[{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-2-imidazoline (delta mass: 27.9972 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.089,"smiles":null,"spectrum_id":"CCMSLIB00017209333","spectrum_index":0},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Acetyloxy)lanosta-8,24-dien-21-oic acid (delta mass: 82.0783 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.456,"smiles":null,"spectrum_id":"CCMSLIB00017209334","spectrum_index":1},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 116.0948 Da; putative annotation: N/A; putative formula: C5H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.165,"smiles":null,"spectrum_id":"CCMSLIB00017209335","spectrum_index":2},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 392.2329 Da; putative annotation: N/A; putative formula: C19H37O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.449,"smiles":null,"spectrum_id":"CCMSLIB00017209336","spectrum_index":3},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C9:0 (delta mass: 227.2254 Da; putative annotation: N/A; putative formula: C14H29NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.432,"smiles":null,"spectrum_id":"CCMSLIB00017209337","spectrum_index":4},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 301.1674 Da; putative annotation: N/A; putative formula: C18H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.259,"smiles":null,"spectrum_id":"CCMSLIB00017209338","spectrum_index":5},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of deoxycholic acid (delta mass: 338.2629 Da; putative annotation: N/A; putative formula: C17H34N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.563,"smiles":null,"spectrum_id":"CCMSLIB00017209339","spectrum_index":6},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 330.2592 Da; putative annotation: N/A; putative formula: C19H38O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.387,"smiles":null,"spectrum_id":"CCMSLIB00017209340","spectrum_index":7},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 485.1168 Da; putative annotation: N/A; putative formula: C20H23NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.198,"smiles":null,"spectrum_id":"CCMSLIB00017209341","spectrum_index":8},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001048987-01!5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-methoxyphenol\"\" (delta mass: 158.0801 Da; putative annotation: N/A; putative formula: C5H10N4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.25,"smiles":null,"spectrum_id":"CCMSLIB00017209342","spectrum_index":9},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 295.2519 Da; putative annotation: N/A; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.349,"smiles":null,"spectrum_id":"CCMSLIB00017209343","spectrum_index":10},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Tyr (delta mass: 163.0633 Da; putative annotation: DL-o-Tyrosine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.166,"smiles":null,"spectrum_id":"CCMSLIB00017209344","spectrum_index":11},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 154.0992 Da; putative annotation: 8-Oxononanoic acid; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.164,"smiles":null,"spectrum_id":"CCMSLIB00017209345","spectrum_index":12},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid (delta mass: 262.2295 Da; putative annotation: Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.472,"smiles":null,"spectrum_id":"CCMSLIB00017209346","spectrum_index":13},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 280.2397 Da; putative annotation: 8-(3-Octyl-2-oxiranyl)octanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.451,"smiles":null,"spectrum_id":"CCMSLIB00017209347","spectrum_index":14},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 240.1722 Da; putative annotation: Tetradecanedioic acid; putative formula: C14H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.42,"smiles":null,"spectrum_id":"CCMSLIB00017209348","spectrum_index":15},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 260.2144 Da; putative annotation: Pinolenic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.301,"smiles":null,"spectrum_id":"CCMSLIB00017209349","spectrum_index":16},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 212.1419 Da; putative annotation: 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.353,"smiles":null,"spectrum_id":"CCMSLIB00017209350","spectrum_index":17},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 345.2644 Da; putative annotation: Gly-C20:3; putative formula: C22H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.47,"smiles":null,"spectrum_id":"CCMSLIB00017209351","spectrum_index":18},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 189.0983 Da; putative annotation: N-(3-Methoxypropyl)-9H-purin-6-amine; putative formula: C9H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.174,"smiles":null,"spectrum_id":"CCMSLIB00017209352","spectrum_index":19},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 282.1956 Da; putative annotation: Retinoic acid; putative formula: C20H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.725,"smiles":null,"spectrum_id":"CCMSLIB00017209353","spectrum_index":20},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linalool oxide (delta mass: 198.1261 Da; putative annotation: 2-Hexylpentanedioic acid; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.264,"smiles":null,"spectrum_id":"CCMSLIB00017209354","spectrum_index":21},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 332.2759 Da; putative annotation: 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate; putative formula: C22H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":925.79,"smiles":null,"spectrum_id":"CCMSLIB00017209355","spectrum_index":22},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 350.2459 Da; putative annotation: Spectral Match to 15(S)-15-Methylprostaglandin E1 from NIST14; putative formula: C21H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.473,"smiles":null,"spectrum_id":"CCMSLIB00017209357","spectrum_index":23},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Cholesterol from NIST14 (delta mass: 292.202 Da; putative annotation: (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one; putative formula: C18H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.564,"smiles":null,"spectrum_id":"CCMSLIB00017209358","spectrum_index":24},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Hexadecanoyl-sn-glycerol from NIST14 (delta mass: 280.2405 Da; putative annotation: 8-(3-Octyl-2-oxiranyl)octanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.525,"smiles":null,"spectrum_id":"CCMSLIB00017209360","spectrum_index":25},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 284.2124 Da; putative annotation: 10-Thiastearic acid; putative formula: C17H32OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":877.726,"smiles":null,"spectrum_id":"CCMSLIB00017209361","spectrum_index":26},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(8Z,11Z,14Z-Eicosatrienoyl)ethanolamine (delta mass: 108.0941 Da; putative annotation: Bicyclo[2.2.1]heptane-2-methanol; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.4,"smiles":null,"spectrum_id":"CCMSLIB00017209362","spectrum_index":27},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 104.0264 Da; putative annotation: 4-hydroxybenzaldehyde CollisionEnergy:102040; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.118,"smiles":null,"spectrum_id":"CCMSLIB00017209363","spectrum_index":28},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 159.0669 Da; putative annotation: 2,2-Dimethyl-3,4-dihydro-2H-1,4-benzoxazin-3-one; putative formula: C10H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017209365","spectrum_index":29},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 232.0853 Da; putative annotation: 5-Nitro-2-(1-piperidinyl)benzoic acid; putative formula: C12H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.177,"smiles":null,"spectrum_id":"CCMSLIB00017209366","spectrum_index":30},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 84.0644 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.15,"smiles":null,"spectrum_id":"CCMSLIB00017209367","spectrum_index":31},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 93.0544 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.26,"smiles":null,"spectrum_id":"CCMSLIB00017209368","spectrum_index":32},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 565.4615 Da; putative annotation: N/A; putative formula: C36H59N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.648,"smiles":null,"spectrum_id":"CCMSLIB00017209369","spectrum_index":33},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 118.0417 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.091,"smiles":null,"spectrum_id":"CCMSLIB00017209370","spectrum_index":34},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 97.0521 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.128,"smiles":null,"spectrum_id":"CCMSLIB00017209371","spectrum_index":35},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Gln (delta mass: 143.0566 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.16,"smiles":null,"spectrum_id":"CCMSLIB00017209372","spectrum_index":36},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16.alpha.-Hydroxyprogesterone (delta mass: 158.0189 Da; putative annotation: N/A; putative formula: C2H2N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.246,"smiles":null,"spectrum_id":"CCMSLIB00017209373","spectrum_index":37},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 377.2071 Da; putative annotation: N/A; putative formula: C19H31N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.278,"smiles":null,"spectrum_id":"CCMSLIB00017209374","spectrum_index":38},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anabasine (delta mass: 326.2083 Da; putative annotation: N/A; putative formula: C15H22N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.331,"smiles":null,"spectrum_id":"CCMSLIB00017209375","spectrum_index":39},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 24.0003 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.113,"smiles":null,"spectrum_id":"CCMSLIB00017209376","spectrum_index":40},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 168.8902 Da; putative annotation: N/A; putative formula: H-1N3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.049,"smiles":null,"spectrum_id":"CCMSLIB00017209377","spectrum_index":41},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 55.0545 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.125,"smiles":null,"spectrum_id":"CCMSLIB00017209378","spectrum_index":42},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 256.0989 Da; putative annotation: N/A; putative formula: C12H13N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.307,"smiles":null,"spectrum_id":"CCMSLIB00017209380","spectrum_index":43},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ335605 N-Nitrosopiperazine (NPAZ)|1-nitrosopiperazine (delta mass: 25.0567 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.139,"smiles":null,"spectrum_id":"CCMSLIB00017209381","spectrum_index":44},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-.alpha.-Tocopherol (delta mass: 193.0581 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.446,"smiles":null,"spectrum_id":"CCMSLIB00017209382","spectrum_index":45},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetramethylcyclopropane-1-carboxylic acid (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.133,"smiles":null,"spectrum_id":"CCMSLIB00017209384","spectrum_index":46},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 322.2876 Da; putative annotation: N/A; putative formula: C21H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.535,"smiles":null,"spectrum_id":"CCMSLIB00017209385","spectrum_index":47},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Putative (3-hydroxyhexadecanoyl)glycine (aka Commendamide) (delta mass: 267.2558 Da; putative annotation: N/A; putative formula: C17H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.52,"smiles":null,"spectrum_id":"CCMSLIB00017209386","spectrum_index":48},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 33.0941 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.149,"smiles":null,"spectrum_id":"CCMSLIB00017209387","spectrum_index":49},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 91.0432 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.12,"smiles":null,"spectrum_id":"CCMSLIB00017209388","spectrum_index":50},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 548.3202 Da; putative annotation: N/A; putative formula: C30H49N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":729.391,"smiles":null,"spectrum_id":"CCMSLIB00017209389","spectrum_index":51},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 248.09 Da; putative annotation: N/A; putative formula: C13H17N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.186,"smiles":null,"spectrum_id":"CCMSLIB00017209390","spectrum_index":52},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycoursodeoxycholic acid (delta mass: 116.0899 Da; putative annotation: N/A; putative formula: CH8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.411,"smiles":null,"spectrum_id":"CCMSLIB00017209391","spectrum_index":53},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 70.0424 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.243,"smiles":null,"spectrum_id":"CCMSLIB00017209392","spectrum_index":54},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,16-Dimethylprostaglandin A1 (delta mass: 62.0524 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017209393","spectrum_index":55},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-methoxybenzoic acid (delta mass: 97.0196 Da; putative annotation: N/A; putative formula: C3H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.085,"smiles":null,"spectrum_id":"CCMSLIB00017209394","spectrum_index":56},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 163.4674 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.538,"smiles":null,"spectrum_id":"CCMSLIB00017209395","spectrum_index":57},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 229.2269 Da; putative annotation: N/A; putative formula: C11H27N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.366,"smiles":null,"spectrum_id":"CCMSLIB00017209396","spectrum_index":58},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 136.0528 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.092,"smiles":null,"spectrum_id":"CCMSLIB00017209397","spectrum_index":59},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 188.071 Da; putative annotation: N/A; putative formula: C7H13N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.174,"smiles":null,"spectrum_id":"CCMSLIB00017209398","spectrum_index":60},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310841 LPC 18:3 (delta mass: 32.0272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.351,"smiles":null,"spectrum_id":"CCMSLIB00017209400","spectrum_index":61},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385794-01_C30H46O9_(3beta,5beta)-3-[(2,6-Dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide (delta mass: 78.0179 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.339,"smiles":null,"spectrum_id":"CCMSLIB00017209401","spectrum_index":62},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 94.0792 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.322,"smiles":null,"spectrum_id":"CCMSLIB00017209402","spectrum_index":63},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 59.0486 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.166,"smiles":null,"spectrum_id":"CCMSLIB00017209403","spectrum_index":64},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 408.8708 Da; putative annotation: N/A; putative formula: C12H11NO-1S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.931,"smiles":null,"spectrum_id":"CCMSLIB00017209405","spectrum_index":65},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.253,"smiles":null,"spectrum_id":"CCMSLIB00017209406","spectrum_index":66},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11,14-Eicosadienoic acid (delta mass: 46.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.321,"smiles":null,"spectrum_id":"CCMSLIB00017209408","spectrum_index":67},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 172.1268 Da; putative annotation: N/A; putative formula: C13H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.464,"smiles":null,"spectrum_id":"CCMSLIB00017209409","spectrum_index":68},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 50.0 eV (delta mass: 29.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.14,"smiles":null,"spectrum_id":"CCMSLIB00017209410","spectrum_index":69},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyoleylcarnitine (delta mass: 66.0065 Da; putative annotation: N/A; putative formula: H-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.359,"smiles":null,"spectrum_id":"CCMSLIB00017209412","spectrum_index":70},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311078 Coumaroyl putrescin (delta mass: 301.1959 Da; putative annotation: N/A; putative formula: C19H28NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.34,"smiles":null,"spectrum_id":"CCMSLIB00017209413","spectrum_index":71},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 264.1471 Da; putative annotation: N/A; putative formula: C14H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.302,"smiles":null,"spectrum_id":"CCMSLIB00017209414","spectrum_index":72},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Resorcinol (delta mass: 60.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.102,"smiles":null,"spectrum_id":"CCMSLIB00017209415","spectrum_index":73},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 444.1405 Da; putative annotation: N/A; putative formula: C28H28O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.195,"smiles":null,"spectrum_id":"CCMSLIB00017209417","spectrum_index":74},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 64.9137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017209419","spectrum_index":75},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 327.0981 Da; putative annotation: N/A; putative formula: C16H9N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.2,"smiles":null,"spectrum_id":"CCMSLIB00017209420","spectrum_index":76},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 324.2708 Da; putative annotation: N/A; putative formula: C18H36N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.336,"smiles":null,"spectrum_id":"CCMSLIB00017209421","spectrum_index":77},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 649.5332 Da; putative annotation: N/A; putative formula: C45H67N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.76,"smiles":null,"spectrum_id":"CCMSLIB00017209422","spectrum_index":78},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 72.0127 Da; putative annotation: N/A; putative formula: C3H5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.083,"smiles":null,"spectrum_id":"CCMSLIB00017209423","spectrum_index":79},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 104.0616 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.299,"smiles":null,"spectrum_id":"CCMSLIB00017209424","spectrum_index":80},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 338.1198 Da; putative annotation: N/A; putative formula: C18H26S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.211,"smiles":null,"spectrum_id":"CCMSLIB00017209425","spectrum_index":81},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 323.1837 Da; putative annotation: N/A; putative formula: C18H30NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.249,"smiles":null,"spectrum_id":"CCMSLIB00017209426","spectrum_index":82},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 693.5557 Da; putative annotation: N/A; putative formula: C42H71N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":970.772,"smiles":null,"spectrum_id":"CCMSLIB00017209427","spectrum_index":83},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 62.0159 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.139,"smiles":null,"spectrum_id":"CCMSLIB00017209428","spectrum_index":84},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Erucamide (delta mass: 92.0673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.409,"smiles":null,"spectrum_id":"CCMSLIB00017209429","spectrum_index":85},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 43.8826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.979,"smiles":null,"spectrum_id":"CCMSLIB00017209430","spectrum_index":86},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.133,"smiles":null,"spectrum_id":"CCMSLIB00017209431","spectrum_index":87},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (delta mass: 121.0093 Da; putative annotation: N/A; putative formula: C5H3N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.098,"smiles":null,"spectrum_id":"CCMSLIB00017209432","spectrum_index":88},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 86.0179 Da; putative annotation: N/A; putative formula: C4H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.375,"smiles":null,"spectrum_id":"CCMSLIB00017209433","spectrum_index":89},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 126.068 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.347,"smiles":null,"spectrum_id":"CCMSLIB00017209434","spectrum_index":90},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Echinocystic acid (delta mass: 128.0275 Da; putative annotation: N/A; putative formula: C2H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.39,"smiles":null,"spectrum_id":"CCMSLIB00017209435","spectrum_index":91},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 88.0655 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.168,"smiles":null,"spectrum_id":"CCMSLIB00017209436","spectrum_index":92},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 80.9874 Da; putative annotation: N/A; putative formula: C2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.214,"smiles":null,"spectrum_id":"CCMSLIB00017209437","spectrum_index":93},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 10.0858 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.135,"smiles":null,"spectrum_id":"CCMSLIB00017209438","spectrum_index":94},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 613.524 Da; putative annotation: N/A; putative formula: C43H67NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.74,"smiles":null,"spectrum_id":"CCMSLIB00017209442","spectrum_index":95},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369606 Salicylic acid|2-hydroxybenzoic acid (delta mass: 111.1386 Da; putative annotation: N/A; putative formula: C8H17NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.178,"smiles":null,"spectrum_id":"CCMSLIB00017209443","spectrum_index":96},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 162.0527 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.197,"smiles":null,"spectrum_id":"CCMSLIB00017209444","spectrum_index":97},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169964-06!4-[2-(3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl]piperidine-2,6-dione (delta mass: 15.9346 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.105,"smiles":null,"spectrum_id":"CCMSLIB00017209445","spectrum_index":98},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 312.2288 Da; putative annotation: N/A; putative formula: C18H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.44,"smiles":null,"spectrum_id":"CCMSLIB00017209446","spectrum_index":99},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corynoline (delta mass: 209.1061 Da; putative annotation: N/A; putative formula: C12H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.255,"smiles":null,"spectrum_id":"CCMSLIB00017209447","spectrum_index":100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 67.0633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.321,"smiles":null,"spectrum_id":"CCMSLIB00017209448","spectrum_index":101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 322.2868 Da; putative annotation: N/A; putative formula: C21H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.571,"smiles":null,"spectrum_id":"CCMSLIB00017209449","spectrum_index":102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 127.0625 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.321,"smiles":null,"spectrum_id":"CCMSLIB00017209450","spectrum_index":103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 138.0833 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.43,"smiles":null,"spectrum_id":"CCMSLIB00017209451","spectrum_index":104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-serine (delta mass: 212.1779 Da; putative annotation: N/A; putative formula: C13H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.243,"smiles":null,"spectrum_id":"CCMSLIB00017209452","spectrum_index":105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 230.1157 Da; putative annotation: N/A; putative formula: C11H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.244,"smiles":null,"spectrum_id":"CCMSLIB00017209453","spectrum_index":106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 534.2691 Da; putative annotation: N/A; putative formula: C26H38N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.334,"smiles":null,"spectrum_id":"CCMSLIB00017209454","spectrum_index":107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[5-[[4-[5-[acetyl(hydroxy)amino]pentylamino]-4-oxobutanoyl]-hydroxyamino]pentylamino]-4-oxobutanoic acid (delta mass: 143.0944 Da; putative annotation: N/A; putative formula: C7H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.355,"smiles":null,"spectrum_id":"CCMSLIB00017209455","spectrum_index":108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2,7-Dihydroxy-6-methylheptan-2-yl)-3-hydroxybenzoic acid (delta mass: 327.2125 Da; putative annotation: N/A; putative formula: C12H25N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.367,"smiles":null,"spectrum_id":"CCMSLIB00017209456","spectrum_index":109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 565.486 Da; putative annotation: N/A; putative formula: C38H63NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":920.77,"smiles":null,"spectrum_id":"CCMSLIB00017209457","spectrum_index":110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gln (delta mass: 150.017 Da; putative annotation: N/A; putative formula: C5H10OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.136,"smiles":null,"spectrum_id":"CCMSLIB00017209458","spectrum_index":111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 143.891 Da; putative annotation: N/A; putative formula: HOPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.988,"smiles":null,"spectrum_id":"CCMSLIB00017209460","spectrum_index":112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.195,"smiles":null,"spectrum_id":"CCMSLIB00017209462","spectrum_index":113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 147.0526 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.176,"smiles":null,"spectrum_id":"CCMSLIB00017209464","spectrum_index":114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE (delta mass: 23.9745 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.061,"smiles":null,"spectrum_id":"CCMSLIB00017209465","spectrum_index":115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 414.0548 Da; putative annotation: N/A; putative formula: C20H12N6OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.125,"smiles":null,"spectrum_id":"CCMSLIB00017209466","spectrum_index":116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 296.0511 Da; putative annotation: N/A; putative formula: C11H15N4P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.189,"smiles":null,"spectrum_id":"CCMSLIB00017209467","spectrum_index":117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 241.113 Da; putative annotation: N/A; putative formula: C14H16N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.168,"smiles":null,"spectrum_id":"CCMSLIB00017209468","spectrum_index":118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 264.1581 Da; putative annotation: N/A; putative formula: C13H20N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.401,"smiles":null,"spectrum_id":"CCMSLIB00017209469","spectrum_index":119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 677.5069 Da; putative annotation: N/A; putative formula: C49H63N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":858.578,"smiles":null,"spectrum_id":"CCMSLIB00017209470","spectrum_index":120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 325.0842 Da; putative annotation: N/A; putative formula: C14H12N7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.15,"smiles":null,"spectrum_id":"CCMSLIB00017209471","spectrum_index":121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 124.0886 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017209472","spectrum_index":122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 128.1055 Da; putative annotation: N/A; putative formula: C5H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.353,"smiles":null,"spectrum_id":"CCMSLIB00017209473","spectrum_index":123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 87.0315 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017209474","spectrum_index":124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 238.009 Da; putative annotation: N/A; putative formula: C7H14N2O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.199,"smiles":null,"spectrum_id":"CCMSLIB00017209475","spectrum_index":125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetraethylene glycol monomethyl ether (delta mass: 62.0116 Da; putative annotation: N/A; putative formula: H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.15,"smiles":null,"spectrum_id":"CCMSLIB00017209476","spectrum_index":126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 227.2616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.515,"smiles":null,"spectrum_id":"CCMSLIB00017209477","spectrum_index":127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 512.3846 Da; putative annotation: N/A; putative formula: C37H52O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.648,"smiles":null,"spectrum_id":"CCMSLIB00017209478","spectrum_index":128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-8-Methyl-6-nonenoic acid (delta mass: 74.0371 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.175,"smiles":null,"spectrum_id":"CCMSLIB00017209479","spectrum_index":129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(prolyltyrosyl) (delta mass: 45.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.181,"smiles":null,"spectrum_id":"CCMSLIB00017209480","spectrum_index":130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 58.0094 Da; putative annotation: N/A; putative formula: CH3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.08,"smiles":null,"spectrum_id":"CCMSLIB00017209481","spectrum_index":131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 197.0899 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.243,"smiles":null,"spectrum_id":"CCMSLIB00017209485","spectrum_index":132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.17,"smiles":null,"spectrum_id":"CCMSLIB00017209486","spectrum_index":133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1036.7416 Da; putative annotation: N/A; putative formula: C56H96N10O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1258.84,"smiles":null,"spectrum_id":"CCMSLIB00017209487","spectrum_index":134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 375.0946 Da; putative annotation: N/A; putative formula: C12H18N5O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.165,"smiles":null,"spectrum_id":"CCMSLIB00017209488","spectrum_index":135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannose 6-phosphate (delta mass: 342.2757 Da; putative annotation: N/A; putative formula: C2H26N22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.313,"smiles":null,"spectrum_id":"CCMSLIB00017209489","spectrum_index":136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austinoneol (delta mass: 45.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.27,"smiles":null,"spectrum_id":"CCMSLIB00017209490","spectrum_index":137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 22.8828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.969,"smiles":null,"spectrum_id":"CCMSLIB00017209491","spectrum_index":138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-hydroxy-4-methoxybenzoate (delta mass: 148.0529 Da; putative annotation: N/A; putative formula: C2H8N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.118,"smiles":null,"spectrum_id":"CCMSLIB00017209492","spectrum_index":139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 102.0831 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017209493","spectrum_index":140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 340.1283 Da; putative annotation: N/A; putative formula: C16H16N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.231,"smiles":null,"spectrum_id":"CCMSLIB00017209497","spectrum_index":141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,17,20,23,26,29-Dotriacontahexaenoic acid, (14Z,17Z,20Z,23Z,26Z,29Z)- (delta mass: 112.0776 Da; putative annotation: N/A; putative formula: C4H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.482,"smiles":null,"spectrum_id":"CCMSLIB00017209498","spectrum_index":142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 80.0638 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.348,"smiles":null,"spectrum_id":"CCMSLIB00017209499","spectrum_index":143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304041 p-Coumaraldehyde (delta mass: 102.0316 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.091,"smiles":null,"spectrum_id":"CCMSLIB00017209500","spectrum_index":144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 921.5231 Da; putative annotation: N/A; putative formula: C44H79N3O15S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1102.59,"smiles":null,"spectrum_id":"CCMSLIB00017209501","spectrum_index":145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 143.0948 Da; putative annotation: N/A; putative formula: C7H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.165,"smiles":null,"spectrum_id":"CCMSLIB00017209502","spectrum_index":146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 82.0517 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.123,"smiles":null,"spectrum_id":"CCMSLIB00017209503","spectrum_index":147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Di-.gamma.-linolenin (6c,9c,12c) from NIST14 (delta mass: 313.2604 Da; putative annotation: N/A; putative formula: C18H35NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.743,"smiles":null,"spectrum_id":"CCMSLIB00017209504","spectrum_index":148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chloro-1H-indol-3-yl)acetic acid (delta mass: 167.0843 Da; putative annotation: N/A; putative formula: C11H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.116,"smiles":null,"spectrum_id":"CCMSLIB00017209505","spectrum_index":149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 17.0271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.098,"smiles":null,"spectrum_id":"CCMSLIB00017209506","spectrum_index":150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 45.023 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.115,"smiles":null,"spectrum_id":"CCMSLIB00017209507","spectrum_index":151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desmethylsildenafil (delta mass: 428.3624 Da; putative annotation: N/A; putative formula: C25H52N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":889.559,"smiles":null,"spectrum_id":"CCMSLIB00017209508","spectrum_index":152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 142.0996 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.217,"smiles":null,"spectrum_id":"CCMSLIB00017209509","spectrum_index":153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 209.0697 Da; putative annotation: N/A; putative formula: C11H15NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.192,"smiles":null,"spectrum_id":"CCMSLIB00017209510","spectrum_index":154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxycinnamic acid (delta mass: 232.1448 Da; putative annotation: N/A; putative formula: C9H21N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.21,"smiles":null,"spectrum_id":"CCMSLIB00017209511","spectrum_index":155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.164,"smiles":null,"spectrum_id":"CCMSLIB00017209512","spectrum_index":156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-1-Benzopyran-2-one, 8-(1,2-dihydroxy-3-methyl-3-buten-1-yl)-7-methoxy- (delta mass: 129.1153 Da; putative annotation: N/A; putative formula: C7H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.222,"smiles":null,"spectrum_id":"CCMSLIB00017209514","spectrum_index":157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,3-Tetramethylbicyclo[2.2.1]heptan-2-ol (delta mass: 144.1157 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.274,"smiles":null,"spectrum_id":"CCMSLIB00017209516","spectrum_index":158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-8,11,14-Eicosatrienoic acid from NIST14 (delta mass: 64.0162 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.279,"smiles":null,"spectrum_id":"CCMSLIB00017209517","spectrum_index":159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terephthalic acid (delta mass: 10.0661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017209519","spectrum_index":160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Skatole - 40.0 eV (delta mass: 55.9792 Da; putative annotation: N/A; putative formula: C2HP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.06,"smiles":null,"spectrum_id":"CCMSLIB00017209520","spectrum_index":161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butylthiourea (delta mass: 57.0658 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.145,"smiles":null,"spectrum_id":"CCMSLIB00017209521","spectrum_index":162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MMV026313 (delta mass: 32.0364 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.134,"smiles":null,"spectrum_id":"CCMSLIB00017209522","spectrum_index":163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 176.0544 Da; putative annotation: N/A; putative formula: C4H8N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.135,"smiles":null,"spectrum_id":"CCMSLIB00017209523","spectrum_index":164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 345.1688 Da; putative annotation: N/A; putative formula: C18H23N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.26,"smiles":null,"spectrum_id":"CCMSLIB00017209524","spectrum_index":165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norharmane (delta mass: 27.9909 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.067,"smiles":null,"spectrum_id":"CCMSLIB00017209525","spectrum_index":166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 233.1631 Da; putative annotation: N/A; putative formula: C11H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.306,"smiles":null,"spectrum_id":"CCMSLIB00017209526","spectrum_index":167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 397.3191 Da; putative annotation: N/A; putative formula: C23H43NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.39,"smiles":null,"spectrum_id":"CCMSLIB00017209527","spectrum_index":168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 535.3346 Da; putative annotation: N/A; putative formula: C31H45N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.399,"smiles":null,"spectrum_id":"CCMSLIB00017209528","spectrum_index":169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 186.1259 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.197,"smiles":null,"spectrum_id":"CCMSLIB00017209529","spectrum_index":170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nonen-1-ol, (Z)- (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.206,"smiles":null,"spectrum_id":"CCMSLIB00017209530","spectrum_index":171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-ol (delta mass: 63.9985 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.199,"smiles":null,"spectrum_id":"CCMSLIB00017209531","spectrum_index":172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 102.0681 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.166,"smiles":null,"spectrum_id":"CCMSLIB00017209532","spectrum_index":173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[(5aS,9R,9aR)-7-Hydroxy-8-(2-hydroxypropan-2-yl)-11-methoxy-4,5a,9-trimethyl-1-oxo-3,6,7,8,9a,10-hexahydro-[2]benzofuro[5,6-b]chromen-9-yl]propanoic acid (delta mass: 69.0272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.26,"smiles":null,"spectrum_id":"CCMSLIB00017209533","spectrum_index":174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-hydroxyquinoline (delta mass: 11.0245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.085,"smiles":null,"spectrum_id":"CCMSLIB00017209534","spectrum_index":175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 177.08 Da; putative annotation: N/A; putative formula: C3H11N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.135,"smiles":null,"spectrum_id":"CCMSLIB00017209535","spectrum_index":176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-3-pyrrolidin-1-yl-1H-pyrazole-4-carbonitrile (delta mass: 40.0313 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.14,"smiles":null,"spectrum_id":"CCMSLIB00017209536","spectrum_index":177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 61.9815 Da; putative annotation: N/A; putative formula: CH2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.036,"smiles":null,"spectrum_id":"CCMSLIB00017209537","spectrum_index":178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 167.0584 Da; putative annotation: N/A; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.208,"smiles":null,"spectrum_id":"CCMSLIB00017209538","spectrum_index":179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 392.1241 Da; putative annotation: N/A; putative formula: C12H16N12O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.215,"smiles":null,"spectrum_id":"CCMSLIB00017209539","spectrum_index":180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 17.8915 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.081,"smiles":null,"spectrum_id":"CCMSLIB00017209540","spectrum_index":181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 99.5584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.65,"smiles":null,"spectrum_id":"CCMSLIB00017209541","spectrum_index":182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 30.0483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.119,"smiles":null,"spectrum_id":"CCMSLIB00017209542","spectrum_index":183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 192.0443 Da; putative annotation: N/A; putative formula: C10H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.088,"smiles":null,"spectrum_id":"CCMSLIB00017209543","spectrum_index":184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 112.0513 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.085,"smiles":null,"spectrum_id":"CCMSLIB00017209545","spectrum_index":185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 241.112 Da; putative annotation: N/A; putative formula: C8H15N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.209,"smiles":null,"spectrum_id":"CCMSLIB00017209546","spectrum_index":186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 101.0833 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.159,"smiles":null,"spectrum_id":"CCMSLIB00017209548","spectrum_index":187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 220.1311 Da; putative annotation: N/A; putative formula: C10H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.222,"smiles":null,"spectrum_id":"CCMSLIB00017209550","spectrum_index":188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 81.0253 Da; putative annotation: N/A; putative formula: C4H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.273,"smiles":null,"spectrum_id":"CCMSLIB00017209551","spectrum_index":189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 134.1098 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017209552","spectrum_index":190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1,2,3,4-tetrahydroquinoline (delta mass: 9.9932 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.105,"smiles":null,"spectrum_id":"CCMSLIB00017209553","spectrum_index":191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 24.0661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.126,"smiles":null,"spectrum_id":"CCMSLIB00017209554","spectrum_index":192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 76.9903 Da; putative annotation: N/A; putative formula: C4H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.097,"smiles":null,"spectrum_id":"CCMSLIB00017209555","spectrum_index":193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 394.1781 Da; putative annotation: N/A; putative formula: C24H26O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.311,"smiles":null,"spectrum_id":"CCMSLIB00017209556","spectrum_index":194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 96.0564 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.132,"smiles":null,"spectrum_id":"CCMSLIB00017209557","spectrum_index":195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Deoxy-9-methyleneprostaglandin E2 (delta mass: 667.3426 Da; putative annotation: N/A; putative formula: C41H50NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1018.6,"smiles":null,"spectrum_id":"CCMSLIB00017209558","spectrum_index":196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 48.0362 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.299,"smiles":null,"spectrum_id":"CCMSLIB00017209559","spectrum_index":197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipalmitolein (9c) (delta mass: 311.2464 Da; putative annotation: N/A; putative formula: C18H33NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":876.729,"smiles":null,"spectrum_id":"CCMSLIB00017209560","spectrum_index":198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 997.6189 Da; putative annotation: N/A; putative formula: C49H91NO19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.69,"smiles":null,"spectrum_id":"CCMSLIB00017209561","spectrum_index":199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 1011.6363 Da; putative annotation: N/A; putative formula: C52H85N9O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1192.71,"smiles":null,"spectrum_id":"CCMSLIB00017209562","spectrum_index":200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 74.0727 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017209563","spectrum_index":201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Oxo-11Z,13E-eicosadienoic acid (delta mass: 88.0514 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.31,"smiles":null,"spectrum_id":"CCMSLIB00017209564","spectrum_index":202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 502.3331 Da; putative annotation: N/A; putative formula: C27H50O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.435,"smiles":null,"spectrum_id":"CCMSLIB00017209565","spectrum_index":203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 279.255 Da; putative annotation: N/A; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.378,"smiles":null,"spectrum_id":"CCMSLIB00017209566","spectrum_index":204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169963-02_C15H26O_(3,3,7-Trimethyltricyclo[5.4.0.0~2,9~]undec-8-yl)methanol (delta mass: 142.1077 Da; putative annotation: N/A; putative formula: C3H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.313,"smiles":null,"spectrum_id":"CCMSLIB00017209567","spectrum_index":205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-8,11,14-Eicosatrienoic acid from NIST14 (delta mass: 239.1009 Da; putative annotation: N/A; putative formula: C11H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.364,"smiles":null,"spectrum_id":"CCMSLIB00017209568","spectrum_index":206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 32.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.112,"smiles":null,"spectrum_id":"CCMSLIB00017209569","spectrum_index":207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Cyclopentyloxy)benzoic acid (delta mass: 98.1095 Da; putative annotation: N/A; putative formula: C7H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017209570","spectrum_index":208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 40.9786 Da; putative annotation: N/A; putative formula: CNO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017209571","spectrum_index":209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 48.8882 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.96,"smiles":null,"spectrum_id":"CCMSLIB00017209573","spectrum_index":210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 118.0167 Da; putative annotation: N/A; putative formula: C6H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.092,"smiles":null,"spectrum_id":"CCMSLIB00017209574","spectrum_index":211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 70.0415 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.138,"smiles":null,"spectrum_id":"CCMSLIB00017209575","spectrum_index":212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 396.2172 Da; putative annotation: N/A; putative formula: C23H24N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.407,"smiles":null,"spectrum_id":"CCMSLIB00017209576","spectrum_index":213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 343.1164 Da; putative annotation: N/A; putative formula: C19H22NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.208,"smiles":null,"spectrum_id":"CCMSLIB00017209578","spectrum_index":214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 262.2295 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.326,"smiles":null,"spectrum_id":"CCMSLIB00017209579","spectrum_index":215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 23.0157 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.201,"smiles":null,"spectrum_id":"CCMSLIB00017209580","spectrum_index":216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10Z,14E)-6,14-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid (delta mass: 45.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.248,"smiles":null,"spectrum_id":"CCMSLIB00017209581","spectrum_index":217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 124.0201 Da; putative annotation: N/A; putative formula: C4H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.247,"smiles":null,"spectrum_id":"CCMSLIB00017209582","spectrum_index":218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 82.0418 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017209583","spectrum_index":219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 163.0794 Da; putative annotation: N/A; putative formula: C5H15N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.229,"smiles":null,"spectrum_id":"CCMSLIB00017209584","spectrum_index":220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 242.0423 Da; putative annotation: N/A; putative formula: C10H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.113,"smiles":null,"spectrum_id":"CCMSLIB00017209585","spectrum_index":221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 541.4538 Da; putative annotation: N/A; putative formula: C33H59N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.514,"smiles":null,"spectrum_id":"CCMSLIB00017209586","spectrum_index":222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 220.1823 Da; putative annotation: N/A; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.295,"smiles":null,"spectrum_id":"CCMSLIB00017209587","spectrum_index":223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Ergothioneine (delta mass: 150.0681 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.164,"smiles":null,"spectrum_id":"CCMSLIB00017209588","spectrum_index":224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 29.9854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.087,"smiles":null,"spectrum_id":"CCMSLIB00017209589","spectrum_index":225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]benzeneethanamine (delta mass: 90.0394 Da; putative annotation: N/A; putative formula: CH6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.176,"smiles":null,"spectrum_id":"CCMSLIB00017209590","spectrum_index":226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 54.0464 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.127,"smiles":null,"spectrum_id":"CCMSLIB00017209591","spectrum_index":227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AGMATINE (delta mass: 455.2062 Da; putative annotation: N/A; putative formula: C25H33N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.335,"smiles":null,"spectrum_id":"CCMSLIB00017209592","spectrum_index":228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1.alpha.,2.alpha.,3.beta.,5.Xi.,9.Xi.,13.Xi.,14.Xi.,18.Xi.)-1,2,3,22,23,29-Hexahydroxy-13,27-cycloolean-11-en-28-oic acid (delta mass: 90.049 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.375,"smiles":null,"spectrum_id":"CCMSLIB00017209593","spectrum_index":229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Pro (delta mass: 97.0538 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.183,"smiles":null,"spectrum_id":"CCMSLIB00017209595","spectrum_index":230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 10.0246 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.106,"smiles":null,"spectrum_id":"CCMSLIB00017209596","spectrum_index":231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 669.2988 Da; putative annotation: N/A; putative formula: C45H39N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.37,"smiles":null,"spectrum_id":"CCMSLIB00017209597","spectrum_index":232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 578.2511 Da; putative annotation: N/A; putative formula: C25H42N2O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.364,"smiles":null,"spectrum_id":"CCMSLIB00017209598","spectrum_index":233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-methoxybenzoic acid (delta mass: 9.9846 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.05,"smiles":null,"spectrum_id":"CCMSLIB00017209599","spectrum_index":234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytisine (delta mass: 71.1121 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.23,"smiles":null,"spectrum_id":"CCMSLIB00017209600","spectrum_index":235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Azepan-1-ylaniline (delta mass: 43.0434 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.198,"smiles":null,"spectrum_id":"CCMSLIB00017209601","spectrum_index":236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 211.0685 Da; putative annotation: N/A; putative formula: C10H15NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.269,"smiles":null,"spectrum_id":"CCMSLIB00017209603","spectrum_index":237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 36.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.284,"smiles":null,"spectrum_id":"CCMSLIB00017209604","spectrum_index":238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 311.2829 Da; putative annotation: N/A; putative formula: C19H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.53,"smiles":null,"spectrum_id":"CCMSLIB00017209605","spectrum_index":239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrophaseic acid (delta mass: 179.0379 Da; putative annotation: N/A; putative formula: C5H5N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.192,"smiles":null,"spectrum_id":"CCMSLIB00017209606","spectrum_index":240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-(-)-Nopol CollisionEnergy:102040 (delta mass: 293.1838 Da; putative annotation: N/A; putative formula: C13H27NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.327,"smiles":null,"spectrum_id":"CCMSLIB00017209608","spectrum_index":241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,10-Bisaboladiene-1,4-diol (delta mass: 36.0361 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.237,"smiles":null,"spectrum_id":"CCMSLIB00017209609","spectrum_index":242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 751.3959 Da; putative annotation: N/A; putative formula: C52H53N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":878.435,"smiles":null,"spectrum_id":"CCMSLIB00017209610","spectrum_index":243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Acetyl-11-keto-.beta.-boswellic acid (delta mass: 120.0995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.457,"smiles":null,"spectrum_id":"CCMSLIB00017209611","spectrum_index":244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 120.0933 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.304,"smiles":null,"spectrum_id":"CCMSLIB00017209612","spectrum_index":245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 104.0839 Da; putative annotation: N/A; putative formula: CH8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.144,"smiles":null,"spectrum_id":"CCMSLIB00017209613","spectrum_index":246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 31.0504 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.137,"smiles":null,"spectrum_id":"CCMSLIB00017209614","spectrum_index":247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 19.0148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.096,"smiles":null,"spectrum_id":"CCMSLIB00017209615","spectrum_index":248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethylsuberosin (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017209616","spectrum_index":249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxybenzoic acid;Veratric acid (delta mass: 60.0204 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017209617","spectrum_index":250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017209618","spectrum_index":251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 114.0434 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.109,"smiles":null,"spectrum_id":"CCMSLIB00017209619","spectrum_index":252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 150.0319 Da; putative annotation: N/A; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.098,"smiles":null,"spectrum_id":"CCMSLIB00017209620","spectrum_index":253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methylquinoline-3-carbaldehyde (delta mass: 15.9984 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.069,"smiles":null,"spectrum_id":"CCMSLIB00017209621","spectrum_index":254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-5Z,9E,11Z,14Z,17Z-eicosapentaenoic acid (delta mass: 49.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.28,"smiles":null,"spectrum_id":"CCMSLIB00017209622","spectrum_index":255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300392 Viridiflorine (delta mass: 321.171 Da; putative annotation: N/A; putative formula: C14H28NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.372,"smiles":null,"spectrum_id":"CCMSLIB00017209623","spectrum_index":256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 157.9996 Da; putative annotation: N/A; putative formula: C3H3N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.08,"smiles":null,"spectrum_id":"CCMSLIB00017209624","spectrum_index":257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 163.0842 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.144,"smiles":null,"spectrum_id":"CCMSLIB00017209625","spectrum_index":258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 123.1263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.337,"smiles":null,"spectrum_id":"CCMSLIB00017209627","spectrum_index":259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Linoleoylglycerol from NIST14 (delta mass: 295.09 Da; putative annotation: N/A; putative formula: C10H17NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.374,"smiles":null,"spectrum_id":"CCMSLIB00017209628","spectrum_index":260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 103.0102 Da; putative annotation: N/A; putative formula: C3H7NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.247,"smiles":null,"spectrum_id":"CCMSLIB00017209629","spectrum_index":261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 293.2344 Da; putative annotation: N/A; putative formula: C18H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.519,"smiles":null,"spectrum_id":"CCMSLIB00017209630","spectrum_index":262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 158.0717 Da; putative annotation: N/A; putative formula: C11H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.147,"smiles":null,"spectrum_id":"CCMSLIB00017209631","spectrum_index":263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 40.0 eV (delta mass: 48.0454 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.132,"smiles":null,"spectrum_id":"CCMSLIB00017209632","spectrum_index":264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 636.6493 Da; putative annotation: N/A; putative formula: C37H80N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1311.89,"smiles":null,"spectrum_id":"CCMSLIB00017209634","spectrum_index":265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 341.14 Da; putative annotation: N/A; putative formula: C17H20N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1170.42,"smiles":null,"spectrum_id":"CCMSLIB00017209635","spectrum_index":266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 479.1831 Da; putative annotation: N/A; putative formula: C21H37NO5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":863.333,"smiles":null,"spectrum_id":"CCMSLIB00017209637","spectrum_index":267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 122.1451 Da; putative annotation: N/A; putative formula: C10H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017209638","spectrum_index":268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 83.0489 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.177,"smiles":null,"spectrum_id":"CCMSLIB00017209639","spectrum_index":269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 5.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.086,"smiles":null,"spectrum_id":"CCMSLIB00017209640","spectrum_index":270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[1-(Hydroxymethyl)-2-(4-nitrophenyl)-2-oxoethyl]acetamide (delta mass: 78.0353 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.117,"smiles":null,"spectrum_id":"CCMSLIB00017209641","spectrum_index":271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017209642","spectrum_index":272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 76.0638 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017209643","spectrum_index":273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 44.0471 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.17,"smiles":null,"spectrum_id":"CCMSLIB00017209644","spectrum_index":274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 264.9902 Da; putative annotation: N/A; putative formula: C8H11NO3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.05,"smiles":null,"spectrum_id":"CCMSLIB00017209645","spectrum_index":275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 427.3814 Da; putative annotation: N/A; putative formula: C29H49NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.571,"smiles":null,"spectrum_id":"CCMSLIB00017209646","spectrum_index":276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid CollisionEnergy:205060 (delta mass: 236.0897 Da; putative annotation: N/A; putative formula: C9H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.353,"smiles":null,"spectrum_id":"CCMSLIB00017209647","spectrum_index":277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 135.1401 Da; putative annotation: N/A; putative formula: C10H17NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.216,"smiles":null,"spectrum_id":"CCMSLIB00017209648","spectrum_index":278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 126.0685 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.15,"smiles":null,"spectrum_id":"CCMSLIB00017209649","spectrum_index":279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Hydroxy-6-ketocholesterol (delta mass: 182.1141 Da; putative annotation: N/A; putative formula: C4H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.466,"smiles":null,"spectrum_id":"CCMSLIB00017209651","spectrum_index":280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Pregnen-3.beta.-ol-20-one (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.3,"smiles":null,"spectrum_id":"CCMSLIB00017209652","spectrum_index":281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-7-carboxylic acid (delta mass: 83.1371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.2,"smiles":null,"spectrum_id":"CCMSLIB00017209653","spectrum_index":282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017209654","spectrum_index":283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 271.2507 Da; putative annotation: N/A; putative formula: C16H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.493,"smiles":null,"spectrum_id":"CCMSLIB00017209655","spectrum_index":284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 295.1417 Da; putative annotation: N/A; putative formula: C15H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.202,"smiles":null,"spectrum_id":"CCMSLIB00017209656","spectrum_index":285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 174.0492 Da; putative annotation: N/A; putative formula: C3H6N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.125,"smiles":null,"spectrum_id":"CCMSLIB00017209657","spectrum_index":286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Sorbitol from NIST14 (delta mass: 106.0517 Da; putative annotation: N/A; putative formula: H7N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.138,"smiles":null,"spectrum_id":"CCMSLIB00017209658","spectrum_index":287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[3-[3-Hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxyphenyl]-5-oxo-2H-furan-2-yl]acetic acid (delta mass: 296.1326 Da; putative annotation: N/A; putative formula: C11H25N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.24,"smiles":null,"spectrum_id":"CCMSLIB00017209659","spectrum_index":288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 63.0322 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.072,"smiles":null,"spectrum_id":"CCMSLIB00017209660","spectrum_index":289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 344.7174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.788,"smiles":null,"spectrum_id":"CCMSLIB00017209662","spectrum_index":290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 293.1835 Da; putative annotation: N/A; putative formula: C13H27NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.244,"smiles":null,"spectrum_id":"CCMSLIB00017209664","spectrum_index":291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 76.0344 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.094,"smiles":null,"spectrum_id":"CCMSLIB00017209665","spectrum_index":292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Phe (delta mass: 23.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.181,"smiles":null,"spectrum_id":"CCMSLIB00017209666","spectrum_index":293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 218.1166 Da; putative annotation: N/A; putative formula: C11H14N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.364,"smiles":null,"spectrum_id":"CCMSLIB00017209667","spectrum_index":294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 136.0834 Da; putative annotation: N/A; putative formula: C5H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.138,"smiles":null,"spectrum_id":"CCMSLIB00017209668","spectrum_index":295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-tridecylpiperidine (delta mass: 340.341 Da; putative annotation: N/A; putative formula: C17H40N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.656,"smiles":null,"spectrum_id":"CCMSLIB00017209669","spectrum_index":296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.113,"smiles":null,"spectrum_id":"CCMSLIB00017209670","spectrum_index":297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 178.1729 Da; putative annotation: N/A; putative formula: C13H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.379,"smiles":null,"spectrum_id":"CCMSLIB00017209671","spectrum_index":298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 35.1111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.25,"smiles":null,"spectrum_id":"CCMSLIB00017209672","spectrum_index":299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 30.4403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017209673","spectrum_index":300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 134.0732 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017209674","spectrum_index":301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 162.0314 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.118,"smiles":null,"spectrum_id":"CCMSLIB00017209675","spectrum_index":302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-1,2,4a,5-Tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 112.0663 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.309,"smiles":null,"spectrum_id":"CCMSLIB00017209676","spectrum_index":303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatin (delta mass: 132.0502 Da; putative annotation: N/A; putative formula: C9H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.137,"smiles":null,"spectrum_id":"CCMSLIB00017209677","spectrum_index":304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 155.0952 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.224,"smiles":null,"spectrum_id":"CCMSLIB00017209678","spectrum_index":305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,19,22,25,28,31-Tetratriacontahexaenoic acid, (all-Z)- (delta mass: 317.1258 Da; putative annotation: N/A; putative formula: C11H20N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.561,"smiles":null,"spectrum_id":"CCMSLIB00017209679","spectrum_index":306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bonactin (delta mass: 200.1051 Da; putative annotation: N/A; putative formula: C10H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.359,"smiles":null,"spectrum_id":"CCMSLIB00017209680","spectrum_index":307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 196.1863 Da; putative annotation: N/A; putative formula: C13H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.278,"smiles":null,"spectrum_id":"CCMSLIB00017209681","spectrum_index":308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 770.1894 Da; putative annotation: N/A; putative formula: C38H34N4O12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1080.3,"smiles":null,"spectrum_id":"CCMSLIB00017209682","spectrum_index":309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 56.012 Da; putative annotation: N/A; putative formula: N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.061,"smiles":null,"spectrum_id":"CCMSLIB00017209684","spectrum_index":310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 106.0416 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.123,"smiles":null,"spectrum_id":"CCMSLIB00017209685","spectrum_index":311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 60.0206 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.226,"smiles":null,"spectrum_id":"CCMSLIB00017209687","spectrum_index":312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3,4-dimethoxybenzoic acid (delta mass: 9.0004 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.061,"smiles":null,"spectrum_id":"CCMSLIB00017209689","spectrum_index":313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1130.9461 Da; putative annotation: N/A; putative formula: C74H130O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1353.04,"smiles":null,"spectrum_id":"CCMSLIB00017209690","spectrum_index":314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Heptynoic acid (delta mass: 27.0182 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.094,"smiles":null,"spectrum_id":"CCMSLIB00017209691","spectrum_index":315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 458.849 Da; putative annotation: N/A; putative formula: C12H4N3O5P3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.94,"smiles":null,"spectrum_id":"CCMSLIB00017209692","spectrum_index":316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 942.4304 Da; putative annotation: N/A; putative formula: C55H62N2O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1105.49,"smiles":null,"spectrum_id":"CCMSLIB00017209693","spectrum_index":317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 143.9375 Da; putative annotation: N/A; putative formula: H2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.998,"smiles":null,"spectrum_id":"CCMSLIB00017209694","spectrum_index":318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 88.0644 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.14,"smiles":null,"spectrum_id":"CCMSLIB00017209695","spectrum_index":319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 428.1187 Da; putative annotation: N/A; putative formula: C27H25O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.215,"smiles":null,"spectrum_id":"CCMSLIB00017209696","spectrum_index":320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 198.1055 Da; putative annotation: N/A; putative formula: C14H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.181,"smiles":null,"spectrum_id":"CCMSLIB00017209697","spectrum_index":321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 149.059 Da; putative annotation: N/A; putative formula: C7H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.145,"smiles":null,"spectrum_id":"CCMSLIB00017209698","spectrum_index":322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 179.0791 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.16,"smiles":null,"spectrum_id":"CCMSLIB00017209699","spectrum_index":323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 230.036 Da; putative annotation: N/A; putative formula: H6N8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.117,"smiles":null,"spectrum_id":"CCMSLIB00017209700","spectrum_index":324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 422.192 Da; putative annotation: N/A; putative formula: C19H30N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.445,"smiles":null,"spectrum_id":"CCMSLIB00017209701","spectrum_index":325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,17-Dihydroxy-7-kauranone (delta mass: 38.0157 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017209702","spectrum_index":326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 92.0629 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.139,"smiles":null,"spectrum_id":"CCMSLIB00017209703","spectrum_index":327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 117.078 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.169,"smiles":null,"spectrum_id":"CCMSLIB00017209704","spectrum_index":328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mangiferin (delta mass: 312.2301 Da; putative annotation: N/A; putative formula: C18H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":735.322,"smiles":null,"spectrum_id":"CCMSLIB00017209705","spectrum_index":329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-.gamma.-Tocopherol (delta mass: 193.0607 Da; putative annotation: N/A; putative formula: C7H7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.433,"smiles":null,"spectrum_id":"CCMSLIB00017209706","spectrum_index":330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 251.1004 Da; putative annotation: N/A; putative formula: C9H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.139,"smiles":null,"spectrum_id":"CCMSLIB00017209707","spectrum_index":331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000066 Salsolinol (delta mass: 198.089 Da; putative annotation: N/A; putative formula: C10H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.191,"smiles":null,"spectrum_id":"CCMSLIB00017209708","spectrum_index":332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 50.0 eV (delta mass: 579.4534 Da; putative annotation: N/A; putative formula: C24H57N11O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.545,"smiles":null,"spectrum_id":"CCMSLIB00017209709","spectrum_index":333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 226.2049 Da; putative annotation: N/A; putative formula: C13H26N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.489,"smiles":null,"spectrum_id":"CCMSLIB00017209710","spectrum_index":334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C12:0 (delta mass: 56.0636 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.27,"smiles":null,"spectrum_id":"CCMSLIB00017209714","spectrum_index":335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 38.0551 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.24,"smiles":null,"spectrum_id":"CCMSLIB00017209715","spectrum_index":336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 49.0533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.301,"smiles":null,"spectrum_id":"CCMSLIB00017209716","spectrum_index":337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 14.016 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.118,"smiles":null,"spectrum_id":"CCMSLIB00017209717","spectrum_index":338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin E (delta mass: 59.1447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.335,"smiles":null,"spectrum_id":"CCMSLIB00017209718","spectrum_index":339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 101.095 Da; putative annotation: N/A; putative formula: C4H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.197,"smiles":null,"spectrum_id":"CCMSLIB00017209719","spectrum_index":340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304024 Enterolactone (delta mass: 244.2069 Da; putative annotation: N/A; putative formula: C13H29N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.335,"smiles":null,"spectrum_id":"CCMSLIB00017209720","spectrum_index":341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 39.9931 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.064,"smiles":null,"spectrum_id":"CCMSLIB00017209721","spectrum_index":342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid CollisionEnergy:102040 (delta mass: 188.0803 Da; putative annotation: N/A; putative formula: C8H16N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.151,"smiles":null,"spectrum_id":"CCMSLIB00017209722","spectrum_index":343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 143.1196 Da; putative annotation: N/A; putative formula: C5H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017209723","spectrum_index":344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 136.219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.305,"smiles":null,"spectrum_id":"CCMSLIB00017209724","spectrum_index":345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 160.0735 Da; putative annotation: N/A; putative formula: C7H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.112,"smiles":null,"spectrum_id":"CCMSLIB00017209725","spectrum_index":346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 94.0086 Da; putative annotation: N/A; putative formula: C4H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.168,"smiles":null,"spectrum_id":"CCMSLIB00017209726","spectrum_index":347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 114.1042 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.242,"smiles":null,"spectrum_id":"CCMSLIB00017209727","spectrum_index":348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 35.0396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.144,"smiles":null,"spectrum_id":"CCMSLIB00017209728","spectrum_index":349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 248.1264 Da; putative annotation: N/A; putative formula: C12H24OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.322,"smiles":null,"spectrum_id":"CCMSLIB00017209729","spectrum_index":350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4aR,5S)-9-Hydroxy-3,4a,5-trimethyl-4,5,6,7,8,8a,9,9a-octahydrobenzo[f][1]benzofuran-2-one (delta mass: 54.0467 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017209730","spectrum_index":351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 266.2977 Da; putative annotation: N/A; putative formula: C19H38)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.545,"smiles":null,"spectrum_id":"CCMSLIB00017209731","spectrum_index":352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 288.0639 Da; putative annotation: N/A; putative formula: C15H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.124,"smiles":null,"spectrum_id":"CCMSLIB00017209732","spectrum_index":353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 88.0674 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017209733","spectrum_index":354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 609.4966 Da; putative annotation: N/A; putative formula: C36H67NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.739,"smiles":null,"spectrum_id":"CCMSLIB00017209734","spectrum_index":355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 657.4809 Da; putative annotation: N/A; putative formula: C41H63N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":934.697,"smiles":null,"spectrum_id":"CCMSLIB00017209736","spectrum_index":356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 42.0101 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.107,"smiles":null,"spectrum_id":"CCMSLIB00017209739","spectrum_index":357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Thienyl)pyrrolidine (delta mass: 23.4315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017209740","spectrum_index":358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Tri(propylene glycol) butyl ether from NIST14 (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.232,"smiles":null,"spectrum_id":"CCMSLIB00017209741","spectrum_index":359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde - 40.0 eV (delta mass: 309.1163 Da; putative annotation: N/A; putative formula: C12H24NO4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.16,"smiles":null,"spectrum_id":"CCMSLIB00017209742","spectrum_index":360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 36.0189 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.147,"smiles":null,"spectrum_id":"CCMSLIB00017209743","spectrum_index":361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentisic acid (delta mass: 54.0661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017209744","spectrum_index":362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 1133.2285 Da; putative annotation: N/A; putative formula: C55H51N5O14S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1355.33,"smiles":null,"spectrum_id":"CCMSLIB00017209745","spectrum_index":363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 17.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.363,"smiles":null,"spectrum_id":"CCMSLIB00017209746","spectrum_index":364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 274.1801 Da; putative annotation: N/A; putative formula: C15H22N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.388,"smiles":null,"spectrum_id":"CCMSLIB00017209747","spectrum_index":365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 70.0648 Da; putative annotation: N/A; putative formula: C2H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.13,"smiles":null,"spectrum_id":"CCMSLIB00017209748","spectrum_index":366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 129.152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.254,"smiles":null,"spectrum_id":"CCMSLIB00017209749","spectrum_index":367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 436.1336 Da; putative annotation: N/A; putative formula: C17H28N2O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.173,"smiles":null,"spectrum_id":"CCMSLIB00017209750","spectrum_index":368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mellein (delta mass: 304.1159 Da; putative annotation: N/A; putative formula: C13H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.186,"smiles":null,"spectrum_id":"CCMSLIB00017209751","spectrum_index":369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 236.1784 Da; putative annotation: N/A; putative formula: C15H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.454,"smiles":null,"spectrum_id":"CCMSLIB00017209752","spectrum_index":370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 293.2735 Da; putative annotation: N/A; putative formula: C19H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.537,"smiles":null,"spectrum_id":"CCMSLIB00017209753","spectrum_index":371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.-Hydroxyetiocholanolone (delta mass: 38.0155 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.242,"smiles":null,"spectrum_id":"CCMSLIB00017209754","spectrum_index":372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 189.944 Da; putative annotation: N/A; putative formula: C3H2N4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.035,"smiles":null,"spectrum_id":"CCMSLIB00017209755","spectrum_index":373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 14.0243 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.091,"smiles":null,"spectrum_id":"CCMSLIB00017209756","spectrum_index":374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 71.0008 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.123,"smiles":null,"spectrum_id":"CCMSLIB00017209757","spectrum_index":375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 122.1141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.325,"smiles":null,"spectrum_id":"CCMSLIB00017209759","spectrum_index":376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 66.0858 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.365,"smiles":null,"spectrum_id":"CCMSLIB00017209761","spectrum_index":377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecan-5-ol (delta mass: 70.0421 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.29,"smiles":null,"spectrum_id":"CCMSLIB00017209763","spectrum_index":378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 199.1713 Da; putative annotation: N/A; putative formula: C15H21NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.258,"smiles":null,"spectrum_id":"CCMSLIB00017209764","spectrum_index":379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Methyl-5.beta.-androstan-3.alpha.,17.beta.-diol (delta mass: 90.0841 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.347,"smiles":null,"spectrum_id":"CCMSLIB00017209765","spectrum_index":380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 298.0667 Da; putative annotation: N/A; putative formula: C10H22N2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.148,"smiles":null,"spectrum_id":"CCMSLIB00017209766","spectrum_index":381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Hydroxybenzoylecgonine (delta mass: 176.0335 Da; putative annotation: N/A; putative formula: C7H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.167,"smiles":null,"spectrum_id":"CCMSLIB00017209767","spectrum_index":382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetylamino-6-amino-3-methyluracil (delta mass: 202.4174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.5,"smiles":null,"spectrum_id":"CCMSLIB00017209768","spectrum_index":383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 24.038 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.117,"smiles":null,"spectrum_id":"CCMSLIB00017209769","spectrum_index":384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 391.2502 Da; putative annotation: N/A; putative formula: C20H34N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.336,"smiles":null,"spectrum_id":"CCMSLIB00017209770","spectrum_index":385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 56.0265 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.29,"smiles":null,"spectrum_id":"CCMSLIB00017209771","spectrum_index":386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 398.1323 Da; putative annotation: N/A; putative formula: C15H10N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.239,"smiles":null,"spectrum_id":"CCMSLIB00017209772","spectrum_index":387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 145.073 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.175,"smiles":null,"spectrum_id":"CCMSLIB00017209773","spectrum_index":388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 191.9921 Da; putative annotation: N/A; putative formula: C6N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.147,"smiles":null,"spectrum_id":"CCMSLIB00017209774","spectrum_index":389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 175.1825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.259,"smiles":null,"spectrum_id":"CCMSLIB00017209775","spectrum_index":390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 100.0981 Da; putative annotation: N/A; putative formula: C5H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.203,"smiles":null,"spectrum_id":"CCMSLIB00017209776","spectrum_index":391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 59.0096 Da; putative annotation: N/A; putative formula: HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.07,"smiles":null,"spectrum_id":"CCMSLIB00017209777","spectrum_index":392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-4-morpholinyl)acetic acid (delta mass: 133.0375 Da; putative annotation: N/A; putative formula: C4H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.098,"smiles":null,"spectrum_id":"CCMSLIB00017209778","spectrum_index":393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DEOXYCHOLIC ACID CollisionEnergy:205060 (delta mass: 59.038 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.338,"smiles":null,"spectrum_id":"CCMSLIB00017209780","spectrum_index":394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 97.9678 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.153,"smiles":null,"spectrum_id":"CCMSLIB00017209781","spectrum_index":395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Formyl-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid (delta mass: 17.033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.13,"smiles":null,"spectrum_id":"CCMSLIB00017209783","spectrum_index":396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 77.0841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.3,"smiles":null,"spectrum_id":"CCMSLIB00017209785","spectrum_index":397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 12.0364 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.086,"smiles":null,"spectrum_id":"CCMSLIB00017209786","spectrum_index":398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1H-Indole-3-carboxylic acid from NIST14 (delta mass: 139.0625 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.117,"smiles":null,"spectrum_id":"CCMSLIB00017209787","spectrum_index":399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 78.0468 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.107,"smiles":null,"spectrum_id":"CCMSLIB00017209788","spectrum_index":400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thymine (delta mass: 141.0536 Da; putative annotation: N/A; putative formula: C5H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.104,"smiles":null,"spectrum_id":"CCMSLIB00017209789","spectrum_index":401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,18.Xi.)-3-Oxolup-20(29)-ene-27,28-dioic acid (delta mass: 168.1298 Da; putative annotation: N/A; putative formula: C14H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.456,"smiles":null,"spectrum_id":"CCMSLIB00017209790","spectrum_index":402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 372.0485 Da; putative annotation: N/A; putative formula: C10H18N2O9P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.109,"smiles":null,"spectrum_id":"CCMSLIB00017209791","spectrum_index":403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.181,"smiles":null,"spectrum_id":"CCMSLIB00017209792","spectrum_index":404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 150.0521 Da; putative annotation: N/A; putative formula: C2H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.154,"smiles":null,"spectrum_id":"CCMSLIB00017209793","spectrum_index":405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 36.0197 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.372,"smiles":null,"spectrum_id":"CCMSLIB00017209794","spectrum_index":406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 130.0779 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.32,"smiles":null,"spectrum_id":"CCMSLIB00017209795","spectrum_index":407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 52.0679 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.164,"smiles":null,"spectrum_id":"CCMSLIB00017209796","spectrum_index":408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 164.0678 Da; putative annotation: D-Sorbitol; putative formula: C6H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.191,"smiles":null,"spectrum_id":"CCMSLIB00017209797","spectrum_index":409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 598.4949 Da; putative annotation: 1,2-Dilinoleoylglycerol; putative formula: C39H66O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":893.722,"smiles":null,"spectrum_id":"CCMSLIB00017209798","spectrum_index":410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 278.2253 Da; putative annotation: (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.447,"smiles":null,"spectrum_id":"CCMSLIB00017209799","spectrum_index":411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 176.0473 Da; putative annotation: 3-Hydroxy-4-methoxycinnamic acid; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.202,"smiles":null,"spectrum_id":"CCMSLIB00017209800","spectrum_index":412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 336.2662 Da; putative annotation: 1-Monolinoleoyl-rac-glycerol; putative formula: C21H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.498,"smiles":null,"spectrum_id":"CCMSLIB00017209801","spectrum_index":413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 260.0846 Da; putative annotation: Met-Glu; putative formula: C10H16N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.185,"smiles":null,"spectrum_id":"CCMSLIB00017209803","spectrum_index":414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 278.2582 Da; putative annotation: Phytomonic acid; putative formula: C19H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.506,"smiles":null,"spectrum_id":"CCMSLIB00017209805","spectrum_index":415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(R)-Hydroxydocosahexaenoic acid (delta mass: 371.2843 Da; putative annotation: Gly-C22:4; putative formula: C24H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.527,"smiles":null,"spectrum_id":"CCMSLIB00017209807","spectrum_index":416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxocholesterol (delta mass: 198.1264 Da; putative annotation: Virginiaebutanolide C; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.468,"smiles":null,"spectrum_id":"CCMSLIB00017209808","spectrum_index":417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of Glucosamine - 30.0 eV (delta mass: 144.0402 Da; putative annotation: \"\"1,6-ANHYDRO-B-GLUCOSE\"\"; putative formula: C6H8O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.127,"smiles":null,"spectrum_id":"CCMSLIB00017209809","spectrum_index":418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 409.2457 Da; putative annotation: Arachidonoyl ethanolamide phosphate; putative formula: C22H36NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.53,"smiles":null,"spectrum_id":"CCMSLIB00017209810","spectrum_index":419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S-Hydroxy-4Z,6E,10Z-hexadecatrienoic acid (delta mass: 266.188 Da; putative annotation: Canangalia H; putative formula: C16H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.383,"smiles":null,"spectrum_id":"CCMSLIB00017209811","spectrum_index":420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 301.2043 Da; putative annotation: PABA-C12:0; putative formula: C19H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.269,"smiles":null,"spectrum_id":"CCMSLIB00017209812","spectrum_index":421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 208.0725 Da; putative annotation: Genipin; putative formula: C11H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.122,"smiles":null,"spectrum_id":"CCMSLIB00017209813","spectrum_index":422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 98.0741 Da; putative annotation: 4-Methylvaleric acid; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.316,"smiles":null,"spectrum_id":"CCMSLIB00017209814","spectrum_index":423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 142.0631 Da; putative annotation: 3,3-Dimethylglutaric acid; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.118,"smiles":null,"spectrum_id":"CCMSLIB00017209815","spectrum_index":424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 16.9981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.23,"smiles":null,"spectrum_id":"CCMSLIB00017209816","spectrum_index":425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 83.0371 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017209817","spectrum_index":426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-TRIHYDROXYBENZOIC ACID\"\" (delta mass: 144.0937 Da; putative annotation: N/A; putative formula: C11H12)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.122,"smiles":null,"spectrum_id":"CCMSLIB00017209818","spectrum_index":427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Methylpentadecanoic acid (delta mass: 54.9838 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.231,"smiles":null,"spectrum_id":"CCMSLIB00017209819","spectrum_index":428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 141.044 Da; putative annotation: N/A; putative formula: C7H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.135,"smiles":null,"spectrum_id":"CCMSLIB00017209820","spectrum_index":429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 279.1106 Da; putative annotation: N/A; putative formula: C9H22N5O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.138,"smiles":null,"spectrum_id":"CCMSLIB00017209821","spectrum_index":430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.122,"smiles":null,"spectrum_id":"CCMSLIB00017209823","spectrum_index":431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 102.089 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.352,"smiles":null,"spectrum_id":"CCMSLIB00017209824","spectrum_index":432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 775.6912 Da; putative annotation: N/A; putative formula: C46H89N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":885.763,"smiles":null,"spectrum_id":"CCMSLIB00017209826","spectrum_index":433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dioleoyl-sn-glycerol (delta mass: 137.0197 Da; putative annotation: N/A; putative formula: CH-1N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.565,"smiles":null,"spectrum_id":"CCMSLIB00017209827","spectrum_index":434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heptaethylene glycol p-tert-octylphenyl ether (delta mass: 56.0617 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.419,"smiles":null,"spectrum_id":"CCMSLIB00017209828","spectrum_index":435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 56.0641 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.291,"smiles":null,"spectrum_id":"CCMSLIB00017209829","spectrum_index":436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 62.0522 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.331,"smiles":null,"spectrum_id":"CCMSLIB00017209830","spectrum_index":437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 252.1678 Da; putative annotation: N/A; putative formula: C7H16N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.354,"smiles":null,"spectrum_id":"CCMSLIB00017209831","spectrum_index":438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 374.0843 Da; putative annotation: N/A; putative formula: C20H24O-1P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.134,"smiles":null,"spectrum_id":"CCMSLIB00017209833","spectrum_index":439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 29.9045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.002,"smiles":null,"spectrum_id":"CCMSLIB00017209834","spectrum_index":440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxydodecanoic acid (delta mass: 36.0369 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.217,"smiles":null,"spectrum_id":"CCMSLIB00017209835","spectrum_index":441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 379.3025 Da; putative annotation: N/A; putative formula: C22H41N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.534,"smiles":null,"spectrum_id":"CCMSLIB00017209836","spectrum_index":442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 27.0477 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017209837","spectrum_index":443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 65.038 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.099,"smiles":null,"spectrum_id":"CCMSLIB00017209838","spectrum_index":444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 591.255 Da; putative annotation: N/A; putative formula: C28H41N5O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.373,"smiles":null,"spectrum_id":"CCMSLIB00017209839","spectrum_index":445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Euscaphic acid (delta mass: 156.1308 Da; putative annotation: N/A; putative formula: C13H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.488,"smiles":null,"spectrum_id":"CCMSLIB00017209840","spectrum_index":446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 262.1416 Da; putative annotation: N/A; putative formula: C12H22O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.202,"smiles":null,"spectrum_id":"CCMSLIB00017209841","spectrum_index":447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 26,27-Dinorcholest-5-en-24-yne-3,20-diol, (3.beta.)- (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017209842","spectrum_index":448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 67.0266 Da; putative annotation: N/A; putative formula: CHN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.394,"smiles":null,"spectrum_id":"CCMSLIB00017209843","spectrum_index":449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 121.0836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.202,"smiles":null,"spectrum_id":"CCMSLIB00017209844","spectrum_index":450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 61.0804 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.199,"smiles":null,"spectrum_id":"CCMSLIB00017209845","spectrum_index":451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethyl-4-hydroxybenzaldehyde (delta mass: 17.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.101,"smiles":null,"spectrum_id":"CCMSLIB00017209846","spectrum_index":452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311082 Dicoumaroyl Spermidine (delta mass: 18.0098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.249,"smiles":null,"spectrum_id":"CCMSLIB00017209848","spectrum_index":453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 10.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017209850","spectrum_index":454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 713.4558 Da; putative annotation: N/A; putative formula: C47H59N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.526,"smiles":null,"spectrum_id":"CCMSLIB00017209852","spectrum_index":455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 83.9008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.039,"smiles":null,"spectrum_id":"CCMSLIB00017209853","spectrum_index":456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 180.0633 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.269,"smiles":null,"spectrum_id":"CCMSLIB00017209854","spectrum_index":457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 280.0886 Da; putative annotation: N/A; putative formula: C21H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.17,"smiles":null,"spectrum_id":"CCMSLIB00017209855","spectrum_index":458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 694.3463 Da; putative annotation: N/A; putative formula: C36H54O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.406,"smiles":null,"spectrum_id":"CCMSLIB00017209856","spectrum_index":459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 281.1098 Da; putative annotation: N/A; putative formula: C7H11N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.185,"smiles":null,"spectrum_id":"CCMSLIB00017209857","spectrum_index":460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 59.0373 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.295,"smiles":null,"spectrum_id":"CCMSLIB00017209858","spectrum_index":461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimelic acid (delta mass: 58.0419 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.123,"smiles":null,"spectrum_id":"CCMSLIB00017209859","spectrum_index":462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Docosenoic acid (delta mass: 110.1108 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.437,"smiles":null,"spectrum_id":"CCMSLIB00017209860","spectrum_index":463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spermine-CDCA (delta mass: 155.143 Da; putative annotation: N/A; putative formula: C8H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.648,"smiles":null,"spectrum_id":"CCMSLIB00017209861","spectrum_index":464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 357.3507 Da; putative annotation: N/A; putative formula: C24H43N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.446,"smiles":null,"spectrum_id":"CCMSLIB00017209862","spectrum_index":465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 327.3158 Da; putative annotation: N/A; putative formula: C19H42N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.563,"smiles":null,"spectrum_id":"CCMSLIB00017209864","spectrum_index":466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heneicosapentaenoic acid (delta mass: 86.0589 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.306,"smiles":null,"spectrum_id":"CCMSLIB00017209865","spectrum_index":467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-METHOXYSALICYLIC ACID (delta mass: 222.0893 Da; putative annotation: N/A; putative formula: C12H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.139,"smiles":null,"spectrum_id":"CCMSLIB00017209866","spectrum_index":468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 383.2822 Da; putative annotation: N/A; putative formula: C25H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.369,"smiles":null,"spectrum_id":"CCMSLIB00017209868","spectrum_index":469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-DIHYDROURACIL (delta mass: 131.0598 Da; putative annotation: N/A; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.11,"smiles":null,"spectrum_id":"CCMSLIB00017209869","spectrum_index":470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyl-DL-serine (delta mass: 44.0045 Da; putative annotation: N/A; putative formula: C5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.07,"smiles":null,"spectrum_id":"CCMSLIB00017209871","spectrum_index":471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monolaurin (delta mass: 16.0302 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.252,"smiles":null,"spectrum_id":"CCMSLIB00017209872","spectrum_index":472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 42.0589 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.161,"smiles":null,"spectrum_id":"CCMSLIB00017209873","spectrum_index":473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 46.1089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.216,"smiles":null,"spectrum_id":"CCMSLIB00017209874","spectrum_index":474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 112.1241 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.258,"smiles":null,"spectrum_id":"CCMSLIB00017209875","spectrum_index":475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 38.027 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.082,"smiles":null,"spectrum_id":"CCMSLIB00017209876","spectrum_index":476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 42.0475 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017209877","spectrum_index":477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 216.0269 Da; putative annotation: N/A; putative formula: C8H8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.129,"smiles":null,"spectrum_id":"CCMSLIB00017209879","spectrum_index":478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,10-Bisaboladiene-1,4-diol (delta mass: 179.0798 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.28,"smiles":null,"spectrum_id":"CCMSLIB00017209880","spectrum_index":479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 328.1671 Da; putative annotation: N/A; putative formula: C20H24O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.357,"smiles":null,"spectrum_id":"CCMSLIB00017209881","spectrum_index":480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 207.1103 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.395,"smiles":null,"spectrum_id":"CCMSLIB00017209882","spectrum_index":481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 38.0817 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.136,"smiles":null,"spectrum_id":"CCMSLIB00017209884","spectrum_index":482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 99.0847 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.15,"smiles":null,"spectrum_id":"CCMSLIB00017209885","spectrum_index":483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 264.5254 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.597,"smiles":null,"spectrum_id":"CCMSLIB00017209886","spectrum_index":484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 269.0972 Da; putative annotation: N/A; putative formula: C16H16NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.152,"smiles":null,"spectrum_id":"CCMSLIB00017209887","spectrum_index":485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 308.0718 Da; putative annotation: N/A; putative formula: C15H16O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.127,"smiles":null,"spectrum_id":"CCMSLIB00017209888","spectrum_index":486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 377.0722 Da; putative annotation: N/A; putative formula: C21H15NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.143,"smiles":null,"spectrum_id":"CCMSLIB00017209889","spectrum_index":487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM823305 Monoisobutyl phthalate|Isobutyl hydrogen phthalate|2-(2-methylpropoxycarbonyl)benzoic acid (delta mass: 28.0671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.164,"smiles":null,"spectrum_id":"CCMSLIB00017209890","spectrum_index":488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 96.0938 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.201,"smiles":null,"spectrum_id":"CCMSLIB00017209891","spectrum_index":489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 184.1203 Da; putative annotation: N/A; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.248,"smiles":null,"spectrum_id":"CCMSLIB00017209893","spectrum_index":490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 356.1001 Da; putative annotation: N/A; putative formula: C10H20N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.244,"smiles":null,"spectrum_id":"CCMSLIB00017209894","spectrum_index":491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 146.0341 Da; putative annotation: N/A; putative formula: C5H2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.25,"smiles":null,"spectrum_id":"CCMSLIB00017209896","spectrum_index":492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 160.0341 Da; putative annotation: N/A; putative formula: C2H4N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.068,"smiles":null,"spectrum_id":"CCMSLIB00017209897","spectrum_index":493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucuronic acid (delta mass: 141.1147 Da; putative annotation: N/A; putative formula: C8H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.165,"smiles":null,"spectrum_id":"CCMSLIB00017209898","spectrum_index":494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 186.1984 Da; putative annotation: N/A; putative formula: C8H22N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.279,"smiles":null,"spectrum_id":"CCMSLIB00017209899","spectrum_index":495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydiethyltryptamine (delta mass: 193.0732 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.238,"smiles":null,"spectrum_id":"CCMSLIB00017209901","spectrum_index":496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 41.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.118,"smiles":null,"spectrum_id":"CCMSLIB00017209902","spectrum_index":497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169031-03![6-(2-formamido-3-methylbutanoyl)oxy-2,3,4,5-tetrahydroxyhexyl] 2-formamido-3-methylbutanoate (delta mass: 453.2258 Da; putative annotation: N/A; putative formula: C17H35N5O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.439,"smiles":null,"spectrum_id":"CCMSLIB00017209903","spectrum_index":498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381021-01!8-(2,4-dihydroxy-6-pentylphenoxy)-6-hydroxy-3-pentylisochromen-1-one (delta mass: 426.1959 Da; putative annotation: N/A; putative formula: C25H31O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.407,"smiles":null,"spectrum_id":"CCMSLIB00017209904","spectrum_index":499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 498.3417 Da; putative annotation: N/A; putative formula: C25H46N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.433,"smiles":null,"spectrum_id":"CCMSLIB00017209905","spectrum_index":500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 128.0481 Da; putative annotation: N/A; putative formula: C7H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.176,"smiles":null,"spectrum_id":"CCMSLIB00017209908","spectrum_index":501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 146.9755 Da; putative annotation: N/A; putative formula: C2H3N3OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.03,"smiles":null,"spectrum_id":"CCMSLIB00017209910","spectrum_index":502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 119.0381 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.098,"smiles":null,"spectrum_id":"CCMSLIB00017209911","spectrum_index":503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 14.0234 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.145,"smiles":null,"spectrum_id":"CCMSLIB00017209912","spectrum_index":504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 162.0481 Da; putative annotation: N/A; putative formula: C5H12N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.181,"smiles":null,"spectrum_id":"CCMSLIB00017209913","spectrum_index":505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-C16:0 (delta mass: 43.0405 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.331,"smiles":null,"spectrum_id":"CCMSLIB00017209914","spectrum_index":506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Enterodiol (delta mass: 176.0301 Da; putative annotation: N/A; putative formula: C3H8N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.189,"smiles":null,"spectrum_id":"CCMSLIB00017209915","spectrum_index":507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 278.0405 Da; putative annotation: N/A; putative formula: C10H18N2O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.095,"smiles":null,"spectrum_id":"CCMSLIB00017209916","spectrum_index":508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 67.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.275,"smiles":null,"spectrum_id":"CCMSLIB00017209917","spectrum_index":509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 63.963 Da; putative annotation: N/A; putative formula: H2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.19,"smiles":null,"spectrum_id":"CCMSLIB00017209918","spectrum_index":510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 529.2719 Da; putative annotation: N/A; putative formula: C29H36N7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.332,"smiles":null,"spectrum_id":"CCMSLIB00017209919","spectrum_index":511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 561.4958 Da; putative annotation: N/A; putative formula: C29H59N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.556,"smiles":null,"spectrum_id":"CCMSLIB00017209921","spectrum_index":512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 408.2862 Da; putative annotation: N/A; putative formula: C21H32N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.502,"smiles":null,"spectrum_id":"CCMSLIB00017209922","spectrum_index":513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 64.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.267,"smiles":null,"spectrum_id":"CCMSLIB00017209924","spectrum_index":514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Formoterol (delta mass: 17.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.217,"smiles":null,"spectrum_id":"CCMSLIB00017209925","spectrum_index":515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 372.121 Da; putative annotation: N/A; putative formula: C20H20O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.173,"smiles":null,"spectrum_id":"CCMSLIB00017209927","spectrum_index":516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 29.0258 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.117,"smiles":null,"spectrum_id":"CCMSLIB00017209928","spectrum_index":517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ADENOSINE 3',5'-DIPHOSPHATE - 40.0 eV (delta mass: 114.48 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.517,"smiles":null,"spectrum_id":"CCMSLIB00017209929","spectrum_index":518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 11.9996 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017209930","spectrum_index":519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 455.2892 Da; putative annotation: N/A; putative formula: C25H45NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.359,"smiles":null,"spectrum_id":"CCMSLIB00017209931","spectrum_index":520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 110.1192 Da; putative annotation: N/A; putative formula: C7H14N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.234,"smiles":null,"spectrum_id":"CCMSLIB00017209932","spectrum_index":521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperazine-2-carbonitrile (delta mass: 41.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.138,"smiles":null,"spectrum_id":"CCMSLIB00017209933","spectrum_index":522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 299.1207 Da; putative annotation: N/A; putative formula: C15H17N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.28,"smiles":null,"spectrum_id":"CCMSLIB00017209934","spectrum_index":523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 319.2077 Da; putative annotation: N/A; putative formula: C18H29N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.249,"smiles":null,"spectrum_id":"CCMSLIB00017209935","spectrum_index":524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 73.052 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.159,"smiles":null,"spectrum_id":"CCMSLIB00017209936","spectrum_index":525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 147.1252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.248,"smiles":null,"spectrum_id":"CCMSLIB00017209937","spectrum_index":526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Lignoceroyl-2-hydroxy-sn-glycero-3-phosphocholine from NIST14 (delta mass: 183.0733 Da; putative annotation: N/A; putative formula: C9H15NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.538,"smiles":null,"spectrum_id":"CCMSLIB00017209938","spectrum_index":527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylcyclohexaneacetic acid (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.138,"smiles":null,"spectrum_id":"CCMSLIB00017209940","spectrum_index":528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 188.0828 Da; putative annotation: N/A; putative formula: C6H13N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.131,"smiles":null,"spectrum_id":"CCMSLIB00017209941","spectrum_index":529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 72.0274 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.114,"smiles":null,"spectrum_id":"CCMSLIB00017209942","spectrum_index":530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperazine (delta mass: 41.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.122,"smiles":null,"spectrum_id":"CCMSLIB00017209943","spectrum_index":531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 17.8982 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.964,"smiles":null,"spectrum_id":"CCMSLIB00017209946","spectrum_index":532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-linoleoyl-rac-glycerol (delta mass: 171.163 Da; putative annotation: N/A; putative formula: C10H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.693,"smiles":null,"spectrum_id":"CCMSLIB00017209947","spectrum_index":533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 237.0938 Da; putative annotation: N/A; putative formula: C11H15N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.31,"smiles":null,"spectrum_id":"CCMSLIB00017209949","spectrum_index":534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 24.0362 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.185,"smiles":null,"spectrum_id":"CCMSLIB00017209950","spectrum_index":535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arsubin (delta mass: 179.0796 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.228,"smiles":null,"spectrum_id":"CCMSLIB00017209951","spectrum_index":536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 36.0129 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.198,"smiles":null,"spectrum_id":"CCMSLIB00017209952","spectrum_index":537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 278.4064 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":887.677,"smiles":null,"spectrum_id":"CCMSLIB00017209953","spectrum_index":538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1-Pyrrolidinylcarbonyl)piperidine (delta mass: 5.0308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.18,"smiles":null,"spectrum_id":"CCMSLIB00017209954","spectrum_index":539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Loliolide (delta mass: 230.1672 Da; putative annotation: N/A; putative formula: C16H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.284,"smiles":null,"spectrum_id":"CCMSLIB00017209955","spectrum_index":540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 26.9398 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.016,"smiles":null,"spectrum_id":"CCMSLIB00017209956","spectrum_index":541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(4-Chlorophenyl)-5-nitro-2-piperidinone (delta mass: 162.0586 Da; putative annotation: N/A; putative formula: C4H12N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.112,"smiles":null,"spectrum_id":"CCMSLIB00017209957","spectrum_index":542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 423.2341 Da; putative annotation: N/A; putative formula: C17H29N9O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.346,"smiles":null,"spectrum_id":"CCMSLIB00017209958","spectrum_index":543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 408.1264 Da; putative annotation: N/A; putative formula: C29H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.187,"smiles":null,"spectrum_id":"CCMSLIB00017209959","spectrum_index":544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 169.2034 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.332,"smiles":null,"spectrum_id":"CCMSLIB00017209960","spectrum_index":545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 104.0626 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.138,"smiles":null,"spectrum_id":"CCMSLIB00017209961","spectrum_index":546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,19-Cyclolanost-25-ene-3,24-diol (delta mass: 59.0359 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.424,"smiles":null,"spectrum_id":"CCMSLIB00017209963","spectrum_index":547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 86.0585 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.27,"smiles":null,"spectrum_id":"CCMSLIB00017209965","spectrum_index":548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 70.0413 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.211,"smiles":null,"spectrum_id":"CCMSLIB00017209966","spectrum_index":549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 214.1319 Da; putative annotation: N/A; putative formula: C10H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.202,"smiles":null,"spectrum_id":"CCMSLIB00017209968","spectrum_index":550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 160.0533 Da; putative annotation: N/A; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.118,"smiles":null,"spectrum_id":"CCMSLIB00017209969","spectrum_index":551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384837-01_C19H32O2_14-(Hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0~1,10~.0~4,9~]hexadecan-5-ol (delta mass: 253.2405 Da; putative annotation: N/A; putative formula: C16H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.488,"smiles":null,"spectrum_id":"CCMSLIB00017209970","spectrum_index":552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 97.0536 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.208,"smiles":null,"spectrum_id":"CCMSLIB00017209971","spectrum_index":553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 228.0306 Da; putative annotation: N/A; putative formula: C6H12O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017209972","spectrum_index":554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 227.2478 Da; putative annotation: N/A; putative formula: C12H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.33,"smiles":null,"spectrum_id":"CCMSLIB00017209973","spectrum_index":555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 216.0424 Da; putative annotation: N/A; putative formula: C12H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.129,"smiles":null,"spectrum_id":"CCMSLIB00017209974","spectrum_index":556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bicyclo[2.2.1]heptane-2-methanol (delta mass: 58.0425 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.154,"smiles":null,"spectrum_id":"CCMSLIB00017209975","spectrum_index":557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 106.0644 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.254,"smiles":null,"spectrum_id":"CCMSLIB00017209976","spectrum_index":558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.119,"smiles":null,"spectrum_id":"CCMSLIB00017209977","spectrum_index":559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-4,8-dimethyl-2H-chromen-2-one (delta mass: 93.0579 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.128,"smiles":null,"spectrum_id":"CCMSLIB00017209978","spectrum_index":560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 178.9868 Da; putative annotation: N/A; putative formula: C8H5NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.234,"smiles":null,"spectrum_id":"CCMSLIB00017209979","spectrum_index":561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 27.9954 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.097,"smiles":null,"spectrum_id":"CCMSLIB00017209980","spectrum_index":562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 17.0285 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.412,"smiles":null,"spectrum_id":"CCMSLIB00017209981","spectrum_index":563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 227.1258 Da; putative annotation: N/A; putative formula: C12H22NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.212,"smiles":null,"spectrum_id":"CCMSLIB00017209982","spectrum_index":564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLIC ACID - 70.00 eV (delta mass: 72.0666 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.122,"smiles":null,"spectrum_id":"CCMSLIB00017209983","spectrum_index":565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-propanoic acid (delta mass: 175.0638 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.15,"smiles":null,"spectrum_id":"CCMSLIB00017209985","spectrum_index":566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 149.0453 Da; putative annotation: N/A; putative formula: C4H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.093,"smiles":null,"spectrum_id":"CCMSLIB00017209987","spectrum_index":567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 140.0116 Da; putative annotation: N/A; putative formula: C7H8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.076,"smiles":null,"spectrum_id":"CCMSLIB00017209989","spectrum_index":568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 148.0741 Da; putative annotation: N/A; putative formula: C6H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.171,"smiles":null,"spectrum_id":"CCMSLIB00017209990","spectrum_index":569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 622.4917 Da; putative annotation: N/A; putative formula: C36H66N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":905.755,"smiles":null,"spectrum_id":"CCMSLIB00017209991","spectrum_index":570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacillaene (delta mass: 179.0791 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.438,"smiles":null,"spectrum_id":"CCMSLIB00017209992","spectrum_index":571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 204.0629 Da; putative annotation: N/A; putative formula: C8H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1177.39,"smiles":null,"spectrum_id":"CCMSLIB00017209993","spectrum_index":572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxysebacic acid (delta mass: 13.0318 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017209994","spectrum_index":573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 55.0664 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.116,"smiles":null,"spectrum_id":"CCMSLIB00017209995","spectrum_index":574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 380.2236 Da; putative annotation: N/A; putative formula: C18H36O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.341,"smiles":null,"spectrum_id":"CCMSLIB00017209996","spectrum_index":575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 398.1974 Da; putative annotation: N/A; putative formula: C17H34O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.315,"smiles":null,"spectrum_id":"CCMSLIB00017209997","spectrum_index":576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 210.9753 Da; putative annotation: N/A; putative formula: C8H5NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.03,"smiles":null,"spectrum_id":"CCMSLIB00017209998","spectrum_index":577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 368.2597 Da; putative annotation: N/A; putative formula: C20H37N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.335,"smiles":null,"spectrum_id":"CCMSLIB00017209999","spectrum_index":578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 88.052 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017210000","spectrum_index":579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 303.1165 Da; putative annotation: N/A; putative formula: C22H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.176,"smiles":null,"spectrum_id":"CCMSLIB00017210002","spectrum_index":580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa (delta mass: 202.12 Da; putative annotation: N/A; putative formula: C10H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.196,"smiles":null,"spectrum_id":"CCMSLIB00017210003","spectrum_index":581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 224.1159 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.202,"smiles":null,"spectrum_id":"CCMSLIB00017210006","spectrum_index":582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthalene-1,8-dicarboxylic acid (delta mass: 27.9937 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.043,"smiles":null,"spectrum_id":"CCMSLIB00017210007","spectrum_index":583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 211.1421 Da; putative annotation: N/A; putative formula: C9H17N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.405,"smiles":null,"spectrum_id":"CCMSLIB00017210008","spectrum_index":584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine (delta mass: 88.0158 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.12,"smiles":null,"spectrum_id":"CCMSLIB00017210009","spectrum_index":585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-2-hydroxybenzoic acid (delta mass: 56.0028 Da; putative annotation: N/A; putative formula: CN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.037,"smiles":null,"spectrum_id":"CCMSLIB00017210010","spectrum_index":586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 88.0678 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.143,"smiles":null,"spectrum_id":"CCMSLIB00017210011","spectrum_index":587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 484.2519 Da; putative annotation: N/A; putative formula: C21H40O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.354,"smiles":null,"spectrum_id":"CCMSLIB00017210012","spectrum_index":588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 341.2592 Da; putative annotation: N/A; putative formula: C18H36N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.486,"smiles":null,"spectrum_id":"CCMSLIB00017210013","spectrum_index":589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 552.2427 Da; putative annotation: N/A; putative formula: C25H44O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.303,"smiles":null,"spectrum_id":"CCMSLIB00017210014","spectrum_index":590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Acetyloxy)-3-methylbenzoic acid (delta mass: 30.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.149,"smiles":null,"spectrum_id":"CCMSLIB00017210015","spectrum_index":591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 256.3979 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.469,"smiles":null,"spectrum_id":"CCMSLIB00017210017","spectrum_index":592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017210018","spectrum_index":593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.alpha.-Hydroxystanozolol (delta mass: 17.9992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.253,"smiles":null,"spectrum_id":"CCMSLIB00017210019","spectrum_index":594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 176.0476 Da; putative annotation: N/A; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.075,"smiles":null,"spectrum_id":"CCMSLIB00017210022","spectrum_index":595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 14.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.31,"smiles":null,"spectrum_id":"CCMSLIB00017210023","spectrum_index":596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 170.0408 Da; putative annotation: N/A; putative formula: CH2N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.136,"smiles":null,"spectrum_id":"CCMSLIB00017210024","spectrum_index":597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine-6-glucuronide (delta mass: 18.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.187,"smiles":null,"spectrum_id":"CCMSLIB00017210025","spectrum_index":598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipalmitolein (9c) (delta mass: 267.2554 Da; putative annotation: N/A; putative formula: C17H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.738,"smiles":null,"spectrum_id":"CCMSLIB00017210026","spectrum_index":599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 691.5181 Da; putative annotation: N/A; putative formula: C44H69NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.708,"smiles":null,"spectrum_id":"CCMSLIB00017210027","spectrum_index":600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 336.2452 Da; putative annotation: N/A; putative formula: C24H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.374,"smiles":null,"spectrum_id":"CCMSLIB00017210028","spectrum_index":601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetyl-5-hydroxy-3-methylphenyl .beta.-D-glucopyranoside (delta mass: 35.0359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.159,"smiles":null,"spectrum_id":"CCMSLIB00017210029","spectrum_index":602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Puerol B (delta mass: 162.0525 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.16,"smiles":null,"spectrum_id":"CCMSLIB00017210030","spectrum_index":603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxytyramine (delta mass: 175.0134 Da; putative annotation: N/A; putative formula: C6HN5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.1,"smiles":null,"spectrum_id":"CCMSLIB00017210031","spectrum_index":604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 139.0714 Da; putative annotation: N/A; putative formula: C2H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.184,"smiles":null,"spectrum_id":"CCMSLIB00017210032","spectrum_index":605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 122.0737 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.322,"smiles":null,"spectrum_id":"CCMSLIB00017210034","spectrum_index":606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 37.9793 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.055,"smiles":null,"spectrum_id":"CCMSLIB00017210035","spectrum_index":607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 270.126 Da; putative annotation: N/A; putative formula: C10H18N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.165,"smiles":null,"spectrum_id":"CCMSLIB00017210038","spectrum_index":608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 368.2311 Da; putative annotation: N/A; putative formula: C19H32N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.322,"smiles":null,"spectrum_id":"CCMSLIB00017210039","spectrum_index":609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 154.0038 Da; putative annotation: N/A; putative formula: C4H3N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.293,"smiles":null,"spectrum_id":"CCMSLIB00017210040","spectrum_index":610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 75.0689 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.316,"smiles":null,"spectrum_id":"CCMSLIB00017210041","spectrum_index":611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 70.042 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.326,"smiles":null,"spectrum_id":"CCMSLIB00017210042","spectrum_index":612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 93.0215 Da; putative annotation: N/A; putative formula: C5H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017210043","spectrum_index":613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 88.0519 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.107,"smiles":null,"spectrum_id":"CCMSLIB00017210044","spectrum_index":614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thuggacin A (delta mass: 482.2717 Da; putative annotation: N/A; putative formula: C27H38N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1114.63,"smiles":null,"spectrum_id":"CCMSLIB00017210045","spectrum_index":615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 581.2413 Da; putative annotation: N/A; putative formula: C35H35NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.354,"smiles":null,"spectrum_id":"CCMSLIB00017210046","spectrum_index":616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyquinuclidine-3-carbonitrile (delta mass: 163.1178 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.22,"smiles":null,"spectrum_id":"CCMSLIB00017210047","spectrum_index":617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Phenylalanine (delta mass: 111.0337 Da; putative annotation: N/A; putative formula: C4H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.12,"smiles":null,"spectrum_id":"CCMSLIB00017210048","spectrum_index":618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 685.2733 Da; putative annotation: N/A; putative formula: C35H43NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.339,"smiles":null,"spectrum_id":"CCMSLIB00017210049","spectrum_index":619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 85.0517 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.164,"smiles":null,"spectrum_id":"CCMSLIB00017210050","spectrum_index":620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-hydroxy-1,7-diphenylhept-1-en-3-one (delta mass: 58.0375 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.191,"smiles":null,"spectrum_id":"CCMSLIB00017210053","spectrum_index":621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 124.0891 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017210055","spectrum_index":622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphylloside (delta mass: 180.0436 Da; putative annotation: N/A; putative formula: C10H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.255,"smiles":null,"spectrum_id":"CCMSLIB00017210056","spectrum_index":623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 92.0621 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.399,"smiles":null,"spectrum_id":"CCMSLIB00017210057","spectrum_index":624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-TRIHYDROXYBENZOIC ACID\"\" (delta mass: 174.0525 Da; putative annotation: N/A; putative formula: C7H10O5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.081,"smiles":null,"spectrum_id":"CCMSLIB00017210058","spectrum_index":625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 931.3976 Da; putative annotation: N/A; putative formula: C47H53N11O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1190.52,"smiles":null,"spectrum_id":"CCMSLIB00017210059","spectrum_index":626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phenol, 4-(2-aminoethyl)- from NIST14 (delta mass: 55.0309 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017210060","spectrum_index":627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 17.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.117,"smiles":null,"spectrum_id":"CCMSLIB00017210061","spectrum_index":628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 23.0855 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.102,"smiles":null,"spectrum_id":"CCMSLIB00017210062","spectrum_index":629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 60.0206 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.107,"smiles":null,"spectrum_id":"CCMSLIB00017210063","spectrum_index":630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 42.9434 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.014,"smiles":null,"spectrum_id":"CCMSLIB00017210064","spectrum_index":631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385097-01_C20H22O9_beta-D-Glucopyranoside, 4-hydroxy-2-(hydroxymethyl)phenyl, 6-benzoate (delta mass: 281.1258 Da; putative annotation: N/A; putative formula: C14H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.26,"smiles":null,"spectrum_id":"CCMSLIB00017210065","spectrum_index":632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 243.1942 Da; putative annotation: N/A; putative formula: C12H25N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.266,"smiles":null,"spectrum_id":"CCMSLIB00017210066","spectrum_index":633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 89.0192 Da; putative annotation: N/A; putative formula: CH3N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017210067","spectrum_index":634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Acetaminobenzoic acid (delta mass: 76.051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.116,"smiles":null,"spectrum_id":"CCMSLIB00017210068","spectrum_index":635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine D (delta mass: 302.0844 Da; putative annotation: N/A; putative formula: C22H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.265,"smiles":null,"spectrum_id":"CCMSLIB00017210070","spectrum_index":636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 552.1832 Da; putative annotation: N/A; putative formula: C20H33N4O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.222,"smiles":null,"spectrum_id":"CCMSLIB00017210073","spectrum_index":637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 154.0026 Da; putative annotation: N/A; putative formula: C6H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.308,"smiles":null,"spectrum_id":"CCMSLIB00017210074","spectrum_index":638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 74.0717 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.288,"smiles":null,"spectrum_id":"CCMSLIB00017210075","spectrum_index":639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 130.0993 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.14,"smiles":null,"spectrum_id":"CCMSLIB00017210076","spectrum_index":640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(18)-Epoxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid (delta mass: 66.0463 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.273,"smiles":null,"spectrum_id":"CCMSLIB00017210077","spectrum_index":641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 15.0108 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.077,"smiles":null,"spectrum_id":"CCMSLIB00017210078","spectrum_index":642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 809.288 Da; putative annotation: N/A; putative formula: C38H47N7O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1314.46,"smiles":null,"spectrum_id":"CCMSLIB00017210079","spectrum_index":643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM836003 Indoline|Indoline|2,3-dihydro-1H-indole (delta mass: 102.0317 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017210080","spectrum_index":644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 124.0628 Da; putative annotation: N/A; putative formula: C6H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.123,"smiles":null,"spectrum_id":"CCMSLIB00017210081","spectrum_index":645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP006902 ?-Tauromuricholic acid|2-[4-(3,6,7-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]ethanesulfonic acid (delta mass: 239.2599 Da; putative annotation: N/A; putative formula: C16H33N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.559,"smiles":null,"spectrum_id":"CCMSLIB00017210082","spectrum_index":646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 175.0487 Da; putative annotation: N/A; putative formula: C7H13NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.198,"smiles":null,"spectrum_id":"CCMSLIB00017210083","spectrum_index":647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 40.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.138,"smiles":null,"spectrum_id":"CCMSLIB00017210084","spectrum_index":648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 165.0988 Da; putative annotation: N/A; putative formula: C10H15NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.164,"smiles":null,"spectrum_id":"CCMSLIB00017210085","spectrum_index":649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 348.2396 Da; putative annotation: N/A; putative formula: C22H37O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.353,"smiles":null,"spectrum_id":"CCMSLIB00017210087","spectrum_index":650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 225.0461 Da; putative annotation: N/A; putative formula: C10H11NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.142,"smiles":null,"spectrum_id":"CCMSLIB00017210090","spectrum_index":651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Lys (delta mass: 71.0373 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.224,"smiles":null,"spectrum_id":"CCMSLIB00017210091","spectrum_index":652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 294.1469 Da; putative annotation: N/A; putative formula: C11H19N8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.218,"smiles":null,"spectrum_id":"CCMSLIB00017210092","spectrum_index":653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 64.0538 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.114,"smiles":null,"spectrum_id":"CCMSLIB00017210093","spectrum_index":654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 253.0982 Da; putative annotation: N/A; putative formula: C13H11N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.147,"smiles":null,"spectrum_id":"CCMSLIB00017210094","spectrum_index":655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 101.0825 Da; putative annotation: N/A; putative formula: CH7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.283,"smiles":null,"spectrum_id":"CCMSLIB00017210095","spectrum_index":656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3aR,6aR,8R,9S,10S,10aR,11R)-2,8,10-Trihydroxy-3a-methyl-12-methylenedodecahydro-1H,7H-5,7,10b-(epimethanetriyl)-6a,9-ethanodibenzo[cd,f]indole (delta mass: 144.0424 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.249,"smiles":null,"spectrum_id":"CCMSLIB00017210096","spectrum_index":657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 163.0691 Da; putative annotation: N/A; putative formula: C5H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.156,"smiles":null,"spectrum_id":"CCMSLIB00017210097","spectrum_index":658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 56.1566 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.205,"smiles":null,"spectrum_id":"CCMSLIB00017210098","spectrum_index":659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 46.0388 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.203,"smiles":null,"spectrum_id":"CCMSLIB00017210099","spectrum_index":660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 358.1529 Da; putative annotation: N/A; putative formula: C19H22N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.271,"smiles":null,"spectrum_id":"CCMSLIB00017210101","spectrum_index":661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Arg (delta mass: 100.0163 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.219,"smiles":null,"spectrum_id":"CCMSLIB00017210102","spectrum_index":662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.263,"smiles":null,"spectrum_id":"CCMSLIB00017210103","spectrum_index":663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Fluorobenzoyl)-5-amino-1H-indole (delta mass: 65.039 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.132,"smiles":null,"spectrum_id":"CCMSLIB00017210106","spectrum_index":664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 376.1693 Da; putative annotation: N/A; putative formula: C10H16N16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.256,"smiles":null,"spectrum_id":"CCMSLIB00017210107","spectrum_index":665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 127.1855 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.228,"smiles":null,"spectrum_id":"CCMSLIB00017210108","spectrum_index":666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 107.0733 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.17,"smiles":null,"spectrum_id":"CCMSLIB00017210109","spectrum_index":667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 31.9873 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.235,"smiles":null,"spectrum_id":"CCMSLIB00017210110","spectrum_index":668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 100.0288 Da; putative annotation: N/A; putative formula: C2H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.256,"smiles":null,"spectrum_id":"CCMSLIB00017210111","spectrum_index":669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 113.1052 Da; putative annotation: N/A; putative formula: C4H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.144,"smiles":null,"spectrum_id":"CCMSLIB00017210112","spectrum_index":670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Allyl 3-amino-1-piperidinecarboxylate (delta mass: 27.9977 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.126,"smiles":null,"spectrum_id":"CCMSLIB00017210114","spectrum_index":671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 277.193 Da; putative annotation: N/A; putative formula: C11H27N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.279,"smiles":null,"spectrum_id":"CCMSLIB00017210115","spectrum_index":672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304049 p-Coumaraldehyde (delta mass: 116.0846 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.144,"smiles":null,"spectrum_id":"CCMSLIB00017210116","spectrum_index":673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 905.3648 Da; putative annotation: N/A; putative formula: C53H47N9O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1215.48,"smiles":null,"spectrum_id":"CCMSLIB00017210117","spectrum_index":674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 29.0412 Da; putative annotation: N/A; putative formula: H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.122,"smiles":null,"spectrum_id":"CCMSLIB00017210118","spectrum_index":675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Longicaulenone (delta mass: 193.0583 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.186,"smiles":null,"spectrum_id":"CCMSLIB00017210120","spectrum_index":676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 206.9055 Da; putative annotation: N/A; putative formula: C3HN3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.003,"smiles":null,"spectrum_id":"CCMSLIB00017210121","spectrum_index":677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyltyramine (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.118,"smiles":null,"spectrum_id":"CCMSLIB00017210123","spectrum_index":678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 340.4243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.526,"smiles":null,"spectrum_id":"CCMSLIB00017210124","spectrum_index":679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine (delta mass: 193.1703 Da; putative annotation: N/A; putative formula: C10H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.274,"smiles":null,"spectrum_id":"CCMSLIB00017210125","spectrum_index":680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 114.082 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.158,"smiles":null,"spectrum_id":"CCMSLIB00017210126","spectrum_index":681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 859.0378 Da; putative annotation: N/A; putative formula: C29H29N7O14S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1081.14,"smiles":null,"spectrum_id":"CCMSLIB00017210127","spectrum_index":682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 697.5639 Da; putative annotation: N/A; putative formula: C44H75NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":919.661,"smiles":null,"spectrum_id":"CCMSLIB00017210128","spectrum_index":683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 134.0924 Da; putative annotation: N/A; putative formula: C2H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.278,"smiles":null,"spectrum_id":"CCMSLIB00017210129","spectrum_index":684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfamethazine (delta mass: 58.0525 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.143,"smiles":null,"spectrum_id":"CCMSLIB00017210130","spectrum_index":685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 96.0929 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.335,"smiles":null,"spectrum_id":"CCMSLIB00017210132","spectrum_index":686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 188.5954 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.667,"smiles":null,"spectrum_id":"CCMSLIB00017210133","spectrum_index":687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 837.4357 Da; putative annotation: N/A; putative formula: C45H59N9O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1018.51,"smiles":null,"spectrum_id":"CCMSLIB00017210135","spectrum_index":688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 100.0163 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017210136","spectrum_index":689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4'-Ethenyl-2'-hydroxy-1,4',4a-trimethyl-5-oxospiro[2,3,4,7,8,8a-hexahydronaphthalene-6,1'-cyclopentane]-1-carboxylic acid (delta mass: 48.0345 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.256,"smiles":null,"spectrum_id":"CCMSLIB00017210138","spectrum_index":690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 412.2809 Da; putative annotation: N/A; putative formula: C20H40N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.492,"smiles":null,"spectrum_id":"CCMSLIB00017210139","spectrum_index":691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 65.0277 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.108,"smiles":null,"spectrum_id":"CCMSLIB00017210140","spectrum_index":692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Wilforlide A (delta mass: 112.0677 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.42,"smiles":null,"spectrum_id":"CCMSLIB00017210141","spectrum_index":693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET020002 CLE_291.1026_12.2|Clensiopenterol|1-(4-amino-3,5-dichlorophenyl)-2-(3-methylbutylamino)ethanol (delta mass: 64.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.114,"smiles":null,"spectrum_id":"CCMSLIB00017210142","spectrum_index":694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 173.0334 Da; putative annotation: N/A; putative formula: C7H11NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.104,"smiles":null,"spectrum_id":"CCMSLIB00017210143","spectrum_index":695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.221,"smiles":null,"spectrum_id":"CCMSLIB00017210144","spectrum_index":696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORADRENALINE (delta mass: 72.0688 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.15,"smiles":null,"spectrum_id":"CCMSLIB00017210145","spectrum_index":697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 311.1692 Da; putative annotation: N/A; putative formula: C11H25N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.266,"smiles":null,"spectrum_id":"CCMSLIB00017210147","spectrum_index":698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 17.9548 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.187,"smiles":null,"spectrum_id":"CCMSLIB00017210148","spectrum_index":699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin Pr-LL (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.329,"smiles":null,"spectrum_id":"CCMSLIB00017210150","spectrum_index":700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 194.1308 Da; putative annotation: N/A; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017210151","spectrum_index":701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 70.0783 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.347,"smiles":null,"spectrum_id":"CCMSLIB00017210152","spectrum_index":702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017210153","spectrum_index":703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid ethyl ester (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017210154","spectrum_index":704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopentylacetic acid (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.128,"smiles":null,"spectrum_id":"CCMSLIB00017210155","spectrum_index":705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 24.9952 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":125.071,"smiles":null,"spectrum_id":"CCMSLIB00017210156","spectrum_index":706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 8.9977 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.303,"smiles":null,"spectrum_id":"CCMSLIB00017210157","spectrum_index":707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 818.4438 Da; putative annotation: N/A; putative formula: C41H58N10O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":981.504,"smiles":null,"spectrum_id":"CCMSLIB00017210158","spectrum_index":708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 508.1437 Da; putative annotation: N/A; putative formula: C21H32O10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.204,"smiles":null,"spectrum_id":"CCMSLIB00017210159","spectrum_index":709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 345.2526 Da; putative annotation: N/A; putative formula: C19H39NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.474,"smiles":null,"spectrum_id":"CCMSLIB00017210161","spectrum_index":710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 205.1673 Da; putative annotation: N/A; putative formula: C11H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.305,"smiles":null,"spectrum_id":"CCMSLIB00017210163","spectrum_index":711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. alcohol methyl ether (delta mass: 124.0701 Da; putative annotation: N/A; putative formula: C8H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.354,"smiles":null,"spectrum_id":"CCMSLIB00017210164","spectrum_index":712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cyclohexylethanol (delta mass: 26.9929 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.12,"smiles":null,"spectrum_id":"CCMSLIB00017210166","spectrum_index":713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 69.0102 Da; putative annotation: N/A; putative formula: H-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017210167","spectrum_index":714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3?-Hydroxy-7 Ketolithocholic Acid (delta mass: 181.1077 Da; putative annotation: N/A; putative formula: C6H11N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.392,"smiles":null,"spectrum_id":"CCMSLIB00017210168","spectrum_index":715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 339.1162 Da; putative annotation: N/A; putative formula: C25H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.192,"smiles":null,"spectrum_id":"CCMSLIB00017210169","spectrum_index":716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 309.2742 Da; putative annotation: N/A; putative formula: C14H31N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.55,"smiles":null,"spectrum_id":"CCMSLIB00017210170","spectrum_index":717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,19-Dihydroxy-3-oxo-12-ursen-28-oic acid (delta mass: 138.0882 Da; putative annotation: N/A; putative formula: C9H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.43,"smiles":null,"spectrum_id":"CCMSLIB00017210171","spectrum_index":718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alphitolic acid (delta mass: 144.0228 Da; putative annotation: N/A; putative formula: C2H4N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.385,"smiles":null,"spectrum_id":"CCMSLIB00017210172","spectrum_index":719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU278501 1-(3-carboxypropyl)-3,7-dimethylxanthine|4-(3,7-dimethyl-2,6-dioxopurin-1-yl)butanoic acid (delta mass: 176.0334 Da; putative annotation: N/A; putative formula: C7H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.142,"smiles":null,"spectrum_id":"CCMSLIB00017210173","spectrum_index":720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 176.0336 Da; putative annotation: N/A; putative formula: C7H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.193,"smiles":null,"spectrum_id":"CCMSLIB00017210174","spectrum_index":721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 319.1975 Da; putative annotation: N/A; putative formula: C19H29NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.31,"smiles":null,"spectrum_id":"CCMSLIB00017210175","spectrum_index":722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.065,"smiles":null,"spectrum_id":"CCMSLIB00017210176","spectrum_index":723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-15-Tetracosenoic acid (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.378,"smiles":null,"spectrum_id":"CCMSLIB00017210179","spectrum_index":724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 130.1878 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.311,"smiles":null,"spectrum_id":"CCMSLIB00017210181","spectrum_index":725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 64.0674 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.268,"smiles":null,"spectrum_id":"CCMSLIB00017210182","spectrum_index":726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Chlorophenyl)-1-piperidinecarboxamide (delta mass: 273.1664 Da; putative annotation: N/A; putative formula: C16H23N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.261,"smiles":null,"spectrum_id":"CCMSLIB00017210183","spectrum_index":727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 427.1722 Da; putative annotation: N/A; putative formula: C34H21NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.244,"smiles":null,"spectrum_id":"CCMSLIB00017210184","spectrum_index":728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 66.0463 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.278,"smiles":null,"spectrum_id":"CCMSLIB00017210185","spectrum_index":729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 78.0465 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.289,"smiles":null,"spectrum_id":"CCMSLIB00017210186","spectrum_index":730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 230.022 Da; putative annotation: N/A; putative formula: C4H12N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.056,"smiles":null,"spectrum_id":"CCMSLIB00017210187","spectrum_index":731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 42.0084 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.104,"smiles":null,"spectrum_id":"CCMSLIB00017210188","spectrum_index":732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 359.4872 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.568,"smiles":null,"spectrum_id":"CCMSLIB00017210189","spectrum_index":733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 66.0101 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.075,"smiles":null,"spectrum_id":"CCMSLIB00017210190","spectrum_index":734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 18.9923 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.126,"smiles":null,"spectrum_id":"CCMSLIB00017210191","spectrum_index":735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylcyclohexanol (delta mass: 74.0728 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.2,"smiles":null,"spectrum_id":"CCMSLIB00017210193","spectrum_index":736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 43.9751 Da; putative annotation: N/A; putative formula: CS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.061,"smiles":null,"spectrum_id":"CCMSLIB00017210195","spectrum_index":737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-5-(1-piperidinylcarbonyl)aniline (delta mass: 67.076 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.171,"smiles":null,"spectrum_id":"CCMSLIB00017210197","spectrum_index":738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 150.125 Da; putative annotation: N/A; putative formula: C8H14N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.237,"smiles":null,"spectrum_id":"CCMSLIB00017210198","spectrum_index":739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101901 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 15.9433 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.03,"smiles":null,"spectrum_id":"CCMSLIB00017210199","spectrum_index":740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Baptifoline (delta mass: 193.084 Da; putative annotation: N/A; putative formula: C9H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.244,"smiles":null,"spectrum_id":"CCMSLIB00017210200","spectrum_index":741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bulbocapnine (delta mass: 180.064 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.203,"smiles":null,"spectrum_id":"CCMSLIB00017210201","spectrum_index":742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 265.1212 Da; putative annotation: N/A; putative formula: C16H15N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.254,"smiles":null,"spectrum_id":"CCMSLIB00017210202","spectrum_index":743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 78.0619 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.127,"smiles":null,"spectrum_id":"CCMSLIB00017210203","spectrum_index":744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 272.2366 Da; putative annotation: N/A; putative formula: C17H28N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.484,"smiles":null,"spectrum_id":"CCMSLIB00017210204","spectrum_index":745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 430.1017 Da; putative annotation: N/A; putative formula: C23H19N4OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.188,"smiles":null,"spectrum_id":"CCMSLIB00017210205","spectrum_index":746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311014 Feruloyl agmatine (isomer of 1607) (delta mass: 30.0108 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.187,"smiles":null,"spectrum_id":"CCMSLIB00017210206","spectrum_index":747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 88.0716 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.186,"smiles":null,"spectrum_id":"CCMSLIB00017210207","spectrum_index":748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 166.1571 Da; putative annotation: N/A; putative formula: C9H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.238,"smiles":null,"spectrum_id":"CCMSLIB00017210208","spectrum_index":749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[3-(2-Carboxyethyl)-4-methylpyrrol-2-methylidenyl]-2-indolinone (delta mass: 42.0091 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.133,"smiles":null,"spectrum_id":"CCMSLIB00017210209","spectrum_index":750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-1H-indole-3-carbaldehyde (delta mass: 46.159 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017210211","spectrum_index":751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 105.0425 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017210213","spectrum_index":752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 46.0149 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017210215","spectrum_index":753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 132.0997 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.332,"smiles":null,"spectrum_id":"CCMSLIB00017210216","spectrum_index":754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaprilat (delta mass: 176.033 Da; putative annotation: N/A; putative formula: C7H12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.224,"smiles":null,"spectrum_id":"CCMSLIB00017210217","spectrum_index":755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cefalexin (delta mass: 264.1113 Da; putative annotation: N/A; putative formula: C13H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.213,"smiles":null,"spectrum_id":"CCMSLIB00017210218","spectrum_index":756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 104.099 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.352,"smiles":null,"spectrum_id":"CCMSLIB00017210219","spectrum_index":757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl hydrogen azelate (delta mass: 124.0876 Da; putative annotation: Tetramethylcyclopropane-1-carboxylic acid; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.215,"smiles":null,"spectrum_id":"CCMSLIB00017210220","spectrum_index":758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Hydroxy-7-oxoabiet-8(14)-en-18-oic acid (delta mass: 316.2041 Da; putative annotation: Prostaglandin A2; putative formula: C20H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.426,"smiles":null,"spectrum_id":"CCMSLIB00017210221","spectrum_index":759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3S-5-dimethylsulfonio-3-hydroxylpentanoate (Gonyol) (delta mass: 98.0369 Da; putative annotation: 3-Oxopentanoic acid; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.111,"smiles":null,"spectrum_id":"CCMSLIB00017210222","spectrum_index":760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 260.2109 Da; putative annotation: Pinolenic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.255,"smiles":null,"spectrum_id":"CCMSLIB00017210223","spectrum_index":761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 340.297 Da; putative annotation: 2,3-Dihydroxypropyl octadecanoate; putative formula: C21H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.513,"smiles":null,"spectrum_id":"CCMSLIB00017210224","spectrum_index":762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Panglimycin E (delta mass: 342.1127 Da; putative annotation: 2,3a,7b,12-Tetrahydroxy-5-methyl-3a,4,5,6,7a,7b-hexahydro-2H-tetrapheno[6a,7-b]oxirene-7,8(3H,12bH)-dione; putative formula: C19H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.23,"smiles":null,"spectrum_id":"CCMSLIB00017210226","spectrum_index":763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 810.2663 Da; putative annotation: Maltopentaose; putative formula: C30H50O25)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1315.44,"smiles":null,"spectrum_id":"CCMSLIB00017210227","spectrum_index":764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 128.0277 Da; putative annotation: PHENYLPROPIOLIC ACID; putative formula: C9H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.098,"smiles":null,"spectrum_id":"CCMSLIB00017210230","spectrum_index":765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-(2,3-Dihydroxypropoxy)-9-oxononanoic acid (delta mass: 142.0993 Da; putative annotation: 3-Hydroxyvalproic acid; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.248,"smiles":null,"spectrum_id":"CCMSLIB00017210231","spectrum_index":766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 250.1557 Da; putative annotation: Corey PG-lactone diol; putative formula: C15H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.367,"smiles":null,"spectrum_id":"CCMSLIB00017210232","spectrum_index":767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 286.2263 Da; putative annotation: Anticopalic acid; putative formula: C20H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":905.756,"smiles":null,"spectrum_id":"CCMSLIB00017210233","spectrum_index":768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 132.0952 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.317,"smiles":null,"spectrum_id":"CCMSLIB00017210234","spectrum_index":769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid (delta mass: 393.2535 Da; putative annotation: Saliniketal B; putative formula: C22H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.496,"smiles":null,"spectrum_id":"CCMSLIB00017210235","spectrum_index":770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 208.1461 Da; putative annotation: 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)-; putative formula: C13H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.404,"smiles":null,"spectrum_id":"CCMSLIB00017210236","spectrum_index":771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 162.0528 Da; putative annotation: D-(+)-Mannose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.123,"smiles":null,"spectrum_id":"CCMSLIB00017210237","spectrum_index":772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 242.0982 Da; putative annotation: Cyperine; putative formula: C15H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.153,"smiles":null,"spectrum_id":"CCMSLIB00017210238","spectrum_index":773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexamethyleneimine (delta mass: 71.0372 Da; putative annotation: D-ALANINE; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.149,"smiles":null,"spectrum_id":"CCMSLIB00017210240","spectrum_index":774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylene Glycol Monododecyl Ether (delta mass: 132.0789 Da; putative annotation: Triethylene glycol; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.363,"smiles":null,"spectrum_id":"CCMSLIB00017210241","spectrum_index":775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 232.1467 Da; putative annotation: Hydroxyvalerenic acid; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.211,"smiles":null,"spectrum_id":"CCMSLIB00017210243","spectrum_index":776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 114.0725 Da; putative annotation: N/A; putative formula: C5H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.232,"smiles":null,"spectrum_id":"CCMSLIB00017210245","spectrum_index":777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4a-Dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 72.0362 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.242,"smiles":null,"spectrum_id":"CCMSLIB00017210246","spectrum_index":778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 245.1498 Da; putative annotation: N/A; putative formula: C10H15N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.336,"smiles":null,"spectrum_id":"CCMSLIB00017210247","spectrum_index":779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 171.1233 Da; putative annotation: N/A; putative formula: C5H13N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.637,"smiles":null,"spectrum_id":"CCMSLIB00017210248","spectrum_index":780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 122.1094 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017210249","spectrum_index":781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 94.0779 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017210250","spectrum_index":782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 124.0711 Da; putative annotation: N/A; putative formula: C8H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.308,"smiles":null,"spectrum_id":"CCMSLIB00017210251","spectrum_index":783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 76.9933 Da; putative annotation: N/A; putative formula: CH3NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.204,"smiles":null,"spectrum_id":"CCMSLIB00017210252","spectrum_index":784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 194.043 Da; putative annotation: N/A; putative formula: C9H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.181,"smiles":null,"spectrum_id":"CCMSLIB00017210253","spectrum_index":785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 48.9766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.095,"smiles":null,"spectrum_id":"CCMSLIB00017210254","spectrum_index":786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 125.109 Da; putative annotation: N/A; putative formula: C5H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.211,"smiles":null,"spectrum_id":"CCMSLIB00017210256","spectrum_index":787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Oxomorphine (delta mass: 374.1383 Da; putative annotation: N/A; putative formula: C14H18N10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.261,"smiles":null,"spectrum_id":"CCMSLIB00017210259","spectrum_index":788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 16.9344 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.241,"smiles":null,"spectrum_id":"CCMSLIB00017210260","spectrum_index":789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alisol B acetate (delta mass: 100.07 Da; putative annotation: N/A; putative formula: C6H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.443,"smiles":null,"spectrum_id":"CCMSLIB00017210261","spectrum_index":790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.091,"smiles":null,"spectrum_id":"CCMSLIB00017210262","spectrum_index":791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 98.072 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.179,"smiles":null,"spectrum_id":"CCMSLIB00017210263","spectrum_index":792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 174.1259 Da; putative annotation: N/A; putative formula: C9H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017210264","spectrum_index":793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Cholesterol from NIST14 (delta mass: 324.2078 Da; putative annotation: N/A; putative formula: C16H29N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.57,"smiles":null,"spectrum_id":"CCMSLIB00017210265","spectrum_index":794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 17.9875 Da; putative annotation: N/A; putative formula: C3H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.219,"smiles":null,"spectrum_id":"CCMSLIB00017210266","spectrum_index":795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 85.0886 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.227,"smiles":null,"spectrum_id":"CCMSLIB00017210267","spectrum_index":796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 23.9843 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.112,"smiles":null,"spectrum_id":"CCMSLIB00017210268","spectrum_index":797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 236.0858 Da; putative annotation: N/A; putative formula: C7H17N4OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.157,"smiles":null,"spectrum_id":"CCMSLIB00017210269","spectrum_index":798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 269.1262 Da; putative annotation: N/A; putative formula: C13H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.186,"smiles":null,"spectrum_id":"CCMSLIB00017210270","spectrum_index":799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentanedioic acid, monomethyl ester (delta mass: 86.0367 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.102,"smiles":null,"spectrum_id":"CCMSLIB00017210272","spectrum_index":800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2Z-Eicosenoic acid (delta mass: 74.0369 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.331,"smiles":null,"spectrum_id":"CCMSLIB00017210275","spectrum_index":801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 44.0127 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.115,"smiles":null,"spectrum_id":"CCMSLIB00017210276","spectrum_index":802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Santacruzamate A (delta mass: 50.0155 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017210277","spectrum_index":803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 72.0586 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.15,"smiles":null,"spectrum_id":"CCMSLIB00017210278","spectrum_index":804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Furanacetic acid, 3-(3,4'-dihydroxy-2,5-dimethoxy[1,1'-biphenyl]-4-yl)-2,5-dihydro-5-oxo- (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.118,"smiles":null,"spectrum_id":"CCMSLIB00017210279","spectrum_index":805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 545.2681 Da; putative annotation: N/A; putative formula: C28H43N5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.339,"smiles":null,"spectrum_id":"CCMSLIB00017210280","spectrum_index":806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyageraphorone (delta mass: 57.0209 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.206,"smiles":null,"spectrum_id":"CCMSLIB00017210281","spectrum_index":807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sebacic acid (delta mass: 129.1508 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.279,"smiles":null,"spectrum_id":"CCMSLIB00017210282","spectrum_index":808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380944-01_C30H46O3_(3beta,5xi,9xi,13alpha,17alpha,18xi)-3-Hydroxy-13,28-epoxyurs-11-en-28-one (delta mass: 60.0264 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.378,"smiles":null,"spectrum_id":"CCMSLIB00017210283","spectrum_index":809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 93.0788 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.301,"smiles":null,"spectrum_id":"CCMSLIB00017210284","spectrum_index":810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 60.0411 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017210285","spectrum_index":811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Hyodeoxycholic acid (delta mass: 50.0548 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.355,"smiles":null,"spectrum_id":"CCMSLIB00017210286","spectrum_index":812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 401.2507 Da; putative annotation: N/A; putative formula: C31H31NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.342,"smiles":null,"spectrum_id":"CCMSLIB00017210290","spectrum_index":813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 186.1767 Da; putative annotation: N/A; putative formula: C15H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.264,"smiles":null,"spectrum_id":"CCMSLIB00017210291","spectrum_index":814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 187.0785 Da; putative annotation: N/A; putative formula: C15H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.191,"smiles":null,"spectrum_id":"CCMSLIB00017210292","spectrum_index":815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 413.1493 Da; putative annotation: N/A; putative formula: C16H27N7S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.22,"smiles":null,"spectrum_id":"CCMSLIB00017210293","spectrum_index":816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 349.2838 Da; putative annotation: N/A; putative formula: C19H35N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.5,"smiles":null,"spectrum_id":"CCMSLIB00017210294","spectrum_index":817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asperlactone (delta mass: 68.0628 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.144,"smiles":null,"spectrum_id":"CCMSLIB00017210295","spectrum_index":818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.096,"smiles":null,"spectrum_id":"CCMSLIB00017210296","spectrum_index":819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 76.0686 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.28,"smiles":null,"spectrum_id":"CCMSLIB00017210297","spectrum_index":820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Formyl-4-methoxyphenoxy)acetic acid (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017210298","spectrum_index":821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 96.0577 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.269,"smiles":null,"spectrum_id":"CCMSLIB00017210299","spectrum_index":822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 305.0504 Da; putative annotation: N/A; putative formula: C10H15N3O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.174,"smiles":null,"spectrum_id":"CCMSLIB00017210300","spectrum_index":823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 74.0004 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.055,"smiles":null,"spectrum_id":"CCMSLIB00017210301","spectrum_index":824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 131.8338 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.9,"smiles":null,"spectrum_id":"CCMSLIB00017210302","spectrum_index":825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 432.1636 Da; putative annotation: N/A; putative formula: C22H29N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.245,"smiles":null,"spectrum_id":"CCMSLIB00017210304","spectrum_index":826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 90.0827 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017210307","spectrum_index":827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethyl 2-(formylamino)malonate (delta mass: 16.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017210308","spectrum_index":828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.306,"smiles":null,"spectrum_id":"CCMSLIB00017210309","spectrum_index":829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 28.0031 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.131,"smiles":null,"spectrum_id":"CCMSLIB00017210310","spectrum_index":830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Blood Group H Trisaccharide (delta mass: 169.2921 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.5,"smiles":null,"spectrum_id":"CCMSLIB00017210311","spectrum_index":831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 19.0499 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.149,"smiles":null,"spectrum_id":"CCMSLIB00017210312","spectrum_index":832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 210.1982 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.332,"smiles":null,"spectrum_id":"CCMSLIB00017210313","spectrum_index":833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-5Z,8Z,11Z,13E,17Z-eicosapentaenoic acid (delta mass: 63.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.295,"smiles":null,"spectrum_id":"CCMSLIB00017210317","spectrum_index":834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 114.081 Da; putative annotation: N/A; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.37,"smiles":null,"spectrum_id":"CCMSLIB00017210318","spectrum_index":835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 17.9744 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.326,"smiles":null,"spectrum_id":"CCMSLIB00017210319","spectrum_index":836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(8Z,11Z,14Z-Eicosatrienoyl)ethanolamine (delta mass: 160.1346 Da; putative annotation: N/A; putative formula: C11H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.44,"smiles":null,"spectrum_id":"CCMSLIB00017210320","spectrum_index":837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 303.2338 Da; putative annotation: N/A; putative formula: C15H33N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.45,"smiles":null,"spectrum_id":"CCMSLIB00017210321","spectrum_index":838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 117.0471 Da; putative annotation: N/A; putative formula: C2H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.134,"smiles":null,"spectrum_id":"CCMSLIB00017210322","spectrum_index":839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 357.1061 Da; putative annotation: N/A; putative formula: C15H19NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.239,"smiles":null,"spectrum_id":"CCMSLIB00017210323","spectrum_index":840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid (delta mass: 242.2039 Da; putative annotation: N/A; putative formula: C18H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.436,"smiles":null,"spectrum_id":"CCMSLIB00017210324","spectrum_index":841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 73.0528 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.119,"smiles":null,"spectrum_id":"CCMSLIB00017210325","spectrum_index":842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine diphosphate - 40.0 eV (delta mass: 211.0375 Da; putative annotation: N/A; putative formula: C11H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.074,"smiles":null,"spectrum_id":"CCMSLIB00017210326","spectrum_index":843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 505.2309 Da; putative annotation: N/A; putative formula: C26H35NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.286,"smiles":null,"spectrum_id":"CCMSLIB00017210327","spectrum_index":844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 274.121 Da; putative annotation: N/A; putative formula: C9H18N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.176,"smiles":null,"spectrum_id":"CCMSLIB00017210329","spectrum_index":845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 142.1003 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017210330","spectrum_index":846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Nitrosopiperazine (NPAZ) (delta mass: 15.0002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":131.082,"smiles":null,"spectrum_id":"CCMSLIB00017210333","spectrum_index":847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 178.0606 Da; putative annotation: N/A; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.277,"smiles":null,"spectrum_id":"CCMSLIB00017210334","spectrum_index":848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 87.0682 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.155,"smiles":null,"spectrum_id":"CCMSLIB00017210335","spectrum_index":849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 17.0275 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.306,"smiles":null,"spectrum_id":"CCMSLIB00017210336","spectrum_index":850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)acetamide (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.155,"smiles":null,"spectrum_id":"CCMSLIB00017210337","spectrum_index":851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16(17)-Epoxy-4Z,7Z,10Z,13Z,19Z-docosapentaenoic acid (delta mass: 60.0424 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.285,"smiles":null,"spectrum_id":"CCMSLIB00017210338","spectrum_index":852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 55.0426 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.171,"smiles":null,"spectrum_id":"CCMSLIB00017210339","spectrum_index":853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 15.9954 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.207,"smiles":null,"spectrum_id":"CCMSLIB00017210341","spectrum_index":854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 489.2344 Da; putative annotation: N/A; putative formula: C23H35N7OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.306,"smiles":null,"spectrum_id":"CCMSLIB00017210342","spectrum_index":855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carboxyibuprofen (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017210343","spectrum_index":856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 113.08 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.177,"smiles":null,"spectrum_id":"CCMSLIB00017210344","spectrum_index":857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.175,"smiles":null,"spectrum_id":"CCMSLIB00017210347","spectrum_index":858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.-Hydroxyprogesterone (delta mass: 176.032 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.259,"smiles":null,"spectrum_id":"CCMSLIB00017210348","spectrum_index":859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Campestrinoside (delta mass: 424.1386 Da; putative annotation: N/A; putative formula: C22H32S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":849.283,"smiles":null,"spectrum_id":"CCMSLIB00017210349","spectrum_index":860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxypropan-2-yl)-9-(3-methylbut-2-enyl)-2,3-dihydrofuro[3,2-g]chromen-7-one (delta mass: 314.1574 Da; putative annotation: N/A; putative formula: C17H22N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.317,"smiles":null,"spectrum_id":"CCMSLIB00017210350","spectrum_index":861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 550.116 Da; putative annotation: N/A; putative formula: C26H22N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.187,"smiles":null,"spectrum_id":"CCMSLIB00017210352","spectrum_index":862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 571.1703 Da; putative annotation: N/A; putative formula: C29H25N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.211,"smiles":null,"spectrum_id":"CCMSLIB00017210353","spectrum_index":863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bonactin (delta mass: 396.2079 Da; putative annotation: N/A; putative formula: C22H29N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":797.461,"smiles":null,"spectrum_id":"CCMSLIB00017210354","spectrum_index":864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic LL-D253.alpha. (delta mass: 73.9833 Da; putative annotation: N/A; putative formula: C2H4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.09,"smiles":null,"spectrum_id":"CCMSLIB00017210355","spectrum_index":865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 143.0365 Da; putative annotation: N/A; putative formula: C9H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.118,"smiles":null,"spectrum_id":"CCMSLIB00017210356","spectrum_index":866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 47.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.29,"smiles":null,"spectrum_id":"CCMSLIB00017210357","spectrum_index":867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,3,4-Oxadiazol-2-yl)phenylamine (delta mass: 65.0396 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.106,"smiles":null,"spectrum_id":"CCMSLIB00017210360","spectrum_index":868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 18.009 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.052,"smiles":null,"spectrum_id":"CCMSLIB00017210361","spectrum_index":869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Thienyl)pyrrolidine (delta mass: 55.0499 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.118,"smiles":null,"spectrum_id":"CCMSLIB00017210363","spectrum_index":870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethanolamide (delta mass: 66.0089 Da; putative annotation: N/A; putative formula: H-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.299,"smiles":null,"spectrum_id":"CCMSLIB00017210364","spectrum_index":871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 283.1618 Da; putative annotation: N/A; putative formula: C18H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.206,"smiles":null,"spectrum_id":"CCMSLIB00017210365","spectrum_index":872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 600.4486 Da; putative annotation: N/A; putative formula: C33H52N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.707,"smiles":null,"spectrum_id":"CCMSLIB00017210367","spectrum_index":873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 40.9755 Da; putative annotation: N/A; putative formula: C16H23N7O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.03,"smiles":null,"spectrum_id":"CCMSLIB00017210368","spectrum_index":874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 444.3095 Da; putative annotation: N/A; putative formula: C25H48O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.552,"smiles":null,"spectrum_id":"CCMSLIB00017210371","spectrum_index":875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 905.5538 Da; putative annotation: N/A; putative formula: C67H71NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1068.61,"smiles":null,"spectrum_id":"CCMSLIB00017210372","spectrum_index":876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 503.4177 Da; putative annotation: N/A; putative formula: C32H59NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.478,"smiles":null,"spectrum_id":"CCMSLIB00017210373","spectrum_index":877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 933.5858 Da; putative annotation: N/A; putative formula: C57H79N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1096.65,"smiles":null,"spectrum_id":"CCMSLIB00017210374","spectrum_index":878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 803.4078 Da; putative annotation: N/A; putative formula: C39H53N11O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1160.71,"smiles":null,"spectrum_id":"CCMSLIB00017210375","spectrum_index":879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 102.0836 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.305,"smiles":null,"spectrum_id":"CCMSLIB00017210376","spectrum_index":880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4-dihydroxybenzoic acid CollisionEnergy:102040\"\" (delta mass: 42.0101 Da; putative annotation: N/A; putative formula: C2H2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.044,"smiles":null,"spectrum_id":"CCMSLIB00017210377","spectrum_index":881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Cycloisolongifol-5-ol (delta mass: 88.0165 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.207,"smiles":null,"spectrum_id":"CCMSLIB00017210378","spectrum_index":882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 117.0654 Da; putative annotation: N/A; putative formula: C2H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.219,"smiles":null,"spectrum_id":"CCMSLIB00017210380","spectrum_index":883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 33.0065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017210381","spectrum_index":884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 18.9588 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.061,"smiles":null,"spectrum_id":"CCMSLIB00017210383","spectrum_index":885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 29.0261 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.122,"smiles":null,"spectrum_id":"CCMSLIB00017210385","spectrum_index":886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 72.0576 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.123,"smiles":null,"spectrum_id":"CCMSLIB00017210386","spectrum_index":887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 660.2427 Da; putative annotation: N/A; putative formula: C34H44O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.324,"smiles":null,"spectrum_id":"CCMSLIB00017210387","spectrum_index":888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 161.1432 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.386,"smiles":null,"spectrum_id":"CCMSLIB00017210388","spectrum_index":889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Ketodeoxycholic acid (delta mass: 279.2548 Da; putative annotation: N/A; putative formula: C14H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.539,"smiles":null,"spectrum_id":"CCMSLIB00017210390","spectrum_index":890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 184.0999 Da; putative annotation: N/A; putative formula: C12H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.213,"smiles":null,"spectrum_id":"CCMSLIB00017210391","spectrum_index":891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylcyclohexylamine (delta mass: 42.011 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.139,"smiles":null,"spectrum_id":"CCMSLIB00017210392","spectrum_index":892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 97.0775 Da; putative annotation: N/A; putative formula: C3H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.226,"smiles":null,"spectrum_id":"CCMSLIB00017210393","spectrum_index":893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 82.0088 Da; putative annotation: N/A; putative formula: C3H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.063,"smiles":null,"spectrum_id":"CCMSLIB00017210394","spectrum_index":894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 325.1172 Da; putative annotation: N/A; putative formula: C16H23NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.177,"smiles":null,"spectrum_id":"CCMSLIB00017210397","spectrum_index":895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 85.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.165,"smiles":null,"spectrum_id":"CCMSLIB00017210398","spectrum_index":896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 331.1238 Da; putative annotation: N/A; putative formula: C20H18N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.34,"smiles":null,"spectrum_id":"CCMSLIB00017210400","spectrum_index":897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 118.1153 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.342,"smiles":null,"spectrum_id":"CCMSLIB00017210401","spectrum_index":898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 176.0761 Da; putative annotation: N/A; putative formula: C11H13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.21,"smiles":null,"spectrum_id":"CCMSLIB00017210402","spectrum_index":899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 185.3044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.5,"smiles":null,"spectrum_id":"CCMSLIB00017210403","spectrum_index":900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-palmitoyl-D-erythro-sphinganine (delta mass: 324.106 Da; putative annotation: N/A; putative formula: C15H21N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.641,"smiles":null,"spectrum_id":"CCMSLIB00017210404","spectrum_index":901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 38.0523 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.113,"smiles":null,"spectrum_id":"CCMSLIB00017210405","spectrum_index":902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 327.2792 Da; putative annotation: N/A; putative formula: C20H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.371,"smiles":null,"spectrum_id":"CCMSLIB00017210406","spectrum_index":903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 37.0238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.24,"smiles":null,"spectrum_id":"CCMSLIB00017210407","spectrum_index":904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 98.0364 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.268,"smiles":null,"spectrum_id":"CCMSLIB00017210408","spectrum_index":905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130087 (delta mass: 45.054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.225,"smiles":null,"spectrum_id":"CCMSLIB00017210411","spectrum_index":906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 59.0733 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017210413","spectrum_index":907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 315.1698 Da; putative annotation: N/A; putative formula: C16H21N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.209,"smiles":null,"spectrum_id":"CCMSLIB00017210414","spectrum_index":908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 78.0313 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017210415","spectrum_index":909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 30.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.127,"smiles":null,"spectrum_id":"CCMSLIB00017210416","spectrum_index":910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 77.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017210417","spectrum_index":911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Methylgallic acid (delta mass: 28.0312 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.076,"smiles":null,"spectrum_id":"CCMSLIB00017210418","spectrum_index":912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.123,"smiles":null,"spectrum_id":"CCMSLIB00017210419","spectrum_index":913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 224.0891 Da; putative annotation: N/A; putative formula: C8H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.144,"smiles":null,"spectrum_id":"CCMSLIB00017210420","spectrum_index":914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(9-Oxodecyl)acetamide (delta mass: 45.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.238,"smiles":null,"spectrum_id":"CCMSLIB00017210421","spectrum_index":915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 37.0334 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.109,"smiles":null,"spectrum_id":"CCMSLIB00017210422","spectrum_index":916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 37.0192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.069,"smiles":null,"spectrum_id":"CCMSLIB00017210423","spectrum_index":917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 88.0594 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.114,"smiles":null,"spectrum_id":"CCMSLIB00017210426","spectrum_index":918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.,17.alpha.-Dimethyl-5.beta.-androstane-3.alpha.,17.beta.-diol (delta mass: 42.0096 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.288,"smiles":null,"spectrum_id":"CCMSLIB00017210428","spectrum_index":919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 494.2111 Da; putative annotation: N/A; putative formula: C20H34N2O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.308,"smiles":null,"spectrum_id":"CCMSLIB00017210429","spectrum_index":920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 498.2862 Da; putative annotation: N/A; putative formula: C23H46O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.404,"smiles":null,"spectrum_id":"CCMSLIB00017210430","spectrum_index":921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Glu (delta mass: 147.0509 Da; putative annotation: N/A; putative formula: C9H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.18,"smiles":null,"spectrum_id":"CCMSLIB00017210431","spectrum_index":922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 36.0293 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.129,"smiles":null,"spectrum_id":"CCMSLIB00017210432","spectrum_index":923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 14.1948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.253,"smiles":null,"spectrum_id":"CCMSLIB00017210433","spectrum_index":924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 149.1311 Da; putative annotation: N/A; putative formula: C9H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.196,"smiles":null,"spectrum_id":"CCMSLIB00017210434","spectrum_index":925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.143,"smiles":null,"spectrum_id":"CCMSLIB00017210435","spectrum_index":926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diallyl-1,3,5-triazinane-2,4,6-trione (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.15,"smiles":null,"spectrum_id":"CCMSLIB00017210436","spectrum_index":927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.232,"smiles":null,"spectrum_id":"CCMSLIB00017210437","spectrum_index":928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 627.5434 Da; putative annotation: N/A; putative formula: C37H73NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.77,"smiles":null,"spectrum_id":"CCMSLIB00017210438","spectrum_index":929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385199-01!2-[3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]phenyl]-5,7-dihydroxychromen-4-one (delta mass: 610.1616 Da; putative annotation: N/A; putative formula: C43H22N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1221.32,"smiles":null,"spectrum_id":"CCMSLIB00017210441","spectrum_index":930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 40.0315 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.081,"smiles":null,"spectrum_id":"CCMSLIB00017210443","spectrum_index":931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatrienoic acid (delta mass: 35.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.332,"smiles":null,"spectrum_id":"CCMSLIB00017210444","spectrum_index":932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 49.0061 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.081,"smiles":null,"spectrum_id":"CCMSLIB00017210445","spectrum_index":933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 79.9649 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.249,"smiles":null,"spectrum_id":"CCMSLIB00017210446","spectrum_index":934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP012803 Benzoic acid (delta mass: 54.0559 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017210447","spectrum_index":935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (Z,E)-Tetradeca-9,12-dienol from NIST14 (delta mass: 77.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.253,"smiles":null,"spectrum_id":"CCMSLIB00017210448","spectrum_index":936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017210449","spectrum_index":937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 156.1304 Da; putative annotation: N/A; putative formula: C13H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.357,"smiles":null,"spectrum_id":"CCMSLIB00017210450","spectrum_index":938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 42.0066 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.176,"smiles":null,"spectrum_id":"CCMSLIB00017210451","spectrum_index":939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetyl-5-hydroxy-3-methylphenyl .beta.-D-glucopyranoside (delta mass: 211.0849 Da; putative annotation: N/A; putative formula: C11H17NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.208,"smiles":null,"spectrum_id":"CCMSLIB00017210453","spectrum_index":940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-3-(4-hydroxyphenyl)-8-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-4H-chromen-4-one (delta mass: 146.0581 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.176,"smiles":null,"spectrum_id":"CCMSLIB00017210455","spectrum_index":941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 263.1364 Da; putative annotation: N/A; putative formula: C11H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.233,"smiles":null,"spectrum_id":"CCMSLIB00017210457","spectrum_index":942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301803 Chelidonin|(+)-Chelidonine|[1,3]Benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridin-6-ol, 5b,6,7,12b,13,14-hexahydro-13-methyl-, (5bR,6S,12bS)- (delta mass: 180.0635 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.197,"smiles":null,"spectrum_id":"CCMSLIB00017210458","spectrum_index":943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 345.127 Da; putative annotation: N/A; putative formula: C24H15N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.317,"smiles":null,"spectrum_id":"CCMSLIB00017210459","spectrum_index":944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 385.2582 Da; putative annotation: N/A; putative formula: C20H39N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.349,"smiles":null,"spectrum_id":"CCMSLIB00017210460","spectrum_index":945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 143.1592 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.286,"smiles":null,"spectrum_id":"CCMSLIB00017210461","spectrum_index":946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 104.011 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.087,"smiles":null,"spectrum_id":"CCMSLIB00017210462","spectrum_index":947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 511.3712 Da; putative annotation: N/A; putative formula: C30H49N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.431,"smiles":null,"spectrum_id":"CCMSLIB00017210463","spectrum_index":948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Homoserine lactone (delta mass: 16.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":118.065,"smiles":null,"spectrum_id":"CCMSLIB00017210464","spectrum_index":949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-4,10-Dimethylidene-7-propan-2-ylcyclodec-5-en-1-ol (delta mass: 359.1426 Da; putative annotation: N/A; putative formula: C12H25NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.333,"smiles":null,"spectrum_id":"CCMSLIB00017210465","spectrum_index":950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdesmethoxycurcumin (delta mass: 298.1393 Da; putative annotation: N/A; putative formula: C19H22OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.251,"smiles":null,"spectrum_id":"CCMSLIB00017210467","spectrum_index":951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 52.0313 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.242,"smiles":null,"spectrum_id":"CCMSLIB00017210469","spectrum_index":952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S)-4-Amino-5-hydroxypentanoic acid (delta mass: 28.0488 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.13,"smiles":null,"spectrum_id":"CCMSLIB00017210471","spectrum_index":953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 112.0674 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.315,"smiles":null,"spectrum_id":"CCMSLIB00017210472","spectrum_index":954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.242,"smiles":null,"spectrum_id":"CCMSLIB00017210473","spectrum_index":955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 479.3063 Da; putative annotation: N/A; putative formula: C29H42N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.496,"smiles":null,"spectrum_id":"CCMSLIB00017210474","spectrum_index":956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 361.113 Da; putative annotation: N/A; putative formula: C14H23N3O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.392,"smiles":null,"spectrum_id":"CCMSLIB00017210475","spectrum_index":957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 104.062 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.2,"smiles":null,"spectrum_id":"CCMSLIB00017210476","spectrum_index":958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 193.059 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.244,"smiles":null,"spectrum_id":"CCMSLIB00017210477","spectrum_index":959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 194.0427 Da; putative annotation: N/A; putative formula: C6H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.27,"smiles":null,"spectrum_id":"CCMSLIB00017210478","spectrum_index":960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxypimara-8(14),15-dien-18-oic acid (delta mass: 158.021 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.248,"smiles":null,"spectrum_id":"CCMSLIB00017210479","spectrum_index":961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethoxybenzoic acid (delta mass: 16.051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.121,"smiles":null,"spectrum_id":"CCMSLIB00017210480","spectrum_index":962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 106.0783 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.316,"smiles":null,"spectrum_id":"CCMSLIB00017210482","spectrum_index":963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.133,"smiles":null,"spectrum_id":"CCMSLIB00017210485","spectrum_index":964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylglutamine (delta mass: 129.0634 Da; putative annotation: N/A; putative formula: C3H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.182,"smiles":null,"spectrum_id":"CCMSLIB00017210486","spectrum_index":965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 80.0625 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.315,"smiles":null,"spectrum_id":"CCMSLIB00017210487","spectrum_index":966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017210488","spectrum_index":967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 132.0421 Da; putative annotation: N/A; putative formula: C6H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.092,"smiles":null,"spectrum_id":"CCMSLIB00017210489","spectrum_index":968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 91.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.196,"smiles":null,"spectrum_id":"CCMSLIB00017210490","spectrum_index":969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 279.1832 Da; putative annotation: N/A; putative formula: C16H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.373,"smiles":null,"spectrum_id":"CCMSLIB00017210491","spectrum_index":970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylimbricatolic acid (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.295,"smiles":null,"spectrum_id":"CCMSLIB00017210492","spectrum_index":971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10(S),17(S)-Dihydroxy-4Z,7Z,11E,13Z,15E,19Z-docosahexaenoic acid (delta mass: 36.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.259,"smiles":null,"spectrum_id":"CCMSLIB00017210493","spectrum_index":972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 189.1004 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.187,"smiles":null,"spectrum_id":"CCMSLIB00017210494","spectrum_index":973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 128.0684 Da; putative annotation: N/A; putative formula: H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.332,"smiles":null,"spectrum_id":"CCMSLIB00017210496","spectrum_index":974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid (delta mass: 95.0584 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.301,"smiles":null,"spectrum_id":"CCMSLIB00017210499","spectrum_index":975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003123 Intermedine N-oxide|[(7R,8R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl (2S)-2-hydroxy-2-[(1R)-1-hydroxyethyl]-3-methylbutanoate (delta mass: 162.053 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.228,"smiles":null,"spectrum_id":"CCMSLIB00017210500","spectrum_index":976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoyl-rac-glycerol (delta mass: 122.9093 Da; putative annotation: N/A; putative formula: H-1NOP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.423,"smiles":null,"spectrum_id":"CCMSLIB00017210501","spectrum_index":977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 346.3304 Da; putative annotation: N/A; putative formula: C23H42N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.373,"smiles":null,"spectrum_id":"CCMSLIB00017210502","spectrum_index":978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linalool oxide (delta mass: 76.0304 Da; putative annotation: N/A; putative formula: H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.168,"smiles":null,"spectrum_id":"CCMSLIB00017210503","spectrum_index":979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 88.0149 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.106,"smiles":null,"spectrum_id":"CCMSLIB00017210504","spectrum_index":980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 175.048 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.108,"smiles":null,"spectrum_id":"CCMSLIB00017210505","spectrum_index":981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 597.2421 Da; putative annotation: N/A; putative formula: C28H39NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.458,"smiles":null,"spectrum_id":"CCMSLIB00017210506","spectrum_index":982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 246.2448 Da; putative annotation: N/A; putative formula: C17H30N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.31,"smiles":null,"spectrum_id":"CCMSLIB00017210507","spectrum_index":983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP008201 Glycohyodeoxycholic acid|SCHEMBL1654508|2-[4-(3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid (delta mass: 445.2827 Da; putative annotation: N/A; putative formula: C26H39NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.604,"smiles":null,"spectrum_id":"CCMSLIB00017210508","spectrum_index":984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300243 Calycanthine (delta mass: 346.2351 Da; putative annotation: N/A; putative formula: C18H34O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.458,"smiles":null,"spectrum_id":"CCMSLIB00017210510","spectrum_index":985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 126.0746 Da; putative annotation: N/A; putative formula: C2H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.213,"smiles":null,"spectrum_id":"CCMSLIB00017210512","spectrum_index":986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 249.2449 Da; putative annotation: N/A; putative formula: C17H31N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.357,"smiles":null,"spectrum_id":"CCMSLIB00017210514","spectrum_index":987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.216,"smiles":null,"spectrum_id":"CCMSLIB00017210515","spectrum_index":988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phytomonic acid (delta mass: 74.0366 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.315,"smiles":null,"spectrum_id":"CCMSLIB00017210516","spectrum_index":989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-6,10,14,18-tetraene-2,3,22,23-tetrol (delta mass: 182.146 Da; putative annotation: N/A; putative formula: C15H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.555,"smiles":null,"spectrum_id":"CCMSLIB00017210517","spectrum_index":990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosanamide (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.42,"smiles":null,"spectrum_id":"CCMSLIB00017210518","spectrum_index":991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 147.0433 Da; putative annotation: N/A; putative formula: C7H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.15,"smiles":null,"spectrum_id":"CCMSLIB00017210519","spectrum_index":992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 251.1157 Da; putative annotation: N/A; putative formula: C13H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.186,"smiles":null,"spectrum_id":"CCMSLIB00017210520","spectrum_index":993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 166.9957 Da; putative annotation: N/A; putative formula: C7H6NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.28,"smiles":null,"spectrum_id":"CCMSLIB00017210521","spectrum_index":994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-2-carbaldehyde (delta mass: 91.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.118,"smiles":null,"spectrum_id":"CCMSLIB00017210522","spectrum_index":995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 68.0026 Da; putative annotation: N/A; putative formula: C2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.089,"smiles":null,"spectrum_id":"CCMSLIB00017210524","spectrum_index":996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 130.1725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.217,"smiles":null,"spectrum_id":"CCMSLIB00017210526","spectrum_index":997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 250.2193 Da; putative annotation: N/A; putative formula: C4H22N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.337,"smiles":null,"spectrum_id":"CCMSLIB00017210528","spectrum_index":998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 58.0461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.112,"smiles":null,"spectrum_id":"CCMSLIB00017210529","spectrum_index":999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 46.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.139,"smiles":null,"spectrum_id":"CCMSLIB00017210530","spectrum_index":1000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,19-Cyclolanost-25-ene-3,24-diol (delta mass: 15.0111 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.4,"smiles":null,"spectrum_id":"CCMSLIB00017210531","spectrum_index":1001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 194.1383 Da; putative annotation: N/A; putative formula: C7H14N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.36,"smiles":null,"spectrum_id":"CCMSLIB00017210532","spectrum_index":1002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 132.0857 Da; putative annotation: N/A; putative formula: CH8N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.37,"smiles":null,"spectrum_id":"CCMSLIB00017210533","spectrum_index":1003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 46.0064 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.077,"smiles":null,"spectrum_id":"CCMSLIB00017210534","spectrum_index":1004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 14.0133 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.152,"smiles":null,"spectrum_id":"CCMSLIB00017210536","spectrum_index":1005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy-4(15),11(13)-eudesmadien-12,6-olide (delta mass: 162.0515 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.2,"smiles":null,"spectrum_id":"CCMSLIB00017210537","spectrum_index":1006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 112.0311 Da; putative annotation: N/A; putative formula: C9H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.101,"smiles":null,"spectrum_id":"CCMSLIB00017210540","spectrum_index":1007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 189.1713 Da; putative annotation: N/A; putative formula: C6H19N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.456,"smiles":null,"spectrum_id":"CCMSLIB00017210541","spectrum_index":1008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 58.039 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.313,"smiles":null,"spectrum_id":"CCMSLIB00017210542","spectrum_index":1009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 41.0248 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.32,"smiles":null,"spectrum_id":"CCMSLIB00017210543","spectrum_index":1010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 179.1601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.259,"smiles":null,"spectrum_id":"CCMSLIB00017210544","spectrum_index":1011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rolipram (delta mass: 84.0365 Da; putative annotation: N/A; putative formula: C8H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.196,"smiles":null,"spectrum_id":"CCMSLIB00017210546","spectrum_index":1012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 94.0795 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.327,"smiles":null,"spectrum_id":"CCMSLIB00017210547","spectrum_index":1013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 111.0356 Da; putative annotation: N/A; putative formula: C4H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.127,"smiles":null,"spectrum_id":"CCMSLIB00017210548","spectrum_index":1014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid from NIST14 (delta mass: 91.075 Da; putative annotation: N/A; putative formula: C7H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.302,"smiles":null,"spectrum_id":"CCMSLIB00017210551","spectrum_index":1015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexadecanedioic acid (delta mass: 36.0348 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.257,"smiles":null,"spectrum_id":"CCMSLIB00017210552","spectrum_index":1016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 95.0356 Da; putative annotation: N/A; putative formula: CHN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.174,"smiles":null,"spectrum_id":"CCMSLIB00017210553","spectrum_index":1017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 377.1519 Da; putative annotation: N/A; putative formula: C17H31NO2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.394,"smiles":null,"spectrum_id":"CCMSLIB00017210554","spectrum_index":1018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 162.0152 Da; putative annotation: N/A; putative formula: C9H8O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.102,"smiles":null,"spectrum_id":"CCMSLIB00017210555","spectrum_index":1019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 1002.4781 Da; putative annotation: N/A; putative formula: C45H70N12O10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1224.58,"smiles":null,"spectrum_id":"CCMSLIB00017210556","spectrum_index":1020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 256.1316 Da; putative annotation: N/A; putative formula: C14H24S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.192,"smiles":null,"spectrum_id":"CCMSLIB00017210557","spectrum_index":1021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of QuinicAcid (delta mass: 233.0711 Da; putative annotation: N/A; putative formula: C11H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.142,"smiles":null,"spectrum_id":"CCMSLIB00017210559","spectrum_index":1022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclooctatin (delta mass: 144.0941 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017210561","spectrum_index":1023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-2-naphthol (delta mass: 9.9959 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.092,"smiles":null,"spectrum_id":"CCMSLIB00017210563","spectrum_index":1024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indolacetic acid (delta mass: 159.126 Da; putative annotation: N/A; putative formula: C8H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.197,"smiles":null,"spectrum_id":"CCMSLIB00017210564","spectrum_index":1025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 336.9294 Da; putative annotation: N/A; putative formula: C6H-1N3O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017210565","spectrum_index":1026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 271.1729 Da; putative annotation: N/A; putative formula: C13H27N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.327,"smiles":null,"spectrum_id":"CCMSLIB00017210566","spectrum_index":1027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 102.0493 Da; putative annotation: N/A; putative formula: C5H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.12,"smiles":null,"spectrum_id":"CCMSLIB00017210568","spectrum_index":1028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-ylmethylene)-1H-indene-1,3(2H)-dione (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.096,"smiles":null,"spectrum_id":"CCMSLIB00017210569","spectrum_index":1029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1082.6822 Da; putative annotation: N/A; putative formula: C50H86N18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1304.78,"smiles":null,"spectrum_id":"CCMSLIB00017210570","spectrum_index":1030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 113.0838 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.191,"smiles":null,"spectrum_id":"CCMSLIB00017210571","spectrum_index":1031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 694.4298 Da; putative annotation: N/A; putative formula: C39H66O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.5,"smiles":null,"spectrum_id":"CCMSLIB00017210573","spectrum_index":1032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 572.6895 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.781,"smiles":null,"spectrum_id":"CCMSLIB00017210575","spectrum_index":1033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13(S)-HODE methyl ester from NIST14 (delta mass: 279.257 Da; putative annotation: N/A; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.515,"smiles":null,"spectrum_id":"CCMSLIB00017210577","spectrum_index":1034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 136.0016 Da; putative annotation: N/A; putative formula: C4H8OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.093,"smiles":null,"spectrum_id":"CCMSLIB00017210578","spectrum_index":1035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 8.9894 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":113.06,"smiles":null,"spectrum_id":"CCMSLIB00017210579","spectrum_index":1036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 211.0699 Da; putative annotation: N/A; putative formula: C9H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.203,"smiles":null,"spectrum_id":"CCMSLIB00017210580","spectrum_index":1037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 474.3189 Da; putative annotation: N/A; putative formula: C25H46O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.358,"smiles":null,"spectrum_id":"CCMSLIB00017210581","spectrum_index":1038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 110.0518 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.419,"smiles":null,"spectrum_id":"CCMSLIB00017210582","spectrum_index":1039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 118.0785 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.415,"smiles":null,"spectrum_id":"CCMSLIB00017210583","spectrum_index":1040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 318.2561 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.327,"smiles":null,"spectrum_id":"CCMSLIB00017210584","spectrum_index":1041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 68.0623 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.42,"smiles":null,"spectrum_id":"CCMSLIB00017210586","spectrum_index":1042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 175.1208 Da; putative annotation: N/A; putative formula: C8H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.368,"smiles":null,"spectrum_id":"CCMSLIB00017210589","spectrum_index":1043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperidine-1-carboximidamide (delta mass: 46.0135 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.132,"smiles":null,"spectrum_id":"CCMSLIB00017210590","spectrum_index":1044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 352.2824 Da; putative annotation: N/A; putative formula: C22H42O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.53,"smiles":null,"spectrum_id":"CCMSLIB00017210591","spectrum_index":1045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 91.0634 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.275,"smiles":null,"spectrum_id":"CCMSLIB00017210592","spectrum_index":1046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 641.4957 Da; putative annotation: N/A; putative formula: C47H63N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.566,"smiles":null,"spectrum_id":"CCMSLIB00017210593","spectrum_index":1047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 53.9873 Da; putative annotation: N/A; putative formula: CH-2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.23,"smiles":null,"spectrum_id":"CCMSLIB00017210594","spectrum_index":1048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 36.0245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.09,"smiles":null,"spectrum_id":"CCMSLIB00017210595","spectrum_index":1049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Amino-2-propanol (delta mass: 40.0673 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":116.143,"smiles":null,"spectrum_id":"CCMSLIB00017210596","spectrum_index":1050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 505.2578 Da; putative annotation: N/A; putative formula: C29H35N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.329,"smiles":null,"spectrum_id":"CCMSLIB00017210597","spectrum_index":1051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 62.0493 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.245,"smiles":null,"spectrum_id":"CCMSLIB00017210598","spectrum_index":1052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 188.0331 Da; putative annotation: N/A; putative formula: C8H12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.124,"smiles":null,"spectrum_id":"CCMSLIB00017210601","spectrum_index":1053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 315.0656 Da; putative annotation: N/A; putative formula: C19H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.13,"smiles":null,"spectrum_id":"CCMSLIB00017210603","spectrum_index":1054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 64.0682 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.316,"smiles":null,"spectrum_id":"CCMSLIB00017210604","spectrum_index":1055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 88.0676 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.31,"smiles":null,"spectrum_id":"CCMSLIB00017210605","spectrum_index":1056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LYSINE (delta mass: 134.0369 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017210606","spectrum_index":1057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 160.0846 Da; putative annotation: N/A; putative formula: C6H12N2O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.134,"smiles":null,"spectrum_id":"CCMSLIB00017210607","spectrum_index":1058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 55.0416 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017210608","spectrum_index":1059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,3S)-3-hydroxy-1-octen-1-yl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5Z)- (delta mass: 78.0465 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.299,"smiles":null,"spectrum_id":"CCMSLIB00017210609","spectrum_index":1060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-methylglutaric acid (delta mass: 327.1311 Da; putative annotation: N/A; putative formula: C9H22N5O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.191,"smiles":null,"spectrum_id":"CCMSLIB00017210610","spectrum_index":1061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 90.0837 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017210611","spectrum_index":1062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Genipin (delta mass: 483.3197 Da; putative annotation: N/A; putative formula: C26H45NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.411,"smiles":null,"spectrum_id":"CCMSLIB00017210615","spectrum_index":1063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 23.0154 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.091,"smiles":null,"spectrum_id":"CCMSLIB00017210616","spectrum_index":1064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.097,"smiles":null,"spectrum_id":"CCMSLIB00017210617","spectrum_index":1065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 315.1321 Da; putative annotation: N/A; putative formula: C17H22N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.192,"smiles":null,"spectrum_id":"CCMSLIB00017210618","spectrum_index":1066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.175,"smiles":null,"spectrum_id":"CCMSLIB00017210619","spectrum_index":1067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-trans-Prostaglandin E3 (delta mass: 107.0934 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.31,"smiles":null,"spectrum_id":"CCMSLIB00017210620","spectrum_index":1068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 77.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.238,"smiles":null,"spectrum_id":"CCMSLIB00017210621","spectrum_index":1069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 301.2973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.587,"smiles":null,"spectrum_id":"CCMSLIB00017210622","spectrum_index":1070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 67.9871 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.058,"smiles":null,"spectrum_id":"CCMSLIB00017210623","spectrum_index":1071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 343.918 Da; putative annotation: N/A; putative formula: C10N8O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.989,"smiles":null,"spectrum_id":"CCMSLIB00017210624","spectrum_index":1072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 106.0303 Da; putative annotation: N/A; putative formula: C2H7N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.169,"smiles":null,"spectrum_id":"CCMSLIB00017210628","spectrum_index":1073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurane-17,18-dioic acid (delta mass: 66.0467 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.268,"smiles":null,"spectrum_id":"CCMSLIB00017210629","spectrum_index":1074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 110.0577 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.274,"smiles":null,"spectrum_id":"CCMSLIB00017210630","spectrum_index":1075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Norepiandrosterone (delta mass: 622.4217 Da; putative annotation: N/A; putative formula: C36H58N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.638,"smiles":null,"spectrum_id":"CCMSLIB00017210631","spectrum_index":1076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 22.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.095,"smiles":null,"spectrum_id":"CCMSLIB00017210632","spectrum_index":1077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 158.0176 Da; putative annotation: N/A; putative formula: C4H7N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.119,"smiles":null,"spectrum_id":"CCMSLIB00017210633","spectrum_index":1078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 41.0508 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017210634","spectrum_index":1079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Pyrrole-3-propanoic acid, 5-[(1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl]-2,4-dimethyl- (delta mass: 121.0891 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.228,"smiles":null,"spectrum_id":"CCMSLIB00017210635","spectrum_index":1080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 26.0504 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.152,"smiles":null,"spectrum_id":"CCMSLIB00017210636","spectrum_index":1081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 239.0791 Da; putative annotation: N/A; putative formula: C11H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.431,"smiles":null,"spectrum_id":"CCMSLIB00017210637","spectrum_index":1082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 429.3455 Da; putative annotation: N/A; putative formula: C24H47NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.645,"smiles":null,"spectrum_id":"CCMSLIB00017210638","spectrum_index":1083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,6-Trimethyl-1-(4-methylphenyl)-1,4-dihydro-2-pyrimidinethiol (delta mass: 170.1098 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.236,"smiles":null,"spectrum_id":"CCMSLIB00017210642","spectrum_index":1084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 94.0627 Da; putative annotation: N/A; putative formula: C4H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.128,"smiles":null,"spectrum_id":"CCMSLIB00017210643","spectrum_index":1085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 94.0059 Da; putative annotation: N/A; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.253,"smiles":null,"spectrum_id":"CCMSLIB00017210644","spectrum_index":1086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 114.0477 Da; putative annotation: N/A; putative formula: C9H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.207,"smiles":null,"spectrum_id":"CCMSLIB00017210645","spectrum_index":1087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine (delta mass: 54.0471 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.585,"smiles":null,"spectrum_id":"CCMSLIB00017210646","spectrum_index":1088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 32.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.091,"smiles":null,"spectrum_id":"CCMSLIB00017210647","spectrum_index":1089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Probenecid (delta mass: 461.133 Da; putative annotation: N/A; putative formula: C23H27NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.244,"smiles":null,"spectrum_id":"CCMSLIB00017210648","spectrum_index":1090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 94.0786 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017210649","spectrum_index":1091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 83.0406 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.179,"smiles":null,"spectrum_id":"CCMSLIB00017210650","spectrum_index":1092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 78.0835 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.243,"smiles":null,"spectrum_id":"CCMSLIB00017210651","spectrum_index":1093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 57.058 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.129,"smiles":null,"spectrum_id":"CCMSLIB00017210655","spectrum_index":1094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 42.0101 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017210656","spectrum_index":1095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 79.9847 Da; putative annotation: N/A; putative formula: C3N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.071,"smiles":null,"spectrum_id":"CCMSLIB00017210657","spectrum_index":1096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 90.0467 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.153,"smiles":null,"spectrum_id":"CCMSLIB00017210658","spectrum_index":1097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 132.0952 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.296,"smiles":null,"spectrum_id":"CCMSLIB00017210659","spectrum_index":1098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 286.0686 Da; putative annotation: N/A; putative formula: C12H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.129,"smiles":null,"spectrum_id":"CCMSLIB00017210660","spectrum_index":1099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 348.0639 Da; putative annotation: N/A; putative formula: C12H18N2O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.15,"smiles":null,"spectrum_id":"CCMSLIB00017210661","spectrum_index":1100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 349.2106 Da; putative annotation: N/A; putative formula: C19H32N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.271,"smiles":null,"spectrum_id":"CCMSLIB00017210662","spectrum_index":1101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D2 (delta mass: 479.1852 Da; putative annotation: N/A; putative formula: C22H25N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":892.527,"smiles":null,"spectrum_id":"CCMSLIB00017210663","spectrum_index":1102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 299.2826 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.509,"smiles":null,"spectrum_id":"CCMSLIB00017210664","spectrum_index":1103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.,16.alpha.-diol-17-one (delta mass: 64.0313 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.242,"smiles":null,"spectrum_id":"CCMSLIB00017210665","spectrum_index":1104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 41.0263 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.305,"smiles":null,"spectrum_id":"CCMSLIB00017210668","spectrum_index":1105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 423.1576 Da; putative annotation: N/A; putative formula: C17H31NO7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.291,"smiles":null,"spectrum_id":"CCMSLIB00017210670","spectrum_index":1106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caseadine (delta mass: 176.0318 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.202,"smiles":null,"spectrum_id":"CCMSLIB00017210671","spectrum_index":1107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 95.0621 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017210672","spectrum_index":1108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5S)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one (delta mass: 79.9571 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.079,"smiles":null,"spectrum_id":"CCMSLIB00017210673","spectrum_index":1109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 276.647 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.718,"smiles":null,"spectrum_id":"CCMSLIB00017210674","spectrum_index":1110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 108.0218 Da; putative annotation: 1,2,3-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017210675","spectrum_index":1111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 312.2418 Da; putative annotation: cis-7,10,13,16,19-Docosapentaenoic acid; putative formula: C22H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.458,"smiles":null,"spectrum_id":"CCMSLIB00017210676","spectrum_index":1112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180673-03!1,12,23-trihydroxy-1,6,12,17,23,28-hexazacyclotritriacontane-2,5,13,16,24,27-hexone [IIN-based: Match] (delta mass: 200.1162 Da; putative annotation: Massbank:NA001270 Pterosin B|(2R)-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one; putative formula: C14H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.472,"smiles":null,"spectrum_id":"CCMSLIB00017210677","spectrum_index":1113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 162.0321 Da; putative annotation: Caffeic acid; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.134,"smiles":null,"spectrum_id":"CCMSLIB00017210678","spectrum_index":1114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,13,15-Trihydroxy-5-methyl-4-oxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-3,11-dione (delta mass: 272.1038 Da; putative annotation: trans-Dehydrocurvularin; putative formula: C16H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.237,"smiles":null,"spectrum_id":"CCMSLIB00017210680","spectrum_index":1115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6,7,8-Tetrahydro-2-naphthalenecarboxylic acid (delta mass: 90.0469 Da; putative annotation: Benzyl alcohol; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.138,"smiles":null,"spectrum_id":"CCMSLIB00017210683","spectrum_index":1116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 100.0525 Da; putative annotation: 2-Hydroxy-2-methylbutyric acid; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.113,"smiles":null,"spectrum_id":"CCMSLIB00017210684","spectrum_index":1117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169972-02!3,6-dihydroxy-8-methoxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione [IIN-based: Match] (delta mass: 352.0949 Da; putative annotation: Paulownin; putative formula: C20H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.197,"smiles":null,"spectrum_id":"CCMSLIB00017210685","spectrum_index":1118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-8,11,14-Eicosatrienoic acid (delta mass: 308.2341 Da; putative annotation: 1,2-Dihydroxyheptadec-16-yn-4-yl acetate; putative formula: C19H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.497,"smiles":null,"spectrum_id":"CCMSLIB00017210686","spectrum_index":1119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 232.1469 Da; putative annotation: 3,7-Dihydroxy-9,11-eremophiladien-8-one; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.207,"smiles":null,"spectrum_id":"CCMSLIB00017210687","spectrum_index":1120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-palmitoyl-rac-glycerol (delta mass: 279.2558 Da; putative annotation: Palmitoleoyl ethanolamide; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.785,"smiles":null,"spectrum_id":"CCMSLIB00017210688","spectrum_index":1121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 228.1154 Da; putative annotation: Asp-Leu; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.181,"smiles":null,"spectrum_id":"CCMSLIB00017210689","spectrum_index":1122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1218.8149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1440.91,"smiles":null,"spectrum_id":"CCMSLIB00017210691","spectrum_index":1123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 206.1301 Da; putative annotation: 4-Hydroxy-4-[(E)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-2-en-1-one; putative formula: C13H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.211,"smiles":null,"spectrum_id":"CCMSLIB00017210692","spectrum_index":1124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 183.0897 Da; putative annotation: N2-Benzyl-1,3,5-triazine-2,4-diamine; putative formula: C10H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.16,"smiles":null,"spectrum_id":"CCMSLIB00017210695","spectrum_index":1125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 279.251 Da; putative annotation: Palmitoleoyl ethanolamide; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.525,"smiles":null,"spectrum_id":"CCMSLIB00017210696","spectrum_index":1126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 294.2557 Da; putative annotation: Ricinoleic acid methyl ester; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.519,"smiles":null,"spectrum_id":"CCMSLIB00017210697","spectrum_index":1127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 127.0624 Da; putative annotation: 2-Amino-5-oxohexanoic acid; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.154,"smiles":null,"spectrum_id":"CCMSLIB00017210698","spectrum_index":1128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385214-01_C35H54O9_beta-D-Xylopyranoside, 1,3,4,6,7,7a,7b,8,9,10,11,13,13a,15,15a-pentadecahydro-13-hydroxy-11-(1-hydroxy-1-methylethyl)-1,1,7a,8,13a-pentamethyl-10,12a-epoxy-2H,5H-cyclopropa[1',8'a]naphth[2',1':4,5]indeno[2,1-b]oxepin-2-yl (delta mass: 486.3283 Da; putative annotation: 1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid; putative formula: C30H46O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1105.71,"smiles":null,"spectrum_id":"CCMSLIB00017210699","spectrum_index":1129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)ethanol (delta mass: 374.283 Da; putative annotation: .beta.-Hyodeoxycholic acid; putative formula: C24H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.417,"smiles":null,"spectrum_id":"CCMSLIB00017210700","spectrum_index":1130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 189.0811 Da; putative annotation: Hydrastinine; putative formula: C11H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.167,"smiles":null,"spectrum_id":"CCMSLIB00017210701","spectrum_index":1131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 105.0215 Da; putative annotation: Nicotinic acid; putative formula: C6H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.145,"smiles":null,"spectrum_id":"CCMSLIB00017210702","spectrum_index":1132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 325.297 Da; putative annotation: N-Acetyldihydrosphingosine; putative formula: C20H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.56,"smiles":null,"spectrum_id":"CCMSLIB00017210704","spectrum_index":1133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2R,9R,10S,12S)-12-hydroxy-7,15-diazatetracyclo[7.7.1.0^{2,7}.0^{10,15}]heptadecan-6-one (delta mass: 227.1273 Da; putative annotation: Asn-Leu; putative formula: C10H17N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.318,"smiles":null,"spectrum_id":"CCMSLIB00017210705","spectrum_index":1134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Dodecanedioic acid from NIST14 (delta mass: 282.2568 Da; putative annotation: Spectral Match to 3-Hydroxyoctadecanoic Acid from NIST14; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.416,"smiles":null,"spectrum_id":"CCMSLIB00017210708","spectrum_index":1135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 162.0496 Da; putative annotation: D-(+)-Mannose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.078,"smiles":null,"spectrum_id":"CCMSLIB00017210709","spectrum_index":1136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxybenzoate (delta mass: 28.0315 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017210710","spectrum_index":1137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 232.0835 Da; putative annotation: N/A; putative formula: C6H13N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.269,"smiles":null,"spectrum_id":"CCMSLIB00017210711","spectrum_index":1138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 200.0843 Da; putative annotation: N/A; putative formula: C6H12N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.134,"smiles":null,"spectrum_id":"CCMSLIB00017210712","spectrum_index":1139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxyundecanoic acid (delta mass: 103.0088 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.173,"smiles":null,"spectrum_id":"CCMSLIB00017210713","spectrum_index":1140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 128.0841 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.164,"smiles":null,"spectrum_id":"CCMSLIB00017210714","spectrum_index":1141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 183.0896 Da; putative annotation: N/A; putative formula: C9H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.223,"smiles":null,"spectrum_id":"CCMSLIB00017210715","spectrum_index":1142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 776.8053 Da; putative annotation: N/A; putative formula: C51H104N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.877,"smiles":null,"spectrum_id":"CCMSLIB00017210716","spectrum_index":1143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 776.5149 Da; putative annotation: N/A; putative formula: C38H72N4O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.586,"smiles":null,"spectrum_id":"CCMSLIB00017210717","spectrum_index":1144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP012803 Benzoic acid (delta mass: 63.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017210718","spectrum_index":1145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 455.2014 Da; putative annotation: N/A; putative formula: C29H30NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.288,"smiles":null,"spectrum_id":"CCMSLIB00017210719","spectrum_index":1146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 670.1883 Da; putative annotation: N/A; putative formula: C48H31PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1175.36,"smiles":null,"spectrum_id":"CCMSLIB00017210722","spectrum_index":1147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 345.2483 Da; putative annotation: N/A; putative formula: C14H31N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.47,"smiles":null,"spectrum_id":"CCMSLIB00017210724","spectrum_index":1148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Morpholin-4-ylsulfonyl)piperidine-4-carboxylic acid (delta mass: 284.3891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.49,"smiles":null,"spectrum_id":"CCMSLIB00017210725","spectrum_index":1149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-oleoyl-sn-glycerol (delta mass: 311.246 Da; putative annotation: N/A; putative formula: C18H33NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.776,"smiles":null,"spectrum_id":"CCMSLIB00017210726","spectrum_index":1150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 457.1069 Da; putative annotation: N/A; putative formula: C21H15N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.178,"smiles":null,"spectrum_id":"CCMSLIB00017210727","spectrum_index":1151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin; AIF; CE0; MS2Dec (delta mass: 120.0393 Da; putative annotation: N/A; putative formula: H4N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.135,"smiles":null,"spectrum_id":"CCMSLIB00017210728","spectrum_index":1152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 80.0604 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.397,"smiles":null,"spectrum_id":"CCMSLIB00017210729","spectrum_index":1153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1246.8419 Da; putative annotation: N/A; putative formula: C66H110N12O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1468.94,"smiles":null,"spectrum_id":"CCMSLIB00017210730","spectrum_index":1154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 430.3049 Da; putative annotation: N/A; putative formula: C24H49P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":935.481,"smiles":null,"spectrum_id":"CCMSLIB00017210731","spectrum_index":1155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 965.4986 Da; putative annotation: N/A; putative formula: C49H75NO18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1158.57,"smiles":null,"spectrum_id":"CCMSLIB00017210732","spectrum_index":1156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 839.503 Da; putative annotation: N/A; putative formula: C44H73NO14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1032.57,"smiles":null,"spectrum_id":"CCMSLIB00017210733","spectrum_index":1157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 124.0638 Da; putative annotation: N/A; putative formula: C6H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.151,"smiles":null,"spectrum_id":"CCMSLIB00017210734","spectrum_index":1158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-hydroxy-1H-pyrimidin-4-one (delta mass: 18.0715 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.117,"smiles":null,"spectrum_id":"CCMSLIB00017210735","spectrum_index":1159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinamine (delta mass: 18.0094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":113.07,"smiles":null,"spectrum_id":"CCMSLIB00017210736","spectrum_index":1160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 198.0737 Da; putative annotation: N/A; putative formula: C9H15N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.332,"smiles":null,"spectrum_id":"CCMSLIB00017210737","spectrum_index":1161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,19,22,25,28,31-Tetratriacontahexaenoic acid, (all-Z)- (delta mass: 130.1138 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.549,"smiles":null,"spectrum_id":"CCMSLIB00017210738","spectrum_index":1162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 156.1301 Da; putative annotation: N/A; putative formula: C13H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.362,"smiles":null,"spectrum_id":"CCMSLIB00017210740","spectrum_index":1163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 552.2003 Da; putative annotation: N/A; putative formula: C23H32N6O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.281,"smiles":null,"spectrum_id":"CCMSLIB00017210741","spectrum_index":1164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 74.0733 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017210743","spectrum_index":1165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 156.1499 Da; putative annotation: N/A; putative formula: C6H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.21,"smiles":null,"spectrum_id":"CCMSLIB00017210744","spectrum_index":1166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 99.2545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.5,"smiles":null,"spectrum_id":"CCMSLIB00017210746","spectrum_index":1167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 423.3357 Da; putative annotation: N/A; putative formula: C26H49NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.625,"smiles":null,"spectrum_id":"CCMSLIB00017210747","spectrum_index":1168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 360.252 Da; putative annotation: N/A; putative formula: C20H40OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.406,"smiles":null,"spectrum_id":"CCMSLIB00017210748","spectrum_index":1169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Phe from NIST14 (delta mass: 15.9983 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.117,"smiles":null,"spectrum_id":"CCMSLIB00017210749","spectrum_index":1170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-11Z,13E-eicosadienoic acid (delta mass: 279.2583 Da; putative annotation: N/A; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.532,"smiles":null,"spectrum_id":"CCMSLIB00017210751","spectrum_index":1171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 266.2242 Da; putative annotation: N/A; putative formula: C17H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.261,"smiles":null,"spectrum_id":"CCMSLIB00017210752","spectrum_index":1172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 160.0644 Da; putative annotation: N/A; putative formula: C9H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.166,"smiles":null,"spectrum_id":"CCMSLIB00017210754","spectrum_index":1173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 26.0154 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":131.07,"smiles":null,"spectrum_id":"CCMSLIB00017210755","spectrum_index":1174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 88.0353 Da; putative annotation: N/A; putative formula: C4H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.086,"smiles":null,"spectrum_id":"CCMSLIB00017210756","spectrum_index":1175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 180.0625 Da; putative annotation: N/A; putative formula: C10H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.409,"smiles":null,"spectrum_id":"CCMSLIB00017210757","spectrum_index":1176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 371.2306 Da; putative annotation: N/A; putative formula: C19H33NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.301,"smiles":null,"spectrum_id":"CCMSLIB00017210759","spectrum_index":1177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lagochilin (delta mass: 118.0776 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.341,"smiles":null,"spectrum_id":"CCMSLIB00017210760","spectrum_index":1178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one (delta mass: 64.0316 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.191,"smiles":null,"spectrum_id":"CCMSLIB00017210761","spectrum_index":1179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 59.0482 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.145,"smiles":null,"spectrum_id":"CCMSLIB00017210763","spectrum_index":1180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 36.0362 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.258,"smiles":null,"spectrum_id":"CCMSLIB00017210764","spectrum_index":1181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 106.0264 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.098,"smiles":null,"spectrum_id":"CCMSLIB00017210766","spectrum_index":1182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 327.1787 Da; putative annotation: N/A; putative formula: C17H30NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.265,"smiles":null,"spectrum_id":"CCMSLIB00017210767","spectrum_index":1183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 169.1352 Da; putative annotation: N/A; putative formula: C7H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.211,"smiles":null,"spectrum_id":"CCMSLIB00017210768","spectrum_index":1184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Hydroxymethylbicyclo[2.2.1]hept-2-yl)methanol (delta mass: 74.0376 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.16,"smiles":null,"spectrum_id":"CCMSLIB00017210769","spectrum_index":1185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 8S-Hydroxy-5Z,9E,11Z,14Z-eicosatetraenoic acid from NIST14 (delta mass: 24.0362 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.279,"smiles":null,"spectrum_id":"CCMSLIB00017210770","spectrum_index":1186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid (delta mass: 130.1143 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.467,"smiles":null,"spectrum_id":"CCMSLIB00017210772","spectrum_index":1187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 555.3403 Da; putative annotation: N/A; putative formula: C27H37N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.562,"smiles":null,"spectrum_id":"CCMSLIB00017210773","spectrum_index":1188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Acetyl-16alpha-hydroxytrametenolic acid (delta mass: 90.0464 Da; putative annotation: N/A; putative formula: CH7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.419,"smiles":null,"spectrum_id":"CCMSLIB00017210775","spectrum_index":1189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACETIC ACID (delta mass: 83.0389 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.109,"smiles":null,"spectrum_id":"CCMSLIB00017210777","spectrum_index":1190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 619.4102 Da; putative annotation: N/A; putative formula: C36H53N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.47,"smiles":null,"spectrum_id":"CCMSLIB00017210778","spectrum_index":1191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hederagenin (delta mass: 114.0318 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.394,"smiles":null,"spectrum_id":"CCMSLIB00017210779","spectrum_index":1192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOATE - 40.0 eV (delta mass: 197.065 Da; putative annotation: N/A; putative formula: C4H11N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.12,"smiles":null,"spectrum_id":"CCMSLIB00017210780","spectrum_index":1193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HarmalolHCl2H2O///harmalol///Harmalol CollisionEnergy:102040 (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.129,"smiles":null,"spectrum_id":"CCMSLIB00017210781","spectrum_index":1194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 36.0194 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.366,"smiles":null,"spectrum_id":"CCMSLIB00017210782","spectrum_index":1195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 25.9795 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":130.05,"smiles":null,"spectrum_id":"CCMSLIB00017210783","spectrum_index":1196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 37.0313 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.086,"smiles":null,"spectrum_id":"CCMSLIB00017210784","spectrum_index":1197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 137.0469 Da; putative annotation: N/A; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.18,"smiles":null,"spectrum_id":"CCMSLIB00017210785","spectrum_index":1198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 86.0517 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.253,"smiles":null,"spectrum_id":"CCMSLIB00017210787","spectrum_index":1199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 242.2021 Da; putative annotation: N/A; putative formula: C12H27N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.471,"smiles":null,"spectrum_id":"CCMSLIB00017210788","spectrum_index":1200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.081,"smiles":null,"spectrum_id":"CCMSLIB00017210790","spectrum_index":1201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 70.0417 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.399,"smiles":null,"spectrum_id":"CCMSLIB00017210791","spectrum_index":1202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fucosterol (delta mass: 44.9922 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.37,"smiles":null,"spectrum_id":"CCMSLIB00017210793","spectrum_index":1203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 45.0587 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.301,"smiles":null,"spectrum_id":"CCMSLIB00017210794","spectrum_index":1204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 67.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.306,"smiles":null,"spectrum_id":"CCMSLIB00017210795","spectrum_index":1205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 265.1552 Da; putative annotation: N/A; putative formula: C10H24N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.257,"smiles":null,"spectrum_id":"CCMSLIB00017210796","spectrum_index":1206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxabicyclo[4.1.0]hept-3-en-2-one, 5-hydroxy-3-(hydroxymethyl)-1-(1-hydroxy-3-methyl-2-buten-1-yl)-4-(1-propen-1-yl)- (delta mass: 297.1526 Da; putative annotation: N/A; putative formula: C22H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.291,"smiles":null,"spectrum_id":"CCMSLIB00017210797","spectrum_index":1207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384803-01!2,4-dihydroxy-3-[(E)-4-hydroxy-3-methyl-5-(1,2,6-trimethyl-3-oxocyclohexyl)pent-2-enyl]-6-methylbenzaldehyde (delta mass: 101.0815 Da; putative annotation: N/A; putative formula: CH7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.314,"smiles":null,"spectrum_id":"CCMSLIB00017210798","spectrum_index":1208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Cyclopentylpropyl)methylamine (delta mass: 365.3299 Da; putative annotation: N/A; putative formula: C23H43NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.489,"smiles":null,"spectrum_id":"CCMSLIB00017210800","spectrum_index":1209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 79.9671 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.136,"smiles":null,"spectrum_id":"CCMSLIB00017210802","spectrum_index":1210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:102040 (delta mass: 108.1148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.159,"smiles":null,"spectrum_id":"CCMSLIB00017210804","spectrum_index":1211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 273.2762 Da; putative annotation: N/A; putative formula: C11H31N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.342,"smiles":null,"spectrum_id":"CCMSLIB00017210805","spectrum_index":1212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethoxy)benzaldehyde (delta mass: 58.0204 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.091,"smiles":null,"spectrum_id":"CCMSLIB00017210806","spectrum_index":1213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 76.031 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.086,"smiles":null,"spectrum_id":"CCMSLIB00017210807","spectrum_index":1214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Pyridin-2-yloxy)aniline (delta mass: 42.9943 Da; putative annotation: N/A; putative formula: CH2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.081,"smiles":null,"spectrum_id":"CCMSLIB00017210808","spectrum_index":1215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylazepane (delta mass: 50.0225 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.166,"smiles":null,"spectrum_id":"CCMSLIB00017210809","spectrum_index":1216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 144.0778 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.175,"smiles":null,"spectrum_id":"CCMSLIB00017210811","spectrum_index":1217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Gallic acid from NIST14 (delta mass: 66.0315 Da; putative annotation: N/A; putative formula: C2H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.06,"smiles":null,"spectrum_id":"CCMSLIB00017210812","spectrum_index":1218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 22.9793 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.15,"smiles":null,"spectrum_id":"CCMSLIB00017210813","spectrum_index":1219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 329.2029 Da; putative annotation: N/A; putative formula: C17H31NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.247,"smiles":null,"spectrum_id":"CCMSLIB00017210815","spectrum_index":1220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 264.0916 Da; putative annotation: N/A; putative formula: C14H17O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.147,"smiles":null,"spectrum_id":"CCMSLIB00017210816","spectrum_index":1221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 344.2214 Da; putative annotation: N/A; putative formula: C19H28N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.438,"smiles":null,"spectrum_id":"CCMSLIB00017210818","spectrum_index":1222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 206.0829 Da; putative annotation: N/A; putative formula: C8H11N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.185,"smiles":null,"spectrum_id":"CCMSLIB00017210819","spectrum_index":1223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 268.2763 Da; putative annotation: N/A; putative formula: C18H36O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.313,"smiles":null,"spectrum_id":"CCMSLIB00017210820","spectrum_index":1224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 122.0975 Da; putative annotation: N/A; putative formula: C6H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.237,"smiles":null,"spectrum_id":"CCMSLIB00017210821","spectrum_index":1225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Methoxyphenyl)acetic acid (delta mass: 39.9876 Da; putative annotation: N/A; putative formula: C2HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.058,"smiles":null,"spectrum_id":"CCMSLIB00017210823","spectrum_index":1226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300679 Kainic acid (delta mass: 129.1511 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.259,"smiles":null,"spectrum_id":"CCMSLIB00017210825","spectrum_index":1227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 15.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.19,"smiles":null,"spectrum_id":"CCMSLIB00017210826","spectrum_index":1228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 19.018 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.37,"smiles":null,"spectrum_id":"CCMSLIB00017210827","spectrum_index":1229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 276.1575 Da; putative annotation: N/A; putative formula: C13H24O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.363,"smiles":null,"spectrum_id":"CCMSLIB00017210829","spectrum_index":1230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxohexanedioic acid (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017210830","spectrum_index":1231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 253.2047 Da; putative annotation: N/A; putative formula: C15H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.354,"smiles":null,"spectrum_id":"CCMSLIB00017210831","spectrum_index":1232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 27.9942 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.081,"smiles":null,"spectrum_id":"CCMSLIB00017210833","spectrum_index":1233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 111.9431 Da; putative annotation: N/A; putative formula: C4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.045,"smiles":null,"spectrum_id":"CCMSLIB00017210834","spectrum_index":1234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethyl-4-pentenoic acid (delta mass: 61.0534 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.144,"smiles":null,"spectrum_id":"CCMSLIB00017210836","spectrum_index":1235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 140.058 Da; putative annotation: N/A; putative formula: C6H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.149,"smiles":null,"spectrum_id":"CCMSLIB00017210837","spectrum_index":1236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 89.0474 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.118,"smiles":null,"spectrum_id":"CCMSLIB00017210838","spectrum_index":1237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-((4R)-4-((5R,7R,8R,9S,10S,12S,13R,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid\"\" (delta mass: 35.0386 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.322,"smiles":null,"spectrum_id":"CCMSLIB00017210840","spectrum_index":1238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 521.6965 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.734,"smiles":null,"spectrum_id":"CCMSLIB00017210841","spectrum_index":1239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 72.0576 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017210843","spectrum_index":1240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 337.2638 Da; putative annotation: N/A; putative formula: C21H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.491,"smiles":null,"spectrum_id":"CCMSLIB00017210844","spectrum_index":1241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 385.1208 Da; putative annotation: N/A; putative formula: C18H19N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.29,"smiles":null,"spectrum_id":"CCMSLIB00017210846","spectrum_index":1242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00244969-01!4-[[2-[(E)-3-hydroxybut-1-enyl]-5-oxooxolan-3-yl]amino]benzaldehyde (delta mass: 102.0609 Da; putative annotation: N/A; putative formula: C4H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.184,"smiles":null,"spectrum_id":"CCMSLIB00017210847","spectrum_index":1243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 156.0786 Da; putative annotation: N/A; putative formula: C8H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.331,"smiles":null,"spectrum_id":"CCMSLIB00017210848","spectrum_index":1244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 401.2844 Da; putative annotation: N/A; putative formula: C25H40NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.49,"smiles":null,"spectrum_id":"CCMSLIB00017210851","spectrum_index":1245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2,6-Dimethylmorpholin-4-yl)ethanol (delta mass: 75.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.202,"smiles":null,"spectrum_id":"CCMSLIB00017210853","spectrum_index":1246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 504.7597 Da; putative annotation: N/A; putative formula: H-1N3O19S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.83,"smiles":null,"spectrum_id":"CCMSLIB00017210854","spectrum_index":1247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 195.1119 Da; putative annotation: N/A; putative formula: C8H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.209,"smiles":null,"spectrum_id":"CCMSLIB00017210855","spectrum_index":1248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 95.0566 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.242,"smiles":null,"spectrum_id":"CCMSLIB00017210856","spectrum_index":1249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxo-4-cholestenoic acid (delta mass: 67.0259 Da; putative annotation: N/A; putative formula: CHN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.347,"smiles":null,"spectrum_id":"CCMSLIB00017210857","spectrum_index":1250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid CollisionEnergy:102040 (delta mass: 105.0785 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.342,"smiles":null,"spectrum_id":"CCMSLIB00017210858","spectrum_index":1251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OMEGA-HYDROXYDODECANOIC ACID (delta mass: 52.0674 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.247,"smiles":null,"spectrum_id":"CCMSLIB00017210859","spectrum_index":1252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 63.9617 Da; putative annotation: N/A; putative formula: O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.173,"smiles":null,"spectrum_id":"CCMSLIB00017210862","spectrum_index":1253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.134,"smiles":null,"spectrum_id":"CCMSLIB00017210863","spectrum_index":1254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 144.0421 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.253,"smiles":null,"spectrum_id":"CCMSLIB00017210865","spectrum_index":1255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 262.1972 Da; putative annotation: N/A; putative formula: C16H27N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.268,"smiles":null,"spectrum_id":"CCMSLIB00017210866","spectrum_index":1256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 168.1151 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.175,"smiles":null,"spectrum_id":"CCMSLIB00017210867","spectrum_index":1257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 710.2742 Da; putative annotation: N/A; putative formula: C27H42N12O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.365,"smiles":null,"spectrum_id":"CCMSLIB00017210868","spectrum_index":1258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetylbenzoic acid (delta mass: 92.0471 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017210869","spectrum_index":1259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 280.1154 Da; putative annotation: N/A; putative formula: C11H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.154,"smiles":null,"spectrum_id":"CCMSLIB00017210870","spectrum_index":1260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 17.1017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.204,"smiles":null,"spectrum_id":"CCMSLIB00017210872","spectrum_index":1261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 149.0685 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.144,"smiles":null,"spectrum_id":"CCMSLIB00017210874","spectrum_index":1262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017210876","spectrum_index":1263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 683.2493 Da; putative annotation: N/A; putative formula: C46H37NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.32,"smiles":null,"spectrum_id":"CCMSLIB00017210877","spectrum_index":1264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017210878","spectrum_index":1265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.28,"smiles":null,"spectrum_id":"CCMSLIB00017210879","spectrum_index":1266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 14.999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.059,"smiles":null,"spectrum_id":"CCMSLIB00017210880","spectrum_index":1267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 76.0679 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.149,"smiles":null,"spectrum_id":"CCMSLIB00017210881","spectrum_index":1268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 269.0803 Da; putative annotation: N/A; putative formula: C14H11N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.288,"smiles":null,"spectrum_id":"CCMSLIB00017210883","spectrum_index":1269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 156.1159 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.395,"smiles":null,"spectrum_id":"CCMSLIB00017210884","spectrum_index":1270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 249.0863 Da; putative annotation: N/A; putative formula: C10H11N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.178,"smiles":null,"spectrum_id":"CCMSLIB00017210886","spectrum_index":1271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 75.032 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.071,"smiles":null,"spectrum_id":"CCMSLIB00017210888","spectrum_index":1272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethoxyethanol (delta mass: 46.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.113,"smiles":null,"spectrum_id":"CCMSLIB00017210889","spectrum_index":1273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 74.0555 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.126,"smiles":null,"spectrum_id":"CCMSLIB00017210890","spectrum_index":1274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N.epsilon.-Acetyl-L-lysine (delta mass: 129.0423 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.166,"smiles":null,"spectrum_id":"CCMSLIB00017210891","spectrum_index":1275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 904.3893 Da; putative annotation: N/A; putative formula: C50H56N4O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1163.51,"smiles":null,"spectrum_id":"CCMSLIB00017210893","spectrum_index":1276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 72.0301 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.08,"smiles":null,"spectrum_id":"CCMSLIB00017210894","spectrum_index":1277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 59.0237 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.09,"smiles":null,"spectrum_id":"CCMSLIB00017210895","spectrum_index":1278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 16.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.1,"smiles":null,"spectrum_id":"CCMSLIB00017210896","spectrum_index":1279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 15.0103 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.075,"smiles":null,"spectrum_id":"CCMSLIB00017210899","spectrum_index":1280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 30.0108 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.086,"smiles":null,"spectrum_id":"CCMSLIB00017210900","spectrum_index":1281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 70.0053 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.081,"smiles":null,"spectrum_id":"CCMSLIB00017210902","spectrum_index":1282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 68.0623 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.378,"smiles":null,"spectrum_id":"CCMSLIB00017210903","spectrum_index":1283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 105.0574 Da; putative annotation: N/A; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.112,"smiles":null,"spectrum_id":"CCMSLIB00017210904","spectrum_index":1284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 50.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.117,"smiles":null,"spectrum_id":"CCMSLIB00017210905","spectrum_index":1285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,2,3,4-Tetrahydro-9H-carbazol-9-yl)propanohydrazide (delta mass: 161.0786 Da; putative annotation: N/A; putative formula: C7H16NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.239,"smiles":null,"spectrum_id":"CCMSLIB00017210906","spectrum_index":1286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol CollisionEnergy:205060 (delta mass: 103.0084 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.214,"smiles":null,"spectrum_id":"CCMSLIB00017210907","spectrum_index":1287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 128.0659 Da; putative annotation: N/A; putative formula: C7H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.418,"smiles":null,"spectrum_id":"CCMSLIB00017210908","spectrum_index":1288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 492.4406 Da; putative annotation: N/A; putative formula: C29H56N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.516,"smiles":null,"spectrum_id":"CCMSLIB00017210909","spectrum_index":1289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 298.1458 Da; putative annotation: N/A; putative formula: C15H19N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.221,"smiles":null,"spectrum_id":"CCMSLIB00017210911","spectrum_index":1290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 143.0995 Da; putative annotation: N/A; putative formula: C6H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.176,"smiles":null,"spectrum_id":"CCMSLIB00017210914","spectrum_index":1291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 68.0262 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017210915","spectrum_index":1292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 99.922 Da; putative annotation: N/A; putative formula: C2H-1O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.013,"smiles":null,"spectrum_id":"CCMSLIB00017210916","spectrum_index":1293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 96.0573 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.268,"smiles":null,"spectrum_id":"CCMSLIB00017210917","spectrum_index":1294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 177.0759 Da; putative annotation: N/A; putative formula: C6H15N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.141,"smiles":null,"spectrum_id":"CCMSLIB00017210918","spectrum_index":1295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 203.0798 Da; putative annotation: N/A; putative formula: C3H10N9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.359,"smiles":null,"spectrum_id":"CCMSLIB00017210919","spectrum_index":1296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 102.0759 Da; putative annotation: N/A; putative formula: H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.173,"smiles":null,"spectrum_id":"CCMSLIB00017210921","spectrum_index":1297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100449 D(-)-Threose|D-Threo-tetrose|D-threo-Aldose (delta mass: 15.0058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.055,"smiles":null,"spectrum_id":"CCMSLIB00017210922","spectrum_index":1298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylene glycol (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.159,"smiles":null,"spectrum_id":"CCMSLIB00017210923","spectrum_index":1299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 74.0481 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.108,"smiles":null,"spectrum_id":"CCMSLIB00017210925","spectrum_index":1300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.065,"smiles":null,"spectrum_id":"CCMSLIB00017210927","spectrum_index":1301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 310.2608 Da; putative annotation: N/A; putative formula: C18H34N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.362,"smiles":null,"spectrum_id":"CCMSLIB00017210928","spectrum_index":1302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-6-Octadecenoic acid (delta mass: 79.0093 Da; putative annotation: N/A; putative formula: C4HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.272,"smiles":null,"spectrum_id":"CCMSLIB00017210929","spectrum_index":1303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9H-Xanthene-4-acetic acid, 5,6-dimethyl-9-oxo- (delta mass: 81.0427 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.139,"smiles":null,"spectrum_id":"CCMSLIB00017210930","spectrum_index":1304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 489.1843 Da; putative annotation: N/A; putative formula: C19H27N11OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.221,"smiles":null,"spectrum_id":"CCMSLIB00017210932","spectrum_index":1305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 625.3688 Da; putative annotation: N/A; putative formula: C30H51N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.44,"smiles":null,"spectrum_id":"CCMSLIB00017210933","spectrum_index":1306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 1025.6511 Da; putative annotation: N/A; putative formula: C52H91N5O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1206.72,"smiles":null,"spectrum_id":"CCMSLIB00017210934","spectrum_index":1307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quercetin-3,7-O-a-L-dirhamnoside (delta mass: 162.0523 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.218,"smiles":null,"spectrum_id":"CCMSLIB00017210935","spectrum_index":1308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 179.0671 Da; putative annotation: N/A; putative formula: C4H5N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.149,"smiles":null,"spectrum_id":"CCMSLIB00017210938","spectrum_index":1309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 42.0102 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017210939","spectrum_index":1310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kenpaullone (delta mass: 325.2008 Da; putative annotation: N/A; putative formula: C17H31N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.214,"smiles":null,"spectrum_id":"CCMSLIB00017210941","spectrum_index":1311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10Z,14E)-6,14-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid (delta mass: 12.0001 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.19,"smiles":null,"spectrum_id":"CCMSLIB00017210942","spectrum_index":1312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-methoxybenzyl)ethanamine (delta mass: 120.051 Da; putative annotation: N/A; putative formula: C8H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.195,"smiles":null,"spectrum_id":"CCMSLIB00017210943","spectrum_index":1313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)ethylamine (delta mass: 77.0728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.154,"smiles":null,"spectrum_id":"CCMSLIB00017210944","spectrum_index":1314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 60.0215 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.118,"smiles":null,"spectrum_id":"CCMSLIB00017210945","spectrum_index":1315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 99.4036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.5,"smiles":null,"spectrum_id":"CCMSLIB00017210946","spectrum_index":1316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 174.1295 Da; putative annotation: N/A; putative formula: C7H18N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.274,"smiles":null,"spectrum_id":"CCMSLIB00017210948","spectrum_index":1317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 268.0281 Da; putative annotation: N/A; putative formula: C10H4N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.119,"smiles":null,"spectrum_id":"CCMSLIB00017210951","spectrum_index":1318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 77.0152 Da; putative annotation: N/A; putative formula: H4N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017210952","spectrum_index":1319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 737.5306 Da; putative annotation: N/A; putative formula: C39H71N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1044.79,"smiles":null,"spectrum_id":"CCMSLIB00017210953","spectrum_index":1320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100091 3,4-Dihydroxy-L-phenylalanine|L-DOPA|L-3-Hydroxytyrosine|Levodopa|3-(3,4-Dihydroxyphenyl)-L-alanine|DOPA (delta mass: 180.0419 Da; putative annotation: N/A; putative formula: C9H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.118,"smiles":null,"spectrum_id":"CCMSLIB00017210954","spectrum_index":1321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desmethylsildenafil (delta mass: 43.0042 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.201,"smiles":null,"spectrum_id":"CCMSLIB00017210955","spectrum_index":1322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 14.0151 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.294,"smiles":null,"spectrum_id":"CCMSLIB00017210956","spectrum_index":1323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000697723-01! (delta mass: 56.1199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.237,"smiles":null,"spectrum_id":"CCMSLIB00017210957","spectrum_index":1324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 322.015 Da; putative annotation: N/A; putative formula: C14H10O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.075,"smiles":null,"spectrum_id":"CCMSLIB00017210958","spectrum_index":1325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 12.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.102,"smiles":null,"spectrum_id":"CCMSLIB00017210961","spectrum_index":1326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Pro (delta mass: 216.0744 Da; putative annotation: N/A; putative formula: C8H12N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.213,"smiles":null,"spectrum_id":"CCMSLIB00017210963","spectrum_index":1327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 144.0947 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.327,"smiles":null,"spectrum_id":"CCMSLIB00017210964","spectrum_index":1328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufalin (delta mass: 181.1672 Da; putative annotation: N/A; putative formula: C9H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.42,"smiles":null,"spectrum_id":"CCMSLIB00017210965","spectrum_index":1329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 122.036 Da; putative annotation: N/A; putative formula: CH7N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.154,"smiles":null,"spectrum_id":"CCMSLIB00017210966","spectrum_index":1330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 143.0957 Da; putative annotation: N/A; putative formula: C7H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.193,"smiles":null,"spectrum_id":"CCMSLIB00017210967","spectrum_index":1331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 165.0788 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.196,"smiles":null,"spectrum_id":"CCMSLIB00017210968","spectrum_index":1332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(6-methyl-6-azabicyclo[4.4.0]dec-2-yl)methyl 3-aminopropanoate, iodide CollisionEnergy:205060\"\" (delta mass: 17.0153 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.222,"smiles":null,"spectrum_id":"CCMSLIB00017210969","spectrum_index":1333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 178.135 Da; putative annotation: N/A; putative formula: C12H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.205,"smiles":null,"spectrum_id":"CCMSLIB00017210972","spectrum_index":1334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 362.182 Da; putative annotation: N/A; putative formula: C23H26N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.305,"smiles":null,"spectrum_id":"CCMSLIB00017210974","spectrum_index":1335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eicosapentaenoyl ethanolamide (delta mass: 35.9768 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.251,"smiles":null,"spectrum_id":"CCMSLIB00017210975","spectrum_index":1336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.113,"smiles":null,"spectrum_id":"CCMSLIB00017210976","spectrum_index":1337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 661.2988 Da; putative annotation: N/A; putative formula: C30H44N7O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.453,"smiles":null,"spectrum_id":"CCMSLIB00017210977","spectrum_index":1338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Methylsulfonyl)-13-(3-pentyloxiranyl)-5Z,8Z,11Z-tridecatrienamide (delta mass: 130.0719 Da; putative annotation: N/A; putative formula: C5H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.308,"smiles":null,"spectrum_id":"CCMSLIB00017210978","spectrum_index":1339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 243.0857 Da; putative annotation: N/A; putative formula: C9H13N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.156,"smiles":null,"spectrum_id":"CCMSLIB00017210979","spectrum_index":1340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 17.0752 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.208,"smiles":null,"spectrum_id":"CCMSLIB00017210980","spectrum_index":1341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 18.0836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.138,"smiles":null,"spectrum_id":"CCMSLIB00017210983","spectrum_index":1342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Methionine (delta mass: 56.026 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.084,"smiles":null,"spectrum_id":"CCMSLIB00017210985","spectrum_index":1343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gibberellin A14 (delta mass: 218.0534 Da; putative annotation: N/A; putative formula: C9H15O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.254,"smiles":null,"spectrum_id":"CCMSLIB00017210986","spectrum_index":1344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 16.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017210987","spectrum_index":1345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 307.2879 Da; putative annotation: N/A; putative formula: C20H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.421,"smiles":null,"spectrum_id":"CCMSLIB00017210988","spectrum_index":1346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[(2,5,5,8a-Tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol (delta mass: 92.0629 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.316,"smiles":null,"spectrum_id":"CCMSLIB00017210989","spectrum_index":1347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 737.7041 Da; putative annotation: N/A; putative formula: C50H91NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":962.816,"smiles":null,"spectrum_id":"CCMSLIB00017210990","spectrum_index":1348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 35.8886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.1,"smiles":null,"spectrum_id":"CCMSLIB00017210994","spectrum_index":1349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy-4(15),11(13)-eudesmadien-12,6-olide (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.164,"smiles":null,"spectrum_id":"CCMSLIB00017210995","spectrum_index":1350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxabicyclo[4.1.0]hept-3-en-2-one, 5-hydroxy-3-(hydroxymethyl)-1-(1-hydroxy-3-methyl-2-buten-1-yl)-4-(1-propen-1-yl)- (delta mass: 59.0368 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.175,"smiles":null,"spectrum_id":"CCMSLIB00017210996","spectrum_index":1351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-(methylsulfanyl)-1H-indole-2-carboxylate (delta mass: 47.0586 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.117,"smiles":null,"spectrum_id":"CCMSLIB00017210997","spectrum_index":1352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zizanoic acid (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.18,"smiles":null,"spectrum_id":"CCMSLIB00017210998","spectrum_index":1353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 81.0092 Da; putative annotation: N/A; putative formula: CH-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.111,"smiles":null,"spectrum_id":"CCMSLIB00017210999","spectrum_index":1354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 58.0043 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.064,"smiles":null,"spectrum_id":"CCMSLIB00017211000","spectrum_index":1355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 80.1409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.242,"smiles":null,"spectrum_id":"CCMSLIB00017211001","spectrum_index":1356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 193.3837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.564,"smiles":null,"spectrum_id":"CCMSLIB00017211002","spectrum_index":1357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzoic acid (delta mass: 112.0308 Da; putative annotation: N/A; putative formula: C9H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.07,"smiles":null,"spectrum_id":"CCMSLIB00017211003","spectrum_index":1358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 95.0691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.223,"smiles":null,"spectrum_id":"CCMSLIB00017211007","spectrum_index":1359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis,cis-9,12-Octadecadien-1-ol (delta mass: 42.0102 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.278,"smiles":null,"spectrum_id":"CCMSLIB00017211008","spectrum_index":1360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 14.0149 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.278,"smiles":null,"spectrum_id":"CCMSLIB00017211009","spectrum_index":1361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 76.016 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017211010","spectrum_index":1362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 15.9957 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.28,"smiles":null,"spectrum_id":"CCMSLIB00017211011","spectrum_index":1363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 36.056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.215,"smiles":null,"spectrum_id":"CCMSLIB00017211012","spectrum_index":1364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 117.049 Da; putative annotation: N/A; putative formula: C2H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.097,"smiles":null,"spectrum_id":"CCMSLIB00017211013","spectrum_index":1365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLYCOCHOLATE - 20.0 eV (delta mass: 60.0316 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.348,"smiles":null,"spectrum_id":"CCMSLIB00017211014","spectrum_index":1366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3?-Hydroxy-7 Ketolithocholic Acid (delta mass: 203.1892 Da; putative annotation: N/A; putative formula: C7H21N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.474,"smiles":null,"spectrum_id":"CCMSLIB00017211015","spectrum_index":1367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 404.1534 Da; putative annotation: N/A; putative formula: C17H29N2O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1071.38,"smiles":null,"spectrum_id":"CCMSLIB00017211016","spectrum_index":1368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 115.0458 Da; putative annotation: N/A; putative formula: C5H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.174,"smiles":null,"spectrum_id":"CCMSLIB00017211020","spectrum_index":1369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 299.2836 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.5,"smiles":null,"spectrum_id":"CCMSLIB00017211021","spectrum_index":1370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 14.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.175,"smiles":null,"spectrum_id":"CCMSLIB00017211022","spectrum_index":1371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 80.0623 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017211023","spectrum_index":1372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 64.0672 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017211024","spectrum_index":1373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-cis-Retinol (delta mass: 46.0031 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.24,"smiles":null,"spectrum_id":"CCMSLIB00017211025","spectrum_index":1374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 48.0341 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.271,"smiles":null,"spectrum_id":"CCMSLIB00017211026","spectrum_index":1375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PETROSELINIC ACID (delta mass: 88.0155 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.279,"smiles":null,"spectrum_id":"CCMSLIB00017211027","spectrum_index":1376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PETROSELINIC ACID (delta mass: 89.0568 Da; putative annotation: N/A; putative formula: C2H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.32,"smiles":null,"spectrum_id":"CCMSLIB00017211028","spectrum_index":1377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 76.0762 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.355,"smiles":null,"spectrum_id":"CCMSLIB00017211030","spectrum_index":1378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 699.4944 Da; putative annotation: N/A; putative formula: C40H61N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1083.64,"smiles":null,"spectrum_id":"CCMSLIB00017211033","spectrum_index":1379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 178.0966 Da; putative annotation: N/A; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.141,"smiles":null,"spectrum_id":"CCMSLIB00017211034","spectrum_index":1380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 115.0996 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.233,"smiles":null,"spectrum_id":"CCMSLIB00017211035","spectrum_index":1381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 128.1053 Da; putative annotation: N/A; putative formula: C5H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.35,"smiles":null,"spectrum_id":"CCMSLIB00017211036","spectrum_index":1382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 283.0415 Da; putative annotation: N/A; putative formula: C14H9N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.218,"smiles":null,"spectrum_id":"CCMSLIB00017211037","spectrum_index":1383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 446.2867 Da; putative annotation: N/A; putative formula: C20H34N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.566,"smiles":null,"spectrum_id":"CCMSLIB00017211038","spectrum_index":1384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 144.0421 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.258,"smiles":null,"spectrum_id":"CCMSLIB00017211039","spectrum_index":1385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 222.1009 Da; putative annotation: N/A; putative formula: C11H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.188,"smiles":null,"spectrum_id":"CCMSLIB00017211040","spectrum_index":1386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000104 5-hydroxyculmorin|(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol (delta mass: 170.1545 Da; putative annotation: N/A; putative formula: C8H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.35,"smiles":null,"spectrum_id":"CCMSLIB00017211042","spectrum_index":1387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 185.1694 Da; putative annotation: N/A; putative formula: C11H24NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.37,"smiles":null,"spectrum_id":"CCMSLIB00017211043","spectrum_index":1388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 138.1411 Da; putative annotation: N/A; putative formula: C10H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.378,"smiles":null,"spectrum_id":"CCMSLIB00017211046","spectrum_index":1389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C15:1 (delta mass: 18.0112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.249,"smiles":null,"spectrum_id":"CCMSLIB00017211047","spectrum_index":1390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 293.1374 Da; putative annotation: N/A; putative formula: C14H19N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.176,"smiles":null,"spectrum_id":"CCMSLIB00017211048","spectrum_index":1391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 35.0592 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.163,"smiles":null,"spectrum_id":"CCMSLIB00017211049","spectrum_index":1392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 210.056 Da; putative annotation: N/A; putative formula: C7H14O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.133,"smiles":null,"spectrum_id":"CCMSLIB00017211050","spectrum_index":1393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 141.0128 Da; putative annotation: N/A; putative formula: C3H3N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.108,"smiles":null,"spectrum_id":"CCMSLIB00017211051","spectrum_index":1394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 86.0534 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.296,"smiles":null,"spectrum_id":"CCMSLIB00017211053","spectrum_index":1395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 140.0976 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.329,"smiles":null,"spectrum_id":"CCMSLIB00017211054","spectrum_index":1396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.beta.-Homophenylalanine (delta mass: 129.0431 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017211055","spectrum_index":1397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 176.0688 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.238,"smiles":null,"spectrum_id":"CCMSLIB00017211056","spectrum_index":1398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 337.1005 Da; putative annotation: N/A; putative formula: C25H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.171,"smiles":null,"spectrum_id":"CCMSLIB00017211058","spectrum_index":1399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucose_6-phosphate (delta mass: 290.1265 Da; putative annotation: N/A; putative formula: C15H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.164,"smiles":null,"spectrum_id":"CCMSLIB00017211060","spectrum_index":1400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 170.0514 Da; putative annotation: N/A; putative formula: C7H10N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.133,"smiles":null,"spectrum_id":"CCMSLIB00017211062","spectrum_index":1401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 60.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.285,"smiles":null,"spectrum_id":"CCMSLIB00017211063","spectrum_index":1402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 131.0942 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.181,"smiles":null,"spectrum_id":"CCMSLIB00017211064","spectrum_index":1403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 256.24 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.363,"smiles":null,"spectrum_id":"CCMSLIB00017211065","spectrum_index":1404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301051 Harmane (delta mass: 35.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.133,"smiles":null,"spectrum_id":"CCMSLIB00017211066","spectrum_index":1405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 57.0467 Da; putative annotation: N/A; putative formula: H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.102,"smiles":null,"spectrum_id":"CCMSLIB00017211068","spectrum_index":1406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 79.96 Da; putative annotation: N/A; putative formula: H2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.206,"smiles":null,"spectrum_id":"CCMSLIB00017211069","spectrum_index":1407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 291.0916 Da; putative annotation: N/A; putative formula: C11H17NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.242,"smiles":null,"spectrum_id":"CCMSLIB00017211070","spectrum_index":1408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 42.0718 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.258,"smiles":null,"spectrum_id":"CCMSLIB00017211073","spectrum_index":1409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 269.1215 Da; putative annotation: N/A; putative formula: C12H21N3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.245,"smiles":null,"spectrum_id":"CCMSLIB00017211074","spectrum_index":1410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 70.0764 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.136,"smiles":null,"spectrum_id":"CCMSLIB00017211075","spectrum_index":1411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Methyl-6-oxopyran-3-yl)butanoic acid (delta mass: 212.0682 Da; putative annotation: N/A; putative formula: C10H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.149,"smiles":null,"spectrum_id":"CCMSLIB00017211077","spectrum_index":1412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 346.1186 Da; putative annotation: N/A; putative formula: C15H23O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.21,"smiles":null,"spectrum_id":"CCMSLIB00017211078","spectrum_index":1413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 561.6998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.791,"smiles":null,"spectrum_id":"CCMSLIB00017211079","spectrum_index":1414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.102,"smiles":null,"spectrum_id":"CCMSLIB00017211080","spectrum_index":1415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 362.0614 Da; putative annotation: N/A; putative formula: C10H19O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.185,"smiles":null,"spectrum_id":"CCMSLIB00017211083","spectrum_index":1416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 33.9616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.173,"smiles":null,"spectrum_id":"CCMSLIB00017211084","spectrum_index":1417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chaulmoogric Acid (delta mass: 72.0215 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.269,"smiles":null,"spectrum_id":"CCMSLIB00017211086","spectrum_index":1418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 118.0626 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.159,"smiles":null,"spectrum_id":"CCMSLIB00017211087","spectrum_index":1419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Coumaric acid (delta mass: 376.3708 Da; putative annotation: N/A; putative formula: C26H48O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.425,"smiles":null,"spectrum_id":"CCMSLIB00017211088","spectrum_index":1420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 15.0184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.266,"smiles":null,"spectrum_id":"CCMSLIB00017211089","spectrum_index":1421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 482.2506 Da; putative annotation: N/A; putative formula: C30H34N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":775.462,"smiles":null,"spectrum_id":"CCMSLIB00017211090","spectrum_index":1422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxy-.DELTA.9-tetrahydrocannabinol (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.238,"smiles":null,"spectrum_id":"CCMSLIB00017211091","spectrum_index":1423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 14,15-EE-(8Z)-E from NIST14 (delta mass: 14.0152 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.289,"smiles":null,"spectrum_id":"CCMSLIB00017211094","spectrum_index":1424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1a,1b-Dihomoprostaglandin E1 (delta mass: 52.0675 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.347,"smiles":null,"spectrum_id":"CCMSLIB00017211096","spectrum_index":1425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 174.9217 Da; putative annotation: N/A; putative formula: C4HNOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.993,"smiles":null,"spectrum_id":"CCMSLIB00017211097","spectrum_index":1426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 365.7875 Da; putative annotation: N/A; putative formula: C9H2S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.848,"smiles":null,"spectrum_id":"CCMSLIB00017211098","spectrum_index":1427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 63.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.228,"smiles":null,"spectrum_id":"CCMSLIB00017211102","spectrum_index":1428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 80.1432 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.214,"smiles":null,"spectrum_id":"CCMSLIB00017211103","spectrum_index":1429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lactose from NIST14 (delta mass: 346.0859 Da; putative annotation: N/A; putative formula: C15H10N10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.209,"smiles":null,"spectrum_id":"CCMSLIB00017211104","spectrum_index":1430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholestan-3-ol, (3.alpha.,5.beta.)- (delta mass: 79.9746 Da; putative annotation: N/A; putative formula: O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.352,"smiles":null,"spectrum_id":"CCMSLIB00017211106","spectrum_index":1431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 85.0163 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.088,"smiles":null,"spectrum_id":"CCMSLIB00017211107","spectrum_index":1432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Statine (delta mass: 83.037 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017211108","spectrum_index":1433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 129.0418 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.186,"smiles":null,"spectrum_id":"CCMSLIB00017211111","spectrum_index":1434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cyclohexylethanol (delta mass: 175.1226 Da; putative annotation: N/A; putative formula: C9H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.25,"smiles":null,"spectrum_id":"CCMSLIB00017211112","spectrum_index":1435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000399 Serine|2-amino-3-hydroxypropanoic acid (delta mass: 57.0215 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.071,"smiles":null,"spectrum_id":"CCMSLIB00017211113","spectrum_index":1436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 17.004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.075,"smiles":null,"spectrum_id":"CCMSLIB00017211114","spectrum_index":1437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017211115","spectrum_index":1438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 595.3289 Da; putative annotation: N/A; putative formula: C32H46N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":908.472,"smiles":null,"spectrum_id":"CCMSLIB00017211116","spectrum_index":1439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 218.158 Da; putative annotation: N/A; putative formula: C15H23O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.24,"smiles":null,"spectrum_id":"CCMSLIB00017211118","spectrum_index":1440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 10.0206 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.175,"smiles":null,"spectrum_id":"CCMSLIB00017211119","spectrum_index":1441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Limaprost (delta mass: 78.0472 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.311,"smiles":null,"spectrum_id":"CCMSLIB00017211120","spectrum_index":1442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1047.9831 Da; putative annotation: N/A; putative formula: C77H125NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1270.08,"smiles":null,"spectrum_id":"CCMSLIB00017211123","spectrum_index":1443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.3,"smiles":null,"spectrum_id":"CCMSLIB00017211124","spectrum_index":1444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 377.2413 Da; putative annotation: N/A; putative formula: C18H35NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.463,"smiles":null,"spectrum_id":"CCMSLIB00017211125","spectrum_index":1445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 395.2518 Da; putative annotation: N/A; putative formula: C25H33NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.479,"smiles":null,"spectrum_id":"CCMSLIB00017211126","spectrum_index":1446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 513.3521 Da; putative annotation: N/A; putative formula: C35H48NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.568,"smiles":null,"spectrum_id":"CCMSLIB00017211127","spectrum_index":1447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 146.0696 Da; putative annotation: N/A; putative formula: C5H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.129,"smiles":null,"spectrum_id":"CCMSLIB00017211128","spectrum_index":1448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[Hydroxy(phenyl)methyl]-1-[2-(3-methylbutanoylamino)ethyl]-4-oxopyridine-3-carboxylic acid (delta mass: 46.0065 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.182,"smiles":null,"spectrum_id":"CCMSLIB00017211129","spectrum_index":1449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-hydroxybenzo(a)pyrene (delta mass: 194.2341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.33,"smiles":null,"spectrum_id":"CCMSLIB00017211131","spectrum_index":1450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 183.1359 Da; putative annotation: N/A; putative formula: C9H17N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.28,"smiles":null,"spectrum_id":"CCMSLIB00017211132","spectrum_index":1451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 103.0267 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.165,"smiles":null,"spectrum_id":"CCMSLIB00017211133","spectrum_index":1452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 254.1876 Da; putative annotation: N/A; putative formula: C15H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.378,"smiles":null,"spectrum_id":"CCMSLIB00017211136","spectrum_index":1453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 82.0412 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.263,"smiles":null,"spectrum_id":"CCMSLIB00017211137","spectrum_index":1454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linalool oxide (delta mass: 78.0424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.18,"smiles":null,"spectrum_id":"CCMSLIB00017211138","spectrum_index":1455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxybenzoic acid (delta mass: 248.1044 Da; putative annotation: N/A; putative formula: C14H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.18,"smiles":null,"spectrum_id":"CCMSLIB00017211139","spectrum_index":1456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 191.0951 Da; putative annotation: N/A; putative formula: C11H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.16,"smiles":null,"spectrum_id":"CCMSLIB00017211141","spectrum_index":1457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranic acid (delta mass: 193.0587 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.181,"smiles":null,"spectrum_id":"CCMSLIB00017211142","spectrum_index":1458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 374.1915 Da; putative annotation: N/A; putative formula: C22H30O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.256,"smiles":null,"spectrum_id":"CCMSLIB00017211143","spectrum_index":1459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 93.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.31,"smiles":null,"spectrum_id":"CCMSLIB00017211144","spectrum_index":1460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 43.0057 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.113,"smiles":null,"spectrum_id":"CCMSLIB00017211145","spectrum_index":1461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 642.5232 Da; putative annotation: N/A; putative formula: C42H66N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":937.75,"smiles":null,"spectrum_id":"CCMSLIB00017211148","spectrum_index":1462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 52.0314 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.098,"smiles":null,"spectrum_id":"CCMSLIB00017211149","spectrum_index":1463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 214.0242 Da; putative annotation: N/A; putative formula: C16H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.1,"smiles":null,"spectrum_id":"CCMSLIB00017211151","spectrum_index":1464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 54.0835 Da; putative annotation: N/A; putative formula: C5H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.164,"smiles":null,"spectrum_id":"CCMSLIB00017211152","spectrum_index":1465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 1125.2098 Da; putative annotation: N/A; putative formula: C45H54N5O19P3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1550.39,"smiles":null,"spectrum_id":"CCMSLIB00017211153","spectrum_index":1466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 486.2448 Da; putative annotation: N/A; putative formula: C21H38N6O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.305,"smiles":null,"spectrum_id":"CCMSLIB00017211154","spectrum_index":1467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 201.5727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.664,"smiles":null,"spectrum_id":"CCMSLIB00017211155","spectrum_index":1468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100015 Serotonin|5-HT|5-Hydoxytryptamine|3-(2-Aminoethyl)-5-hydroxyindole|Enteramine (delta mass: 771.6178 Da; putative annotation: N/A; putative formula: C51H81NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":948.72,"smiles":null,"spectrum_id":"CCMSLIB00017211156","spectrum_index":1469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Cyclopentylpropyl)methylamine (delta mass: 616.5914 Da; putative annotation: N/A; putative formula: C40H76N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.75,"smiles":null,"spectrum_id":"CCMSLIB00017211157","spectrum_index":1470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 127.1613 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.253,"smiles":null,"spectrum_id":"CCMSLIB00017211158","spectrum_index":1471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 221.0618 Da; putative annotation: N/A; putative formula: C10H11N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.103,"smiles":null,"spectrum_id":"CCMSLIB00017211161","spectrum_index":1472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 286.2513 Da; putative annotation: N/A; putative formula: C17H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.53,"smiles":null,"spectrum_id":"CCMSLIB00017211163","spectrum_index":1473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE30; MS2Dec (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.077,"smiles":null,"spectrum_id":"CCMSLIB00017211164","spectrum_index":1474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 50.0533 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.343,"smiles":null,"spectrum_id":"CCMSLIB00017211165","spectrum_index":1475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 128.0833 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017211166","spectrum_index":1476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid methyl ester (delta mass: 184.1308 Da; putative annotation: N/A; putative formula: C4H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.514,"smiles":null,"spectrum_id":"CCMSLIB00017211167","spectrum_index":1477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Hydroxyphenyllactic acid (delta mass: 27.0477 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.113,"smiles":null,"spectrum_id":"CCMSLIB00017211168","spectrum_index":1478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 41.9037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.99,"smiles":null,"spectrum_id":"CCMSLIB00017211170","spectrum_index":1479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alisol B acetate (delta mass: 114.0819 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.455,"smiles":null,"spectrum_id":"CCMSLIB00017211171","spectrum_index":1480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 100.0655 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.324,"smiles":null,"spectrum_id":"CCMSLIB00017211174","spectrum_index":1481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 28.0312 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.081,"smiles":null,"spectrum_id":"CCMSLIB00017211175","spectrum_index":1482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.113,"smiles":null,"spectrum_id":"CCMSLIB00017211176","spectrum_index":1483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 333.1054 Da; putative annotation: N/A; putative formula: C13H19NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.187,"smiles":null,"spectrum_id":"CCMSLIB00017211177","spectrum_index":1484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopetasol (delta mass: 82.0414 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017211178","spectrum_index":1485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pentenedioic acid, 2-octyl- (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.175,"smiles":null,"spectrum_id":"CCMSLIB00017211179","spectrum_index":1486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 38.0154 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017211181","spectrum_index":1487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 238.9926 Da; putative annotation: N/A; putative formula: C6HN5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.084,"smiles":null,"spectrum_id":"CCMSLIB00017211182","spectrum_index":1488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 117.0419 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.133,"smiles":null,"spectrum_id":"CCMSLIB00017211184","spectrum_index":1489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 605.2147 Da; putative annotation: N/A; putative formula: C32H31N9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.285,"smiles":null,"spectrum_id":"CCMSLIB00017211186","spectrum_index":1490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Pro (delta mass: 97.0536 Da; putative annotation: PROLINE; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.177,"smiles":null,"spectrum_id":"CCMSLIB00017211187","spectrum_index":1491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384771-01![(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-4,4,6,6-tetramethyl-2-(2-methylprop-1-enyl)-3,5-dioxocyclohexyl]oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate (delta mass: 152.0114 Da; putative annotation: Phloroglucinolcarboxylic acid; putative formula: C7H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.234,"smiles":null,"spectrum_id":"CCMSLIB00017211188","spectrum_index":1492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Pro from NIST14 (delta mass: 226.1115 Da; putative annotation: 3-Benzylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione; putative formula: C14H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.25,"smiles":null,"spectrum_id":"CCMSLIB00017211189","spectrum_index":1493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 330.2197 Da; putative annotation: Kaurane-17,18-dioic acid, 18-methyl ester, (4.alpha.,16.alpha.)-; putative formula: C21H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.452,"smiles":null,"spectrum_id":"CCMSLIB00017211191","spectrum_index":1494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169029-02_C15H22O3_Naphtho[2,3-b]furan-2(4H)-one, 4a,5,6,7,8,8a,9,9a-octahydro-9a-hydroxy-3,4a,5-trimethyl-, (4aR,5S,8aS,9aR)- (delta mass: 250.156 Da; putative annotation: NCGC00385647-01_C15H24O4_2-[(4aS,7R,8R)-7,8-Dihydroxy-4a,8-dimethyldecahydro-2-naphthalenyl]acrylic acid; putative formula: C15H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.32,"smiles":null,"spectrum_id":"CCMSLIB00017211192","spectrum_index":1495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 164.0839 Da; putative annotation: 1-(4-Methoxyphenyl)propane-1,2-diol; putative formula: C10H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.202,"smiles":null,"spectrum_id":"CCMSLIB00017211193","spectrum_index":1496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 193.0224 Da; putative annotation: PHOSPHOCREATINE - 20.0 eV; putative formula: C4H8N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.12,"smiles":null,"spectrum_id":"CCMSLIB00017211194","spectrum_index":1497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 316.2408 Da; putative annotation: 5.alpha.-Pregnane-3.alpha.,21-diol-20-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.364,"smiles":null,"spectrum_id":"CCMSLIB00017211197","spectrum_index":1498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Thr (delta mass: 212.0784 Da; putative annotation: Asp-Pro; putative formula: C9H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.186,"smiles":null,"spectrum_id":"CCMSLIB00017211198","spectrum_index":1499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonoylglycerol (delta mass: 409.2384 Da; putative annotation: Arachidonoyl ethanolamide phosphate; putative formula: C22H36NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.523,"smiles":null,"spectrum_id":"CCMSLIB00017211199","spectrum_index":1500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 164.0843 Da; putative annotation: \"\"(1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid CollisionEnergy:205060\"\"; putative formula: C10H12O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.421,"smiles":null,"spectrum_id":"CCMSLIB00017211200","spectrum_index":1501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 132.0962 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.328,"smiles":null,"spectrum_id":"CCMSLIB00017211201","spectrum_index":1502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 368.3443 Da; putative annotation: Cholesterol; putative formula: C27H44)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.409,"smiles":null,"spectrum_id":"CCMSLIB00017211202","spectrum_index":1503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 234.1104 Da; putative annotation: Pro-His; putative formula: C11H14N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.207,"smiles":null,"spectrum_id":"CCMSLIB00017211203","spectrum_index":1504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 198.1287 Da; putative annotation: Virginiaebutanolide C; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.2,"smiles":null,"spectrum_id":"CCMSLIB00017211205","spectrum_index":1505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 132.0934 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.32,"smiles":null,"spectrum_id":"CCMSLIB00017211207","spectrum_index":1506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-docosahexaenoyl-sn-glycerol (delta mass: 283.2872 Da; putative annotation: D-erythro-Sphinganine; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":952.833,"smiles":null,"spectrum_id":"CCMSLIB00017211209","spectrum_index":1507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 652.1888 Da; putative annotation: (1aS,1bS,2S,5aR,6S,6aS)-6-((6-Deoxy-3-O-((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl)-.alpha.-L-mannopyranosyl)oxy)-1a-(hydroxymethyl)-1a,1b,2,5a,6,6a-hexahydrooxireno[4,5]cyclopenta[1,2-c]pyran-2-yl .beta.-D-glucopyranoside; putative formula: C30H36O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.26,"smiles":null,"spectrum_id":"CCMSLIB00017211210","spectrum_index":1508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 234.199 Da; putative annotation: Palmitic acid alkyne; putative formula: C16H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.426,"smiles":null,"spectrum_id":"CCMSLIB00017211211","spectrum_index":1509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 333.2299 Da; putative annotation: N-3-Oxohexadec-11Z-enoyl-L-homoserine lactone; putative formula: C20H31NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.477,"smiles":null,"spectrum_id":"CCMSLIB00017211212","spectrum_index":1510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 325.2991 Da; putative annotation: N-Acetyldihydrosphingosine; putative formula: C20H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.562,"smiles":null,"spectrum_id":"CCMSLIB00017211213","spectrum_index":1511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 205.0739 Da; putative annotation: 2-Amino-3-[4-(carboxymethyl)phenyl]propanoic acid; putative formula: C11H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.139,"smiles":null,"spectrum_id":"CCMSLIB00017211214","spectrum_index":1512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 358.2506 Da; putative annotation: Mevastatin; putative formula: C23H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.482,"smiles":null,"spectrum_id":"CCMSLIB00017211216","spectrum_index":1513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pristanic acid (delta mass: 146.073 Da; putative annotation: .beta.-Thujaplicin; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.367,"smiles":null,"spectrum_id":"CCMSLIB00017211217","spectrum_index":1514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 225.1738 Da; putative annotation: Gly-C11:0; putative formula: C13H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.432,"smiles":null,"spectrum_id":"CCMSLIB00017211220","spectrum_index":1515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 197.0941 Da; putative annotation: N-(4-Methoxybenzyl)-2-pyrimidinamine; putative formula: C12H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.154,"smiles":null,"spectrum_id":"CCMSLIB00017211221","spectrum_index":1516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatrienoic acid (delta mass: 96.952 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.246,"smiles":null,"spectrum_id":"CCMSLIB00017211223","spectrum_index":1517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8Z,14Z-Eicosadienoic acid (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.306,"smiles":null,"spectrum_id":"CCMSLIB00017211224","spectrum_index":1518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 54.0465 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.252,"smiles":null,"spectrum_id":"CCMSLIB00017211225","spectrum_index":1519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 255.2196 Da; putative annotation: N/A; putative formula: C15H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.472,"smiles":null,"spectrum_id":"CCMSLIB00017211226","spectrum_index":1520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 51.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.4,"smiles":null,"spectrum_id":"CCMSLIB00017211228","spectrum_index":1521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 96.0574 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017211230","spectrum_index":1522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 316.2398 Da; putative annotation: N/A; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.331,"smiles":null,"spectrum_id":"CCMSLIB00017211231","spectrum_index":1523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Oxyclozapine (delta mass: 131.0316 Da; putative annotation: N/A; putative formula: C5H10NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.164,"smiles":null,"spectrum_id":"CCMSLIB00017211232","spectrum_index":1524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 14.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.056,"smiles":null,"spectrum_id":"CCMSLIB00017211234","spectrum_index":1525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Hyodeoxycholic acid (delta mass: 88.0674 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.367,"smiles":null,"spectrum_id":"CCMSLIB00017211235","spectrum_index":1526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 831.2391 Da; putative annotation: N/A; putative formula: C35H43N7O13P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":941.31,"smiles":null,"spectrum_id":"CCMSLIB00017211236","spectrum_index":1527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 92.0469 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.326,"smiles":null,"spectrum_id":"CCMSLIB00017211237","spectrum_index":1528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 244.2099 Da; putative annotation: N/A; putative formula: C12H28N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.349,"smiles":null,"spectrum_id":"CCMSLIB00017211238","spectrum_index":1529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU089301 Volinanserin (delta mass: 238.1531 Da; putative annotation: N/A; putative formula: C10H18N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.366,"smiles":null,"spectrum_id":"CCMSLIB00017211240","spectrum_index":1530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(18)-Epoxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid (delta mass: 48.0367 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.263,"smiles":null,"spectrum_id":"CCMSLIB00017211242","spectrum_index":1531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 98.9517 Da; putative annotation: N/A; putative formula: C2H-2NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.199,"smiles":null,"spectrum_id":"CCMSLIB00017211244","spectrum_index":1532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 229.1824 Da; putative annotation: N/A; putative formula: C16H23N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.253,"smiles":null,"spectrum_id":"CCMSLIB00017211245","spectrum_index":1533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 159.9245 Da; putative annotation: N/A; putative formula: H3O4P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.022,"smiles":null,"spectrum_id":"CCMSLIB00017211246","spectrum_index":1534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.-Hydroxytestosterone (delta mass: 176.0315 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.243,"smiles":null,"spectrum_id":"CCMSLIB00017211247","spectrum_index":1535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid (delta mass: 106.0636 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.431,"smiles":null,"spectrum_id":"CCMSLIB00017211248","spectrum_index":1536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1a,1b-Dihomoprostaglandin E1 (delta mass: 98.0342 Da; putative annotation: N/A; putative formula: CH2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.313,"smiles":null,"spectrum_id":"CCMSLIB00017211250","spectrum_index":1537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brassicasterol (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017211251","spectrum_index":1538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 330.277 Da; putative annotation: N/A; putative formula: C19H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.493,"smiles":null,"spectrum_id":"CCMSLIB00017211252","spectrum_index":1539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,19,22,25,28,31-Tetratriacontahexaenoic acid, (all-Z)- (delta mass: 104.0993 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.535,"smiles":null,"spectrum_id":"CCMSLIB00017211255","spectrum_index":1540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 17.9381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017211256","spectrum_index":1541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 187.1574 Da; putative annotation: N/A; putative formula: C10H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.217,"smiles":null,"spectrum_id":"CCMSLIB00017211258","spectrum_index":1542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 79.0423 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017211259","spectrum_index":1543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 80.0218 Da; putative annotation: N/A; putative formula: CN6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.191,"smiles":null,"spectrum_id":"CCMSLIB00017211260","spectrum_index":1544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-8-Methyl-6-nonenoic acid (delta mass: 85.0148 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.153,"smiles":null,"spectrum_id":"CCMSLIB00017211261","spectrum_index":1545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 511.6801 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.761,"smiles":null,"spectrum_id":"CCMSLIB00017211262","spectrum_index":1546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 108.094 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.321,"smiles":null,"spectrum_id":"CCMSLIB00017211263","spectrum_index":1547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 88.0703 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.313,"smiles":null,"spectrum_id":"CCMSLIB00017211266","spectrum_index":1548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 17.9846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.227,"smiles":null,"spectrum_id":"CCMSLIB00017211268","spectrum_index":1549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 106.1713 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.268,"smiles":null,"spectrum_id":"CCMSLIB00017211269","spectrum_index":1550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 152.1046 Da; putative annotation: N/A; putative formula: C7H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.457,"smiles":null,"spectrum_id":"CCMSLIB00017211270","spectrum_index":1551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid, methyl ester (delta mass: 101.0847 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.343,"smiles":null,"spectrum_id":"CCMSLIB00017211271","spectrum_index":1552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 90.0474 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.113,"smiles":null,"spectrum_id":"CCMSLIB00017211272","spectrum_index":1553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 125.0689 Da; putative annotation: N/A; putative formula: C4H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.316,"smiles":null,"spectrum_id":"CCMSLIB00017211273","spectrum_index":1554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 176.0586 Da; putative annotation: N/A; putative formula: C9H8N2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.15,"smiles":null,"spectrum_id":"CCMSLIB00017211274","spectrum_index":1555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 82.0782 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.263,"smiles":null,"spectrum_id":"CCMSLIB00017211275","spectrum_index":1556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 162.0527 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.186,"smiles":null,"spectrum_id":"CCMSLIB00017211276","spectrum_index":1557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385388-01_C21H34O11_(1R,4S,7S,8S,9R,12E,20R,21R,22S,23S)-7,8,21,22,23-Pentahydroxy-12,16-dimethyl-3,5,10,19,24-pentaoxatricyclo[18.3.1.0~4,9~]tetracos-12-en-11-one (delta mass: 78.0169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.234,"smiles":null,"spectrum_id":"CCMSLIB00017211279","spectrum_index":1558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 449.3515 Da; putative annotation: N/A; putative formula: C28H51NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.454,"smiles":null,"spectrum_id":"CCMSLIB00017211281","spectrum_index":1559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 73.9045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.136,"smiles":null,"spectrum_id":"CCMSLIB00017211282","spectrum_index":1560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 433.27 Da; putative annotation: N/A; putative formula: C23H31N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.46,"smiles":null,"spectrum_id":"CCMSLIB00017211283","spectrum_index":1561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 96.0946 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.306,"smiles":null,"spectrum_id":"CCMSLIB00017211284","spectrum_index":1562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 292.2385 Da; putative annotation: N/A; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.309,"smiles":null,"spectrum_id":"CCMSLIB00017211285","spectrum_index":1563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norverapamil (delta mass: 386.0277 Da; putative annotation: N/A; putative formula: C11H18N2O7S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":827.302,"smiles":null,"spectrum_id":"CCMSLIB00017211286","spectrum_index":1564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 268.0368 Da; putative annotation: N/A; putative formula: C7H12N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.16,"smiles":null,"spectrum_id":"CCMSLIB00017211287","spectrum_index":1565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 15.9774 Da; putative annotation: N/A; putative formula: O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.08,"smiles":null,"spectrum_id":"CCMSLIB00017211288","spectrum_index":1566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 97.9764 Da; putative annotation: N/A; putative formula: C2H-2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.042,"smiles":null,"spectrum_id":"CCMSLIB00017211291","spectrum_index":1567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 192.3984 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.5,"smiles":null,"spectrum_id":"CCMSLIB00017211293","spectrum_index":1568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyphenylacetone (delta mass: 224.2502 Da; putative annotation: N/A; putative formula: C16H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.336,"smiles":null,"spectrum_id":"CCMSLIB00017211294","spectrum_index":1569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 468.2578 Da; putative annotation: N/A; putative formula: C22H44O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.323,"smiles":null,"spectrum_id":"CCMSLIB00017211295","spectrum_index":1570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 67.0792 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.129,"smiles":null,"spectrum_id":"CCMSLIB00017211296","spectrum_index":1571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 100.016 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017211297","spectrum_index":1572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 87.0703 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.25,"smiles":null,"spectrum_id":"CCMSLIB00017211298","spectrum_index":1573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 145.5439 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.615,"smiles":null,"spectrum_id":"CCMSLIB00017211299","spectrum_index":1574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 27.0359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.154,"smiles":null,"spectrum_id":"CCMSLIB00017211301","spectrum_index":1575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 695.4087 Da; putative annotation: N/A; putative formula: C46H53N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1050.69,"smiles":null,"spectrum_id":"CCMSLIB00017211304","spectrum_index":1576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 252.2453 Da; putative annotation: N/A; putative formula: C17H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.29,"smiles":null,"spectrum_id":"CCMSLIB00017211305","spectrum_index":1577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 259.1341 Da; putative annotation: N/A; putative formula: C12H22NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.356,"smiles":null,"spectrum_id":"CCMSLIB00017211306","spectrum_index":1578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Secalonic acid B (delta mass: 654.1792 Da; putative annotation: N/A; putative formula: C27H30N10O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1293.35,"smiles":null,"spectrum_id":"CCMSLIB00017211307","spectrum_index":1579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 28.0316 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.108,"smiles":null,"spectrum_id":"CCMSLIB00017211308","spectrum_index":1580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 265.2284 Da; putative annotation: N/A; putative formula: C14H27N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.315,"smiles":null,"spectrum_id":"CCMSLIB00017211309","spectrum_index":1581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 68.0257 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.096,"smiles":null,"spectrum_id":"CCMSLIB00017211311","spectrum_index":1582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 263.1733 Da; putative annotation: N/A; putative formula: C12H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.238,"smiles":null,"spectrum_id":"CCMSLIB00017211314","spectrum_index":1583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 70.0628 Da; putative annotation: N/A; putative formula: C2H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.274,"smiles":null,"spectrum_id":"CCMSLIB00017211315","spectrum_index":1584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 89.9633 Da; putative annotation: N/A; putative formula: H-1N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.19,"smiles":null,"spectrum_id":"CCMSLIB00017211316","spectrum_index":1585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 119.0723 Da; putative annotation: N/A; putative formula: C2H10N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.159,"smiles":null,"spectrum_id":"CCMSLIB00017211317","spectrum_index":1586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 49.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.316,"smiles":null,"spectrum_id":"CCMSLIB00017211318","spectrum_index":1587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 108.0946 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.342,"smiles":null,"spectrum_id":"CCMSLIB00017211319","spectrum_index":1588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 144.1298 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.513,"smiles":null,"spectrum_id":"CCMSLIB00017211320","spectrum_index":1589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 24.4134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017211321","spectrum_index":1590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoolein CollisionEnergy:102040 (delta mass: 136.0127 Da; putative annotation: N/A; putative formula: C4H11O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.313,"smiles":null,"spectrum_id":"CCMSLIB00017211322","spectrum_index":1591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 51.0315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.279,"smiles":null,"spectrum_id":"CCMSLIB00017211326","spectrum_index":1592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 60.0101 Da; putative annotation: N/A; putative formula: C4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.071,"smiles":null,"spectrum_id":"CCMSLIB00017211327","spectrum_index":1593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 49.0543 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.281,"smiles":null,"spectrum_id":"CCMSLIB00017211328","spectrum_index":1594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 98.073 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.154,"smiles":null,"spectrum_id":"CCMSLIB00017211329","spectrum_index":1595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 288.2793 Da; putative annotation: N/A; putative formula: C21H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.537,"smiles":null,"spectrum_id":"CCMSLIB00017211330","spectrum_index":1596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 216.1014 Da; putative annotation: N/A; putative formula: C11H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.161,"smiles":null,"spectrum_id":"CCMSLIB00017211331","spectrum_index":1597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-DIHYDROURACIL (delta mass: 49.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.092,"smiles":null,"spectrum_id":"CCMSLIB00017211332","spectrum_index":1598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7,8-Tetramethyl-2-(.beta.-carboxyethyl)-6-hydroxychroman (delta mass: 158.0186 Da; putative annotation: N/A; putative formula: C2H2N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.178,"smiles":null,"spectrum_id":"CCMSLIB00017211333","spectrum_index":1599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,20-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0,?.0?,?.0?,?]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaen-17-ol (delta mass: 466.1574 Da; putative annotation: N/A; putative formula: C26H22N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.291,"smiles":null,"spectrum_id":"CCMSLIB00017211334","spectrum_index":1600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 647.177 Da; putative annotation: N/A; putative formula: C20H33N5O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.279,"smiles":null,"spectrum_id":"CCMSLIB00017211337","spectrum_index":1601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 263.2601 Da; putative annotation: N/A; putative formula: C18H33N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.372,"smiles":null,"spectrum_id":"CCMSLIB00017211339","spectrum_index":1602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Putative (3-hydroxyhexadecanoyl)glycine (aka Commendamide) (delta mass: 208.1818 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.446,"smiles":null,"spectrum_id":"CCMSLIB00017211341","spectrum_index":1603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 317.0556 Da; putative annotation: N/A; putative formula: C17H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.1,"smiles":null,"spectrum_id":"CCMSLIB00017211344","spectrum_index":1604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11-Eicosatrienoic acid (delta mass: 75.0317 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.295,"smiles":null,"spectrum_id":"CCMSLIB00017211345","spectrum_index":1605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 65.0268 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.167,"smiles":null,"spectrum_id":"CCMSLIB00017211346","spectrum_index":1606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 240.0931 Da; putative annotation: N/A; putative formula: C11H16N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.179,"smiles":null,"spectrum_id":"CCMSLIB00017211347","spectrum_index":1607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 539.3298 Da; putative annotation: N/A; putative formula: C38H41N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.369,"smiles":null,"spectrum_id":"CCMSLIB00017211348","spectrum_index":1608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CHEMBL358188 CollisionEnergy:102040 (delta mass: 265.1324 Da; putative annotation: N/A; putative formula: C15H23NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.271,"smiles":null,"spectrum_id":"CCMSLIB00017211349","spectrum_index":1609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tibolone (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.226,"smiles":null,"spectrum_id":"CCMSLIB00017211350","spectrum_index":1610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 198.1626 Da; putative annotation: N/A; putative formula: C12H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017211352","spectrum_index":1611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-indole-3-carbaldehyde (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.086,"smiles":null,"spectrum_id":"CCMSLIB00017211355","spectrum_index":1612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 221.5802 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.651,"smiles":null,"spectrum_id":"CCMSLIB00017211356","spectrum_index":1613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 61.0167 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.066,"smiles":null,"spectrum_id":"CCMSLIB00017211357","spectrum_index":1614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017211358","spectrum_index":1615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 70.0613 Da; putative annotation: N/A; putative formula: C2H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.12,"smiles":null,"spectrum_id":"CCMSLIB00017211359","spectrum_index":1616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 88.0665 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.424,"smiles":null,"spectrum_id":"CCMSLIB00017211360","spectrum_index":1617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexamethyleneimine (delta mass: 159.0895 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.202,"smiles":null,"spectrum_id":"CCMSLIB00017211361","spectrum_index":1618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 148.1626 Da; putative annotation: N/A; putative formula: C12H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.223,"smiles":null,"spectrum_id":"CCMSLIB00017211362","spectrum_index":1619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [6,10a-Dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl-9-oxo-1,2,3,4a,5,6,6a,7,11,11a-decahydronaphtho[2,1-f][1]benzofuran-5-yl] acetate (delta mass: 54.0279 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.25,"smiles":null,"spectrum_id":"CCMSLIB00017211364","spectrum_index":1620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 83.0366 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017211367","spectrum_index":1621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 111.101 Da; putative annotation: N/A; putative formula: C7H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.181,"smiles":null,"spectrum_id":"CCMSLIB00017211368","spectrum_index":1622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 312.0945 Da; putative annotation: N/A; putative formula: C10H8N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.135,"smiles":null,"spectrum_id":"CCMSLIB00017211369","spectrum_index":1623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 311.1185 Da; putative annotation: N/A; putative formula: C17H18N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.189,"smiles":null,"spectrum_id":"CCMSLIB00017211370","spectrum_index":1624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 12.0149 Da; putative annotation: N/A; putative formula: N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.101,"smiles":null,"spectrum_id":"CCMSLIB00017211371","spectrum_index":1625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385097-01_C20H22O9_beta-D-Glucopyranoside, 4-hydroxy-2-(hydroxymethyl)phenyl, 6-benzoate (delta mass: 268.0796 Da; putative annotation: N/A; putative formula: C9H16O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.213,"smiles":null,"spectrum_id":"CCMSLIB00017211372","spectrum_index":1626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 72.0576 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.212,"smiles":null,"spectrum_id":"CCMSLIB00017211373","spectrum_index":1627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 11.0383 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.135,"smiles":null,"spectrum_id":"CCMSLIB00017211374","spectrum_index":1628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 112.0699 Da; putative annotation: N/A; putative formula: C7H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.307,"smiles":null,"spectrum_id":"CCMSLIB00017211377","spectrum_index":1629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 152.0626 Da; putative annotation: N/A; putative formula: C12H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.11,"smiles":null,"spectrum_id":"CCMSLIB00017211378","spectrum_index":1630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 463.1701 Da; putative annotation: N/A; putative formula: C30H26NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.23,"smiles":null,"spectrum_id":"CCMSLIB00017211379","spectrum_index":1631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 585.2188 Da; putative annotation: N/A; putative formula: C34H35NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.3,"smiles":null,"spectrum_id":"CCMSLIB00017211381","spectrum_index":1632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 60.0217 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.149,"smiles":null,"spectrum_id":"CCMSLIB00017211382","spectrum_index":1633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 901.4947 Da; putative annotation: N/A; putative formula: C48H67N7O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1082.57,"smiles":null,"spectrum_id":"CCMSLIB00017211383","spectrum_index":1634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 558.4261 Da; putative annotation: N/A; putative formula: C39H58S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":852.705,"smiles":null,"spectrum_id":"CCMSLIB00017211384","spectrum_index":1635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Cycloisolongifol-5-ol (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.185,"smiles":null,"spectrum_id":"CCMSLIB00017211387","spectrum_index":1636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 142.0775 Da; putative annotation: N/A; putative formula: C5H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.414,"smiles":null,"spectrum_id":"CCMSLIB00017211389","spectrum_index":1637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 180.0621 Da; putative annotation: N/A; putative formula: C10H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.128,"smiles":null,"spectrum_id":"CCMSLIB00017211390","spectrum_index":1638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Sitosterol (delta mass: 499.3838 Da; putative annotation: N/A; putative formula: C32H53NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.777,"smiles":null,"spectrum_id":"CCMSLIB00017211391","spectrum_index":1639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 325.21 Da; putative annotation: N/A; putative formula: C17H32N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.359,"smiles":null,"spectrum_id":"CCMSLIB00017211392","spectrum_index":1640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 41.0268 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.14,"smiles":null,"spectrum_id":"CCMSLIB00017211393","spectrum_index":1641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 119.988 Da; putative annotation: N/A; putative formula: C3H4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.168,"smiles":null,"spectrum_id":"CCMSLIB00017211394","spectrum_index":1642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM836501 Morpholine|Morpholin (delta mass: 18.9948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":107.071,"smiles":null,"spectrum_id":"CCMSLIB00017211395","spectrum_index":1643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 180.0632 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.128,"smiles":null,"spectrum_id":"CCMSLIB00017211397","spectrum_index":1644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 398.3405 Da; putative annotation: N/A; putative formula: C25H50O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.604,"smiles":null,"spectrum_id":"CCMSLIB00017211400","spectrum_index":1645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.Phaeophorbide a (delta mass: 279.4277 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.703,"smiles":null,"spectrum_id":"CCMSLIB00017211401","spectrum_index":1646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 100.0677 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017211402","spectrum_index":1647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 179.0796 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.166,"smiles":null,"spectrum_id":"CCMSLIB00017211403","spectrum_index":1648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 41.071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.146,"smiles":null,"spectrum_id":"CCMSLIB00017211404","spectrum_index":1649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100394 5,6-Dihydrouracil|Hydrouracil|5,6-Dihydro-2,4-dihydroxypyrimidine|2,4-Dioxotetrahydropyrimidine (delta mass: 72.0324 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.083,"smiles":null,"spectrum_id":"CCMSLIB00017211406","spectrum_index":1650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-(2-Ethylphenyl)prop-2-enoic acid (delta mass: 229.1652 Da; putative annotation: N/A; putative formula: C8H19N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.256,"smiles":null,"spectrum_id":"CCMSLIB00017211407","spectrum_index":1651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 142.0743 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.229,"smiles":null,"spectrum_id":"CCMSLIB00017211409","spectrum_index":1652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 52.0675 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.127,"smiles":null,"spectrum_id":"CCMSLIB00017211411","spectrum_index":1653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyoctadecanoic acid (delta mass: 179.0791 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.353,"smiles":null,"spectrum_id":"CCMSLIB00017211412","spectrum_index":1654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-amino-4-methylbenzoate (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.112,"smiles":null,"spectrum_id":"CCMSLIB00017211413","spectrum_index":1655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 368.0959 Da; putative annotation: N/A; putative formula: C16H21N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.187,"smiles":null,"spectrum_id":"CCMSLIB00017211414","spectrum_index":1656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Acetyloxy)lanosta-8,24-dien-21-oic acid (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.404,"smiles":null,"spectrum_id":"CCMSLIB00017211416","spectrum_index":1657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 39.959 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017211417","spectrum_index":1658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 228.1076 Da; putative annotation: N/A; putative formula: C6H12N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.225,"smiles":null,"spectrum_id":"CCMSLIB00017211420","spectrum_index":1659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 224.1169 Da; putative annotation: N/A; putative formula: C12H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.214,"smiles":null,"spectrum_id":"CCMSLIB00017211421","spectrum_index":1660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 87.0322 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.109,"smiles":null,"spectrum_id":"CCMSLIB00017211422","spectrum_index":1661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexanone, 2-(ethylamino)-2-phenyl- (delta mass: 341.1207 Da; putative annotation: N/A; putative formula: C18H19N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.275,"smiles":null,"spectrum_id":"CCMSLIB00017211424","spectrum_index":1662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-3,3',4,4'-tetracarboxylic acid (delta mass: 182.0233 Da; putative annotation: N/A; putative formula: C9H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.068,"smiles":null,"spectrum_id":"CCMSLIB00017211425","spectrum_index":1663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Allylpiperazine (delta mass: 30.0226 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.146,"smiles":null,"spectrum_id":"CCMSLIB00017211426","spectrum_index":1664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 43.0324 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.083,"smiles":null,"spectrum_id":"CCMSLIB00017211428","spectrum_index":1665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-carbinol CollisionEnergy:205060 (delta mass: 7.9492 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.025,"smiles":null,"spectrum_id":"CCMSLIB00017211429","spectrum_index":1666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid (delta mass: 186.0988 Da; putative annotation: N/A; putative formula: C10H19O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.238,"smiles":null,"spectrum_id":"CCMSLIB00017211430","spectrum_index":1667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 56.0278 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.065,"smiles":null,"spectrum_id":"CCMSLIB00017211433","spectrum_index":1668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 42.0461 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.106,"smiles":null,"spectrum_id":"CCMSLIB00017211435","spectrum_index":1669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-proline (delta mass: 75.0675 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.154,"smiles":null,"spectrum_id":"CCMSLIB00017211436","spectrum_index":1670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 74.0519 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.274,"smiles":null,"spectrum_id":"CCMSLIB00017211437","spectrum_index":1671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 234.1482 Da; putative annotation: N/A; putative formula: C12H18N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.224,"smiles":null,"spectrum_id":"CCMSLIB00017211438","spectrum_index":1672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Urobilin (delta mass: 590.3309 Da; putative annotation: N/A; putative formula: C32H51N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1181.65,"smiles":null,"spectrum_id":"CCMSLIB00017211439","spectrum_index":1673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 129.0404 Da; putative annotation: N/A; putative formula: CH3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.116,"smiles":null,"spectrum_id":"CCMSLIB00017211440","spectrum_index":1674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Gln (delta mass: 168.0536 Da; putative annotation: N/A; putative formula: C7H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.183,"smiles":null,"spectrum_id":"CCMSLIB00017211441","spectrum_index":1675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid (delta mass: 54.0103 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.253,"smiles":null,"spectrum_id":"CCMSLIB00017211443","spectrum_index":1676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 110.0004 Da; putative annotation: N/A; putative formula: C5H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.087,"smiles":null,"spectrum_id":"CCMSLIB00017211445","spectrum_index":1677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 82.0781 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.138,"smiles":null,"spectrum_id":"CCMSLIB00017211447","spectrum_index":1678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 110.0514 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.127,"smiles":null,"spectrum_id":"CCMSLIB00017211448","spectrum_index":1679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 410.3023 Da; putative annotation: N/A; putative formula: C21H34N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.545,"smiles":null,"spectrum_id":"CCMSLIB00017211449","spectrum_index":1680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannose 6-phosphate (delta mass: 348.1063 Da; putative annotation: N/A; putative formula: C17H21N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.143,"smiles":null,"spectrum_id":"CCMSLIB00017211450","spectrum_index":1681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 109.0738 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.181,"smiles":null,"spectrum_id":"CCMSLIB00017211451","spectrum_index":1682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Methylpentadecanoic acid (delta mass: 325.3707 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.618,"smiles":null,"spectrum_id":"CCMSLIB00017211453","spectrum_index":1683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 117.0467 Da; putative annotation: N/A; putative formula: C2H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.113,"smiles":null,"spectrum_id":"CCMSLIB00017211456","spectrum_index":1684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucine butyl ester (delta mass: 71.0379 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.202,"smiles":null,"spectrum_id":"CCMSLIB00017211457","spectrum_index":1685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 74.0371 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017211458","spectrum_index":1686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 120.0299 Da; putative annotation: N/A; putative formula: C2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.127,"smiles":null,"spectrum_id":"CCMSLIB00017211459","spectrum_index":1687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 125.0122 Da; putative annotation: N/A; putative formula: C6H-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017211460","spectrum_index":1688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 310.2587 Da; putative annotation: N/A; putative formula: C14H30N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.412,"smiles":null,"spectrum_id":"CCMSLIB00017211461","spectrum_index":1689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 48.9553 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.027,"smiles":null,"spectrum_id":"CCMSLIB00017211462","spectrum_index":1690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 17.9082 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.958,"smiles":null,"spectrum_id":"CCMSLIB00017211463","spectrum_index":1691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 60.0393 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.277,"smiles":null,"spectrum_id":"CCMSLIB00017211467","spectrum_index":1692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 264.2452 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.31,"smiles":null,"spectrum_id":"CCMSLIB00017211468","spectrum_index":1693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 82.0778 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.346,"smiles":null,"spectrum_id":"CCMSLIB00017211469","spectrum_index":1694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 102.0834 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017211470","spectrum_index":1695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 193.8471 Da; putative annotation: N/A; putative formula: C2O-1P6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.907,"smiles":null,"spectrum_id":"CCMSLIB00017211471","spectrum_index":1696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 138.1044 Da; putative annotation: N/A; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.258,"smiles":null,"spectrum_id":"CCMSLIB00017211472","spectrum_index":1697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 96.0575 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.149,"smiles":null,"spectrum_id":"CCMSLIB00017211474","spectrum_index":1698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.103,"smiles":null,"spectrum_id":"CCMSLIB00017211475","spectrum_index":1699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 112.075 Da; putative annotation: N/A; putative formula: C4H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.135,"smiles":null,"spectrum_id":"CCMSLIB00017211477","spectrum_index":1700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 39.0208 Da; putative annotation: N/A; putative formula: CHN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017211478","spectrum_index":1701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 245.2228 Da; putative annotation: N/A; putative formula: C11H27N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.32,"smiles":null,"spectrum_id":"CCMSLIB00017211479","spectrum_index":1702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01040 Hexahydrocurcumin (delta mass: 170.8198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.0,"smiles":null,"spectrum_id":"CCMSLIB00017211480","spectrum_index":1703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoyl-rac-glycerol (delta mass: 893.5353 Da; putative annotation: N/A; putative formula: C49H77N5O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1463.05,"smiles":null,"spectrum_id":"CCMSLIB00017211481","spectrum_index":1704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 57.0215 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.071,"smiles":null,"spectrum_id":"CCMSLIB00017211482","spectrum_index":1705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 341.293 Da; putative annotation: N/A; putative formula: C20H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.364,"smiles":null,"spectrum_id":"CCMSLIB00017211485","spectrum_index":1706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 171.0528 Da; putative annotation: N/A; putative formula: C7H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.139,"smiles":null,"spectrum_id":"CCMSLIB00017211487","spectrum_index":1707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-methylglutaric acid (delta mass: 371.1583 Da; putative annotation: N/A; putative formula: C20H26N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.218,"smiles":null,"spectrum_id":"CCMSLIB00017211488","spectrum_index":1708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 156.0848 Da; putative annotation: N/A; putative formula: C6H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.145,"smiles":null,"spectrum_id":"CCMSLIB00017211489","spectrum_index":1709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 172.1259 Da; putative annotation: N/A; putative formula: C13H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.249,"smiles":null,"spectrum_id":"CCMSLIB00017211490","spectrum_index":1710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Deoxyprostaglandin E2 (delta mass: 189.1004 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.338,"smiles":null,"spectrum_id":"CCMSLIB00017211491","spectrum_index":1711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 323.1223 Da; putative annotation: N/A; putative formula: C13H25NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.281,"smiles":null,"spectrum_id":"CCMSLIB00017211492","spectrum_index":1712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminoadipic acid (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.092,"smiles":null,"spectrum_id":"CCMSLIB00017211493","spectrum_index":1713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lupeol (delta mass: 256.247 Da; putative annotation: N/A; putative formula: C11H28N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.64,"smiles":null,"spectrum_id":"CCMSLIB00017211495","spectrum_index":1714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 60.0239 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.209,"smiles":null,"spectrum_id":"CCMSLIB00017211498","spectrum_index":1715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 92.0474 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.29,"smiles":null,"spectrum_id":"CCMSLIB00017211499","spectrum_index":1716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-3.alpha.-ol-11,20-dione (delta mass: 60.0359 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.278,"smiles":null,"spectrum_id":"CCMSLIB00017211500","spectrum_index":1717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 52.0312 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.07,"smiles":null,"spectrum_id":"CCMSLIB00017211501","spectrum_index":1718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 53.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017211502","spectrum_index":1719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 125.0478 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.118,"smiles":null,"spectrum_id":"CCMSLIB00017211503","spectrum_index":1720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 84.0576 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.149,"smiles":null,"spectrum_id":"CCMSLIB00017211504","spectrum_index":1721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 284.2721 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.405,"smiles":null,"spectrum_id":"CCMSLIB00017211506","spectrum_index":1722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 50.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.284,"smiles":null,"spectrum_id":"CCMSLIB00017211509","spectrum_index":1723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rostafuroxin (delta mass: 88.0691 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.322,"smiles":null,"spectrum_id":"CCMSLIB00017211510","spectrum_index":1724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxocholesterol (delta mass: 80.0628 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.404,"smiles":null,"spectrum_id":"CCMSLIB00017211511","spectrum_index":1725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 550.0958 Da; putative annotation: N/A; putative formula: C24H22O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.156,"smiles":null,"spectrum_id":"CCMSLIB00017211512","spectrum_index":1726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 332.2373 Da; putative annotation: N/A; putative formula: C14H34N6O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":999.466,"smiles":null,"spectrum_id":"CCMSLIB00017211513","spectrum_index":1727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 197.2265 Da; putative annotation: N/A; putative formula: C12H27N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.293,"smiles":null,"spectrum_id":"CCMSLIB00017211514","spectrum_index":1728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130036 (delta mass: 373.1893 Da; putative annotation: N/A; putative formula: C21H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.385,"smiles":null,"spectrum_id":"CCMSLIB00017211515","spectrum_index":1729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 137.1206 Da; putative annotation: N/A; putative formula: C9H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.363,"smiles":null,"spectrum_id":"CCMSLIB00017211517","spectrum_index":1730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Isobutyl-2-(2-methyl-1H-indol-1-yl)acetamide (delta mass: 70.0421 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.207,"smiles":null,"spectrum_id":"CCMSLIB00017211520","spectrum_index":1731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthro[3,2-b]furan-9(1H)-one, 2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro-6,10a-dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl- (delta mass: 116.0655 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.282,"smiles":null,"spectrum_id":"CCMSLIB00017211521","spectrum_index":1732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 145.0738 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.176,"smiles":null,"spectrum_id":"CCMSLIB00017211522","spectrum_index":1733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 211.0997 Da; putative annotation: N/A; putative formula: C9H14ClN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.212,"smiles":null,"spectrum_id":"CCMSLIB00017211523","spectrum_index":1734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androsterone (delta mass: 332.1094 Da; putative annotation: N/A; putative formula: C11H12N10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.341,"smiles":null,"spectrum_id":"CCMSLIB00017211524","spectrum_index":1735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Arachidonoylglycerol (delta mass: 140.1051 Da; putative annotation: N/A; putative formula: C6H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.389,"smiles":null,"spectrum_id":"CCMSLIB00017211525","spectrum_index":1736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 80.0621 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.31,"smiles":null,"spectrum_id":"CCMSLIB00017211526","spectrum_index":1737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatol (delta mass: 176.0319 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.113,"smiles":null,"spectrum_id":"CCMSLIB00017211529","spectrum_index":1738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid methyl ester (delta mass: 172.1309 Da; putative annotation: N/A; putative formula: C3H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.514,"smiles":null,"spectrum_id":"CCMSLIB00017211531","spectrum_index":1739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 16.007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.291,"smiles":null,"spectrum_id":"CCMSLIB00017211532","spectrum_index":1740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Pro (delta mass: 319.1175 Da; putative annotation: N/A; putative formula: C16H21N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.289,"smiles":null,"spectrum_id":"CCMSLIB00017211533","spectrum_index":1741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 153.0651 Da; putative annotation: N/A; putative formula: C5H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.13,"smiles":null,"spectrum_id":"CCMSLIB00017211534","spectrum_index":1742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 102.0828 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.341,"smiles":null,"spectrum_id":"CCMSLIB00017211535","spectrum_index":1743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 32.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.263,"smiles":null,"spectrum_id":"CCMSLIB00017211536","spectrum_index":1744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 71.0004 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.211,"smiles":null,"spectrum_id":"CCMSLIB00017211539","spectrum_index":1745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 129.115 Da; putative annotation: N/A; putative formula: C7H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.175,"smiles":null,"spectrum_id":"CCMSLIB00017211540","spectrum_index":1746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOATE (delta mass: 96.0429 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.093,"smiles":null,"spectrum_id":"CCMSLIB00017211542","spectrum_index":1747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 825.5842 Da; putative annotation: N/A; putative formula: C52H79N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1132.85,"smiles":null,"spectrum_id":"CCMSLIB00017211543","spectrum_index":1748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-4,8-dimethyl-2H-chromen-2-one (delta mass: 229.1104 Da; putative annotation: N/A; putative formula: C14H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.181,"smiles":null,"spectrum_id":"CCMSLIB00017211544","spectrum_index":1749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 179.0643 Da; putative annotation: N/A; putative formula: C5H14N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.176,"smiles":null,"spectrum_id":"CCMSLIB00017211545","spectrum_index":1750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 236.0894 Da; putative annotation: N/A; putative formula: C9H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.321,"smiles":null,"spectrum_id":"CCMSLIB00017211546","spectrum_index":1751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 133.0698 Da; putative annotation: N/A; putative formula: CH7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.12,"smiles":null,"spectrum_id":"CCMSLIB00017211548","spectrum_index":1752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 102.9236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.988,"smiles":null,"spectrum_id":"CCMSLIB00017211550","spectrum_index":1753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 290.2472 Da; putative annotation: N/A; putative formula: C17H30N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.333,"smiles":null,"spectrum_id":"CCMSLIB00017211552","spectrum_index":1754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin C (delta mass: 63.9977 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.177,"smiles":null,"spectrum_id":"CCMSLIB00017211553","spectrum_index":1755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 104.0262 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.118,"smiles":null,"spectrum_id":"CCMSLIB00017211554","spectrum_index":1756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 263.1767 Da; putative annotation: N/A; putative formula: C11H26N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.456,"smiles":null,"spectrum_id":"CCMSLIB00017211555","spectrum_index":1757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,8-Dihydroxy-3-methylisocoumarin (delta mass: 90.0471 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.097,"smiles":null,"spectrum_id":"CCMSLIB00017211556","spectrum_index":1758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,15-Labdanediol (delta mass: 248.0543 Da; putative annotation: N/A; putative formula: C10H8N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.349,"smiles":null,"spectrum_id":"CCMSLIB00017211558","spectrum_index":1759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 359.174 Da; putative annotation: N/A; putative formula: C13H25N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.245,"smiles":null,"spectrum_id":"CCMSLIB00017211561","spectrum_index":1760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 62.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017211562","spectrum_index":1761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 607.5783 Da; putative annotation: N/A; putative formula: C35H74N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":994.94,"smiles":null,"spectrum_id":"CCMSLIB00017211563","spectrum_index":1762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 141.0792 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.15,"smiles":null,"spectrum_id":"CCMSLIB00017211564","spectrum_index":1763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 337.8852 Da; putative annotation: N/A; putative formula: C10H10O-1S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.959,"smiles":null,"spectrum_id":"CCMSLIB00017211565","spectrum_index":1764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 279.293 Da; putative annotation: N/A; putative formula: C19H37N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.405,"smiles":null,"spectrum_id":"CCMSLIB00017211567","spectrum_index":1765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Retinoic acid (delta mass: 19.0138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.23,"smiles":null,"spectrum_id":"CCMSLIB00017211568","spectrum_index":1766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 204.0999 Da; putative annotation: N/A; putative formula: C9H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.165,"smiles":null,"spectrum_id":"CCMSLIB00017211570","spectrum_index":1767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 142.1352 Da; putative annotation: N/A; putative formula: C9H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.179,"smiles":null,"spectrum_id":"CCMSLIB00017211571","spectrum_index":1768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 16.0061 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.124,"smiles":null,"spectrum_id":"CCMSLIB00017211572","spectrum_index":1769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 102.0394 Da; putative annotation: N/A; putative formula: C2H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.126,"smiles":null,"spectrum_id":"CCMSLIB00017211574","spectrum_index":1770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Acetaminobenzoic acid (delta mass: 32.0007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.066,"smiles":null,"spectrum_id":"CCMSLIB00017211575","spectrum_index":1771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid propyl ester (delta mass: 32.0082 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.094,"smiles":null,"spectrum_id":"CCMSLIB00017211577","spectrum_index":1772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 205.0419 Da; putative annotation: N/A; putative formula: C8H15NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.128,"smiles":null,"spectrum_id":"CCMSLIB00017211579","spectrum_index":1773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 218.1028 Da; putative annotation: N/A; putative formula: C8H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.168,"smiles":null,"spectrum_id":"CCMSLIB00017211580","spectrum_index":1774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 149.1412 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.415,"smiles":null,"spectrum_id":"CCMSLIB00017211581","spectrum_index":1775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Piperidinyl)morpholine (delta mass: 17.0308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.18,"smiles":null,"spectrum_id":"CCMSLIB00017211582","spectrum_index":1776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 16.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.144,"smiles":null,"spectrum_id":"CCMSLIB00017211583","spectrum_index":1777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 103.0631 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.237,"smiles":null,"spectrum_id":"CCMSLIB00017211584","spectrum_index":1778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.065,"smiles":null,"spectrum_id":"CCMSLIB00017211585","spectrum_index":1779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 656.2959 Da; putative annotation: N/A; putative formula: C35H40N6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":855.383,"smiles":null,"spectrum_id":"CCMSLIB00017211586","spectrum_index":1780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 658.3117 Da; putative annotation: N/A; putative formula: C43H46O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.398,"smiles":null,"spectrum_id":"CCMSLIB00017211588","spectrum_index":1781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 629.2484 Da; putative annotation: N/A; putative formula: C26H51N3O4S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.335,"smiles":null,"spectrum_id":"CCMSLIB00017211591","spectrum_index":1782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Longicaulenone (delta mass: 101.1679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.296,"smiles":null,"spectrum_id":"CCMSLIB00017211592","spectrum_index":1783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 5.4545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.5,"smiles":null,"spectrum_id":"CCMSLIB00017211593","spectrum_index":1784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,6,6-Tetramethylpiperidine (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.164,"smiles":null,"spectrum_id":"CCMSLIB00017211594","spectrum_index":1785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 117.0584 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.14,"smiles":null,"spectrum_id":"CCMSLIB00017211595","spectrum_index":1786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 113.0437 Da; putative annotation: N/A; putative formula: CH3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.161,"smiles":null,"spectrum_id":"CCMSLIB00017211596","spectrum_index":1787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTIDINE (delta mass: 42.0096 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.102,"smiles":null,"spectrum_id":"CCMSLIB00017211597","spectrum_index":1788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 50.0435 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.535,"smiles":null,"spectrum_id":"CCMSLIB00017211599","spectrum_index":1789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 98.9989 Da; putative annotation: N/A; putative formula: C2H2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.21,"smiles":null,"spectrum_id":"CCMSLIB00017211602","spectrum_index":1790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(5-Nitro-1H-indol-3-yl)ethan-1-one (delta mass: 197.098 Da; putative annotation: N/A; putative formula: C9H15N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.159,"smiles":null,"spectrum_id":"CCMSLIB00017211603","spectrum_index":1791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 904.8858 Da; putative annotation: N/A; putative formula: C65H112N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1215.0,"smiles":null,"spectrum_id":"CCMSLIB00017211604","spectrum_index":1792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 741.5311 Da; putative annotation: N/A; putative formula: C41H76NO8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1334.81,"smiles":null,"spectrum_id":"CCMSLIB00017211605","spectrum_index":1793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 239.1155 Da; putative annotation: N/A; putative formula: C12H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.186,"smiles":null,"spectrum_id":"CCMSLIB00017211606","spectrum_index":1794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 18.0094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.059,"smiles":null,"spectrum_id":"CCMSLIB00017211607","spectrum_index":1795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 35.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.206,"smiles":null,"spectrum_id":"CCMSLIB00017211609","spectrum_index":1796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 108.0937 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017211611","spectrum_index":1797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1173.5507 Da; putative annotation: N/A; putative formula: C76H75N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1395.65,"smiles":null,"spectrum_id":"CCMSLIB00017211613","spectrum_index":1798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 777.6858 Da; putative annotation: N/A; putative formula: C49H95NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":999.783,"smiles":null,"spectrum_id":"CCMSLIB00017211614","spectrum_index":1799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 121.1097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.357,"smiles":null,"spectrum_id":"CCMSLIB00017211615","spectrum_index":1800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017211616","spectrum_index":1801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 173.0002 Da; putative annotation: N/A; putative formula: C3H3N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.06,"smiles":null,"spectrum_id":"CCMSLIB00017211618","spectrum_index":1802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrograpanin (delta mass: 66.0468 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.274,"smiles":null,"spectrum_id":"CCMSLIB00017211619","spectrum_index":1803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 342.116 Da; putative annotation: N/A; putative formula: C12H22O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.217,"smiles":null,"spectrum_id":"CCMSLIB00017211621","spectrum_index":1804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 38.0044 Da; putative annotation: N/A; putative formula: H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":121.065,"smiles":null,"spectrum_id":"CCMSLIB00017211623","spectrum_index":1805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-myo-Inositol-1-phosphate (delta mass: 382.3804 Da; putative annotation: N/A; putative formula: C25H50O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.417,"smiles":null,"spectrum_id":"CCMSLIB00017211624","spectrum_index":1806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sericic acid (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.404,"smiles":null,"spectrum_id":"CCMSLIB00017211625","spectrum_index":1807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Benz[g]indole-2-carboxylic acid (delta mass: 114.0388 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.109,"smiles":null,"spectrum_id":"CCMSLIB00017211627","spectrum_index":1808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 94.0416 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.128,"smiles":null,"spectrum_id":"CCMSLIB00017211628","spectrum_index":1809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 28.056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.106,"smiles":null,"spectrum_id":"CCMSLIB00017211629","spectrum_index":1810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 88.0728 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.555,"smiles":null,"spectrum_id":"CCMSLIB00017211631","spectrum_index":1811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 230.1152 Da; putative annotation: N/A; putative formula: C11H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.175,"smiles":null,"spectrum_id":"CCMSLIB00017211632","spectrum_index":1812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 197.1775 Da; putative annotation: N/A; putative formula: C12H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.248,"smiles":null,"spectrum_id":"CCMSLIB00017211633","spectrum_index":1813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 948.6156 Da; putative annotation: N/A; putative formula: C50H80N10O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1444.96,"smiles":null,"spectrum_id":"CCMSLIB00017211635","spectrum_index":1814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 54.0468 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.289,"smiles":null,"spectrum_id":"CCMSLIB00017211637","spectrum_index":1815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOATE (delta mass: 162.0528 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.103,"smiles":null,"spectrum_id":"CCMSLIB00017211638","spectrum_index":1816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 292.1735 Da; putative annotation: N/A; putative formula: C21H25O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.286,"smiles":null,"spectrum_id":"CCMSLIB00017211640","spectrum_index":1817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam A (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.092,"smiles":null,"spectrum_id":"CCMSLIB00017211641","spectrum_index":1818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 94.042 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.113,"smiles":null,"spectrum_id":"CCMSLIB00017211643","spectrum_index":1819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 59.0737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.196,"smiles":null,"spectrum_id":"CCMSLIB00017211644","spectrum_index":1820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 367.6634 Da; putative annotation: N/A; putative formula: O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.761,"smiles":null,"spectrum_id":"CCMSLIB00017211646","spectrum_index":1821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine; AIF; CE0; MS2Dec (delta mass: 158.0478 Da; putative annotation: N/A; putative formula: C9H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.134,"smiles":null,"spectrum_id":"CCMSLIB00017211647","spectrum_index":1822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 297.276 Da; putative annotation: N/A; putative formula: C13H31N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.79,"smiles":null,"spectrum_id":"CCMSLIB00017211649","spectrum_index":1823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU277306 Creatinine|2-amino-3-methyl-4H-imidazol-5-one (delta mass: 59.0257 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.092,"smiles":null,"spectrum_id":"CCMSLIB00017211650","spectrum_index":1824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 129.0429 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.16,"smiles":null,"spectrum_id":"CCMSLIB00017211651","spectrum_index":1825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Pro from NIST14 (delta mass: 226.0936 Da; putative annotation: N/A; putative formula: C10H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.196,"smiles":null,"spectrum_id":"CCMSLIB00017211653","spectrum_index":1826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 90.0104 Da; putative annotation: N/A; putative formula: C6H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.134,"smiles":null,"spectrum_id":"CCMSLIB00017211654","spectrum_index":1827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 677.5057 Da; putative annotation: N/A; putative formula: C40H71NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.732,"smiles":null,"spectrum_id":"CCMSLIB00017211656","spectrum_index":1828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 242.1016 Da; putative annotation: N/A; putative formula: C9H14N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.141,"smiles":null,"spectrum_id":"CCMSLIB00017211678","spectrum_index":1829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 483.9505 Da; putative annotation: N/A; putative formula: C14H20N4O-1S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.0,"smiles":null,"spectrum_id":"CCMSLIB00017211679","spectrum_index":1830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.117,"smiles":null,"spectrum_id":"CCMSLIB00017211680","spectrum_index":1831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 27.9983 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.07,"smiles":null,"spectrum_id":"CCMSLIB00017211681","spectrum_index":1832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethyl ester (delta mass: 76.0679 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.347,"smiles":null,"spectrum_id":"CCMSLIB00017211682","spectrum_index":1833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 342.2769 Da; putative annotation: N/A; putative formula: C20H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.352,"smiles":null,"spectrum_id":"CCMSLIB00017211684","spectrum_index":1834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 277.0808 Da; putative annotation: N/A; putative formula: C11H19NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.146,"smiles":null,"spectrum_id":"CCMSLIB00017211686","spectrum_index":1835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 197.07 Da; putative annotation: N/A; putative formula: C10H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.24,"smiles":null,"spectrum_id":"CCMSLIB00017211688","spectrum_index":1836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 257.2002 Da; putative annotation: N/A; putative formula: C15H23N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.427,"smiles":null,"spectrum_id":"CCMSLIB00017211689","spectrum_index":1837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-2-Amino-3-phenylpropan-1-ol (delta mass: 295.2495 Da; putative annotation: N/A; putative formula: C14H29N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.357,"smiles":null,"spectrum_id":"CCMSLIB00017211690","spectrum_index":1838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 158.1383 Da; putative annotation: N/A; putative formula: C4H14N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.36,"smiles":null,"spectrum_id":"CCMSLIB00017211692","spectrum_index":1839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 137.1509 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.31,"smiles":null,"spectrum_id":"CCMSLIB00017211693","spectrum_index":1840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 230.1304 Da; putative annotation: N/A; putative formula: C15H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.201,"smiles":null,"spectrum_id":"CCMSLIB00017211694","spectrum_index":1841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-3-ylmethanamine (delta mass: 30.0356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.122,"smiles":null,"spectrum_id":"CCMSLIB00017211697","spectrum_index":1842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 52.0315 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.284,"smiles":null,"spectrum_id":"CCMSLIB00017211698","spectrum_index":1843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 114.0839 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.253,"smiles":null,"spectrum_id":"CCMSLIB00017211700","spectrum_index":1844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 108.0951 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.322,"smiles":null,"spectrum_id":"CCMSLIB00017211701","spectrum_index":1845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 162.0528 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.123,"smiles":null,"spectrum_id":"CCMSLIB00017211702","spectrum_index":1846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 122.1104 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.363,"smiles":null,"spectrum_id":"CCMSLIB00017211703","spectrum_index":1847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2Z)-2-[(E)-6-(hydroxymethyl)-2,4,8,10-tetramethyldodec-2-enylidene]-4-methylpentanedioic acid (delta mass: 48.0356 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.331,"smiles":null,"spectrum_id":"CCMSLIB00017211706","spectrum_index":1848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 66.0464 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.278,"smiles":null,"spectrum_id":"CCMSLIB00017211708","spectrum_index":1849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 258.0162 Da; putative annotation: N/A; putative formula: C13H6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.057,"smiles":null,"spectrum_id":"CCMSLIB00017211709","spectrum_index":1850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 175.8387 Da; putative annotation: N/A; putative formula: O-1S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.909,"smiles":null,"spectrum_id":"CCMSLIB00017211710","spectrum_index":1851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoxaline (delta mass: 11.9998 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.198,"smiles":null,"spectrum_id":"CCMSLIB00017211711","spectrum_index":1852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU058201 Tris(2-hydroxyethyl) isocyanurate|1,3,5-tris(2-hydroxyethyl)-1,3,5-triazinane-2,4,6-trione (delta mass: 71.9841 Da; putative annotation: N/A; putative formula: C2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.087,"smiles":null,"spectrum_id":"CCMSLIB00017211712","spectrum_index":1853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 115.0997 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.253,"smiles":null,"spectrum_id":"CCMSLIB00017211714","spectrum_index":1854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 88.0162 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.059,"smiles":null,"spectrum_id":"CCMSLIB00017211717","spectrum_index":1855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 150.0319 Da; putative annotation: N/A; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.112,"smiles":null,"spectrum_id":"CCMSLIB00017211718","spectrum_index":1856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic JBIR 27 (delta mass: 282.0415 Da; putative annotation: N/A; putative formula: C12H15N2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.206,"smiles":null,"spectrum_id":"CCMSLIB00017211719","spectrum_index":1857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 298.0995 Da; putative annotation: N/A; putative formula: C14H22N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.16,"smiles":null,"spectrum_id":"CCMSLIB00017211720","spectrum_index":1858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 250.0834 Da; putative annotation: N/A; putative formula: C7H15N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.18,"smiles":null,"spectrum_id":"CCMSLIB00017211722","spectrum_index":1859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 351.2989 Da; putative annotation: N/A; putative formula: C19H37N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.562,"smiles":null,"spectrum_id":"CCMSLIB00017211723","spectrum_index":1860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 22.0218 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.065,"smiles":null,"spectrum_id":"CCMSLIB00017211724","spectrum_index":1861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 34.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.097,"smiles":null,"spectrum_id":"CCMSLIB00017211727","spectrum_index":1862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyisovanillic acid (delta mass: 184.0377 Da; putative annotation: N/A; putative formula: CH8N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.082,"smiles":null,"spectrum_id":"CCMSLIB00017211728","spectrum_index":1863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 283.2484 Da; putative annotation: N/A; putative formula: C13H29N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.434,"smiles":null,"spectrum_id":"CCMSLIB00017211730","spectrum_index":1864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 244.1048 Da; putative annotation: N/A; putative formula: C7H8N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.17,"smiles":null,"spectrum_id":"CCMSLIB00017211731","spectrum_index":1865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 223.0471 Da; putative annotation: N/A; putative formula: C10H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.138,"smiles":null,"spectrum_id":"CCMSLIB00017211732","spectrum_index":1866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 88.0424 Da; putative annotation: N/A; putative formula: C6H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.118,"smiles":null,"spectrum_id":"CCMSLIB00017211733","spectrum_index":1867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 434.1354 Da; putative annotation: N/A; putative formula: C29H24P2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.201,"smiles":null,"spectrum_id":"CCMSLIB00017211734","spectrum_index":1868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 189.0424 Da; putative annotation: N/A; putative formula: C10H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.144,"smiles":null,"spectrum_id":"CCMSLIB00017211735","spectrum_index":1869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 133.0527 Da; putative annotation: 3-Acetamidophenol; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017211738","spectrum_index":1870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 240.0724 Da; putative annotation: His-Cys; putative formula: C9H12N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.144,"smiles":null,"spectrum_id":"CCMSLIB00017211740","spectrum_index":1871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 246.1041 Da; putative annotation: N-[2-(Benzoylamino)propanoyl]alanine; putative formula: C13H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.18,"smiles":null,"spectrum_id":"CCMSLIB00017211741","spectrum_index":1872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 132.0576 Da; putative annotation: 2,3-Dimethylbenzoic acid; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.106,"smiles":null,"spectrum_id":"CCMSLIB00017211742","spectrum_index":1873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 101.0493 Da; putative annotation: Massbank:PR100315 L-allo-Threonine|allo-Thr|L-Allothreonine|(2S,3S)-2-Amino-3-hydroxybutyric Acid; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.12,"smiles":null,"spectrum_id":"CCMSLIB00017211743","spectrum_index":1874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-MANNOSAMINE (delta mass: 264.1119 Da; putative annotation: Thr-Tyr; putative formula: C13H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.209,"smiles":null,"spectrum_id":"CCMSLIB00017211744","spectrum_index":1875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 147.0682 Da; putative annotation: Spectral Match to DL-Phenylalanine from NIST14; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.192,"smiles":null,"spectrum_id":"CCMSLIB00017211745","spectrum_index":1876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-L-.gamma.-Glutamyl-L-leucine (delta mass: 226.1695 Da; putative annotation: Ile-Leu; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.314,"smiles":null,"spectrum_id":"CCMSLIB00017211747","spectrum_index":1877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 318.2194 Da; putative annotation: (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid; putative formula: C20H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.348,"smiles":null,"spectrum_id":"CCMSLIB00017211750","spectrum_index":1878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 352.2239 Da; putative annotation: 15(R),19(R)-Hydroxyprostaglandin F2.alpha.; putative formula: C20H32O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.44,"smiles":null,"spectrum_id":"CCMSLIB00017211751","spectrum_index":1879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 146.0465 Da; putative annotation: (4aR,5aR)-4,4a,5,5a-Tetrahydro-1H-cyclopropa[4,5]cyclopenta[1,2-c]pyrazole-3-carboxylic acid; putative formula: C8H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.102,"smiles":null,"spectrum_id":"CCMSLIB00017211752","spectrum_index":1880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .DELTA.2-Androstene-1.alpha.,17.beta.-diol acetate (delta mass: 470.3452 Da; putative annotation: Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)-; putative formula: C30H46O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.588,"smiles":null,"spectrum_id":"CCMSLIB00017211753","spectrum_index":1881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 113.0475 Da; putative annotation: 5-Aminolevulinic acid; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017211755","spectrum_index":1882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gln (delta mass: 239.0899 Da; putative annotation: haplamine; putative formula: C15H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.209,"smiles":null,"spectrum_id":"CCMSLIB00017211756","spectrum_index":1883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitelaidic acid (delta mass: 180.1519 Da; putative annotation: cis-5-Dodecenoic acid; putative formula: C12H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.384,"smiles":null,"spectrum_id":"CCMSLIB00017211758","spectrum_index":1884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 336.2087 Da; putative annotation: 9.alpha.-Fluoro-17.alpha.-methyl-4-androstene-3.alpha.,6.beta.,11.beta.,17.beta.-tetrol; putative formula: C20H29FO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.42,"smiles":null,"spectrum_id":"CCMSLIB00017211761","spectrum_index":1885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 300.2083 Da; putative annotation: Steviol; putative formula: C20H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.57,"smiles":null,"spectrum_id":"CCMSLIB00017211762","spectrum_index":1886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 282.2552 Da; putative annotation: Spectral Match to 3-Hydroxyoctadecanoic Acid from NIST14; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.482,"smiles":null,"spectrum_id":"CCMSLIB00017211763","spectrum_index":1887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 260.0299 Da; putative annotation: Diethyl (4-chlorophenyl)(hydroxy)methylphosphonate; putative formula: C11H14ClO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.067,"smiles":null,"spectrum_id":"CCMSLIB00017211764","spectrum_index":1888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 148.1244 Da; putative annotation: (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol; putative formula: C11H16)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017211765","spectrum_index":1889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 204.1531 Da; putative annotation: 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one; putative formula: C14H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.343,"smiles":null,"spectrum_id":"CCMSLIB00017211767","spectrum_index":1890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 278.1506 Da; putative annotation: Methyl 2-(4-ethenyl-2,6-dihydroxy-3-(3-hydroxyprop-1-en-2-yl)-4-methylcyclohexyl)prop-2-enoate; putative formula: C16H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.263,"smiles":null,"spectrum_id":"CCMSLIB00017211769","spectrum_index":1891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-ol (delta mass: 282.1986 Da; putative annotation: Retinoic acid; putative formula: C20H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.399,"smiles":null,"spectrum_id":"CCMSLIB00017211771","spectrum_index":1892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 222.1651 Da; putative annotation: Dicyclohexyl(hydroxy)acetic acid; putative formula: C14H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.355,"smiles":null,"spectrum_id":"CCMSLIB00017211772","spectrum_index":1893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 260.2171 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.407,"smiles":null,"spectrum_id":"CCMSLIB00017211773","spectrum_index":1894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 156.0695 Da; putative annotation: [5-(Pyridin-3-yl)furan-2-yl]methanamine; putative formula: C10H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017211774","spectrum_index":1895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dioscin (delta mass: 146.056 Da; putative annotation: L-Rhamnose; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1015.55,"smiles":null,"spectrum_id":"CCMSLIB00017211775","spectrum_index":1896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 98.0727 Da; putative annotation: 4-Methylvaleric acid; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.278,"smiles":null,"spectrum_id":"CCMSLIB00017211776","spectrum_index":1897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 131.0949 Da; putative annotation: Triethanolamine; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.186,"smiles":null,"spectrum_id":"CCMSLIB00017211778","spectrum_index":1898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 129.0793 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.171,"smiles":null,"spectrum_id":"CCMSLIB00017211781","spectrum_index":1899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4,8,12-Trimethylcyclotetradeca-3,7,11-trien-1-yl)propan-2-ol (delta mass: 317.2932 Da; putative annotation: N/A; putative formula: C19H35N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.561,"smiles":null,"spectrum_id":"CCMSLIB00017211782","spectrum_index":1900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 176.0316 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.102,"smiles":null,"spectrum_id":"CCMSLIB00017211783","spectrum_index":1901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01043 Hexahydrocurcumin (delta mass: 18.0134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.194,"smiles":null,"spectrum_id":"CCMSLIB00017211784","spectrum_index":1902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethanolamide (delta mass: 116.0988 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.389,"smiles":null,"spectrum_id":"CCMSLIB00017211785","spectrum_index":1903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 778.2829 Da; putative annotation: N/A; putative formula: C39H50N6O3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.354,"smiles":null,"spectrum_id":"CCMSLIB00017211786","spectrum_index":1904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 82.0785 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.342,"smiles":null,"spectrum_id":"CCMSLIB00017211787","spectrum_index":1905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 17.9849 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.056,"smiles":null,"spectrum_id":"CCMSLIB00017211788","spectrum_index":1906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 868.0028 Da; putative annotation: N/A; putative formula: C30H44O7S11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1090.1,"smiles":null,"spectrum_id":"CCMSLIB00017211792","spectrum_index":1907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.076,"smiles":null,"spectrum_id":"CCMSLIB00017211793","spectrum_index":1908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monomyristin CollisionEnergy:205060 (delta mass: 163.0638 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.317,"smiles":null,"spectrum_id":"CCMSLIB00017211794","spectrum_index":1909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 215.1061 Da; putative annotation: N/A; putative formula: C12H13N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.239,"smiles":null,"spectrum_id":"CCMSLIB00017211795","spectrum_index":1910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 27.9955 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.071,"smiles":null,"spectrum_id":"CCMSLIB00017211796","spectrum_index":1911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.112,"smiles":null,"spectrum_id":"CCMSLIB00017211797","spectrum_index":1912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 45.0219 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.124,"smiles":null,"spectrum_id":"CCMSLIB00017211798","spectrum_index":1913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid from NIST14 (delta mass: 180.0633 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.29,"smiles":null,"spectrum_id":"CCMSLIB00017211800","spectrum_index":1914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,18.Xi.)-3-Oxolup-20(29)-ene-27,28-dioic acid (delta mass: 128.0994 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.426,"smiles":null,"spectrum_id":"CCMSLIB00017211802","spectrum_index":1915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 291.2778 Da; putative annotation: N/A; putative formula: C17H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.489,"smiles":null,"spectrum_id":"CCMSLIB00017211803","spectrum_index":1916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 323.1844 Da; putative annotation: N/A; putative formula: C16H25N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.249,"smiles":null,"spectrum_id":"CCMSLIB00017211804","spectrum_index":1917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dihydroxy-5Z,8Z,11Z-eicosatrienoic acid (delta mass: 38.0517 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017211805","spectrum_index":1918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terminolic acid (delta mass: 457.1798 Da; putative annotation: N/A; putative formula: C23H23N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":962.532,"smiles":null,"spectrum_id":"CCMSLIB00017211806","spectrum_index":1919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 421.2364 Da; putative annotation: N/A; putative formula: C25H31N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.369,"smiles":null,"spectrum_id":"CCMSLIB00017211807","spectrum_index":1920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 74.0733 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.165,"smiles":null,"spectrum_id":"CCMSLIB00017211809","spectrum_index":1921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 92.0628 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.305,"smiles":null,"spectrum_id":"CCMSLIB00017211810","spectrum_index":1922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP012803 Benzoic acid (delta mass: 93.0424 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.087,"smiles":null,"spectrum_id":"CCMSLIB00017211813","spectrum_index":1923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 87.0326 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.223,"smiles":null,"spectrum_id":"CCMSLIB00017211814","spectrum_index":1924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 188.1577 Da; putative annotation: N/A; putative formula: C14H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.343,"smiles":null,"spectrum_id":"CCMSLIB00017211815","spectrum_index":1925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 42.0115 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.28,"smiles":null,"spectrum_id":"CCMSLIB00017211816","spectrum_index":1926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 62.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.125,"smiles":null,"spectrum_id":"CCMSLIB00017211817","spectrum_index":1927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 219.1105 Da; putative annotation: N/A; putative formula: C9H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.153,"smiles":null,"spectrum_id":"CCMSLIB00017211819","spectrum_index":1928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 237.2376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.324,"smiles":null,"spectrum_id":"CCMSLIB00017211820","spectrum_index":1929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 76.0677 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.31,"smiles":null,"spectrum_id":"CCMSLIB00017211823","spectrum_index":1930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 157.1465 Da; putative annotation: N/A; putative formula: C9H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.264,"smiles":null,"spectrum_id":"CCMSLIB00017211824","spectrum_index":1931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 325.2993 Da; putative annotation: N/A; putative formula: C20H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.526,"smiles":null,"spectrum_id":"CCMSLIB00017211825","spectrum_index":1932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 40.0322 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.119,"smiles":null,"spectrum_id":"CCMSLIB00017211827","spectrum_index":1933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 268.2398 Da; putative annotation: N/A; putative formula: C17H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.277,"smiles":null,"spectrum_id":"CCMSLIB00017211828","spectrum_index":1934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-3-yl)acetonitrile (delta mass: 103.0518 Da; putative annotation: N/A; putative formula: C6H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.138,"smiles":null,"spectrum_id":"CCMSLIB00017211829","spectrum_index":1935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cucurbitacin D (delta mass: 349.0939 Da; putative annotation: N/A; putative formula: C14H16N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.41,"smiles":null,"spectrum_id":"CCMSLIB00017211830","spectrum_index":1936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 204.027 Da; putative annotation: N/A; putative formula: C7H8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.066,"smiles":null,"spectrum_id":"CCMSLIB00017211832","spectrum_index":1937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 256.2395 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.305,"smiles":null,"spectrum_id":"CCMSLIB00017211833","spectrum_index":1938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 173.1045 Da; putative annotation: N/A; putative formula: C8H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.363,"smiles":null,"spectrum_id":"CCMSLIB00017211834","spectrum_index":1939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(8Z,11Z,14Z-Eicosatrienoyl)ethanolamine (delta mass: 108.0939 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.399,"smiles":null,"spectrum_id":"CCMSLIB00017211835","spectrum_index":1940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 104.0471 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.149,"smiles":null,"spectrum_id":"CCMSLIB00017211836","spectrum_index":1941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4,8,12-Trimethylcyclotetradeca-3,7,11-trien-1-yl)propan-2-ol (delta mass: 59.0332 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.301,"smiles":null,"spectrum_id":"CCMSLIB00017211837","spectrum_index":1942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Roquefortine C (delta mass: 162.0523 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.245,"smiles":null,"spectrum_id":"CCMSLIB00017211840","spectrum_index":1943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 103.1569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.222,"smiles":null,"spectrum_id":"CCMSLIB00017211841","spectrum_index":1944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z-octadecadienoic acid (delta mass: 593.5348 Da; putative annotation: N/A; putative formula: C33H67N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.762,"smiles":null,"spectrum_id":"CCMSLIB00017211843","spectrum_index":1945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Methyl-5.beta.-androstan-3.alpha.,17.beta.-diol (delta mass: 92.0626 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.326,"smiles":null,"spectrum_id":"CCMSLIB00017211844","spectrum_index":1946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 165.064 Da; putative annotation: N/A; putative formula: C5H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.202,"smiles":null,"spectrum_id":"CCMSLIB00017211845","spectrum_index":1947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 95.9449 Da; putative annotation: N/A; putative formula: H3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.005,"smiles":null,"spectrum_id":"CCMSLIB00017211846","spectrum_index":1948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,8-Difluoro-3-azabicyclo[3.2.1]octane (delta mass: 74.0536 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.147,"smiles":null,"spectrum_id":"CCMSLIB00017211847","spectrum_index":1949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU229306 2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP)|2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine|1-methyl-6-phenylimidazo[4,5-b]pyridin-2-amine (delta mass: 46.0051 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.119,"smiles":null,"spectrum_id":"CCMSLIB00017211848","spectrum_index":1950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 36.0369 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.248,"smiles":null,"spectrum_id":"CCMSLIB00017211849","spectrum_index":1951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyphenylacetic acid (delta mass: 42.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.124,"smiles":null,"spectrum_id":"CCMSLIB00017211853","spectrum_index":1952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lanosterol (delta mass: 118.1175 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.511,"smiles":null,"spectrum_id":"CCMSLIB00017211854","spectrum_index":1953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholestenoic acid (delta mass: 48.035 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.371,"smiles":null,"spectrum_id":"CCMSLIB00017211855","spectrum_index":1954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Acetyl-16alpha-hydroxytrametenolic acid (delta mass: 90.0869 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.46,"smiles":null,"spectrum_id":"CCMSLIB00017211856","spectrum_index":1955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 346.2043 Da; putative annotation: N/A; putative formula: C23H26N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.291,"smiles":null,"spectrum_id":"CCMSLIB00017211857","spectrum_index":1956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 64.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.269,"smiles":null,"spectrum_id":"CCMSLIB00017211859","spectrum_index":1957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 56.1005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.239,"smiles":null,"spectrum_id":"CCMSLIB00017211862","spectrum_index":1958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,11-Tridecadienoic acid, 13-(3-pentyl-2-oxiranyl)-, (8Z,11Z)- (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.274,"smiles":null,"spectrum_id":"CCMSLIB00017211863","spectrum_index":1959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 592.5068 Da; putative annotation: N/A; putative formula: C37H68O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.77,"smiles":null,"spectrum_id":"CCMSLIB00017211864","spectrum_index":1960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.097,"smiles":null,"spectrum_id":"CCMSLIB00017211865","spectrum_index":1961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 270.0336 Da; putative annotation: N/A; putative formula: C9H19OPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.105,"smiles":null,"spectrum_id":"CCMSLIB00017211866","spectrum_index":1962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperazine-2-carbonitrile (delta mass: 84.0689 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.156,"smiles":null,"spectrum_id":"CCMSLIB00017211867","spectrum_index":1963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 514.15 Da; putative annotation: N/A; putative formula: C28H18N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.305,"smiles":null,"spectrum_id":"CCMSLIB00017211868","spectrum_index":1964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxy-.DELTA.9-tetrahydrocannabinol (delta mass: 294.0948 Da; putative annotation: N/A; putative formula: C11H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.322,"smiles":null,"spectrum_id":"CCMSLIB00017211870","spectrum_index":1965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 280.1158 Da; putative annotation: N/A; putative formula: C11H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.244,"smiles":null,"spectrum_id":"CCMSLIB00017211873","spectrum_index":1966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 127.0846 Da; putative annotation: N/A; putative formula: C4H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.15,"smiles":null,"spectrum_id":"CCMSLIB00017211874","spectrum_index":1967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 386.3549 Da; putative annotation: N/A; putative formula: C27H46O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.571,"smiles":null,"spectrum_id":"CCMSLIB00017211875","spectrum_index":1968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 77.0782 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.357,"smiles":null,"spectrum_id":"CCMSLIB00017211876","spectrum_index":1969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 50.0 eV (delta mass: 309.1582 Da; putative annotation: N/A; putative formula: C9H23N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.261,"smiles":null,"spectrum_id":"CCMSLIB00017211877","spectrum_index":1970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 269.0487 Da; putative annotation: N/A; putative formula: C8H16NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.14,"smiles":null,"spectrum_id":"CCMSLIB00017211878","spectrum_index":1971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 128.0831 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.164,"smiles":null,"spectrum_id":"CCMSLIB00017211880","spectrum_index":1972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5-Anhydro-1-(5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl)hexitol (delta mass: 152.0109 Da; putative annotation: N/A; putative formula: C7H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.124,"smiles":null,"spectrum_id":"CCMSLIB00017211883","spectrum_index":1973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Methionine (delta mass: 42.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017211884","spectrum_index":1974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 205.9921 Da; putative annotation: N/A; putative formula: C3H2N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.04,"smiles":null,"spectrum_id":"CCMSLIB00017211885","spectrum_index":1975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Volinanserin (delta mass: 11.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.224,"smiles":null,"spectrum_id":"CCMSLIB00017211886","spectrum_index":1976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ricinoleic acid methyl ester (delta mass: 64.0671 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.341,"smiles":null,"spectrum_id":"CCMSLIB00017211887","spectrum_index":1977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 15.019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.157,"smiles":null,"spectrum_id":"CCMSLIB00017211889","spectrum_index":1978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 179.0413 Da; putative annotation: N/A; putative formula: C2H9N7O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.117,"smiles":null,"spectrum_id":"CCMSLIB00017211892","spectrum_index":1979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 185.0847 Da; putative annotation: N/A; putative formula: C5H11N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.166,"smiles":null,"spectrum_id":"CCMSLIB00017211893","spectrum_index":1980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 323.1217 Da; putative annotation: N/A; putative formula: C12H21NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.245,"smiles":null,"spectrum_id":"CCMSLIB00017211894","spectrum_index":1981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 111.0538 Da; putative annotation: N/A; putative formula: C3H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.286,"smiles":null,"spectrum_id":"CCMSLIB00017211895","spectrum_index":1982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 384.1112 Da; putative annotation: N/A; putative formula: C16H24N4OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.182,"smiles":null,"spectrum_id":"CCMSLIB00017211896","spectrum_index":1983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 530.2377 Da; putative annotation: N/A; putative formula: C26H34N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.302,"smiles":null,"spectrum_id":"CCMSLIB00017211898","spectrum_index":1984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 342.1164 Da; putative annotation: N/A; putative formula: C12H22O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.24,"smiles":null,"spectrum_id":"CCMSLIB00017211899","spectrum_index":1985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Emetine N-oxide (delta mass: 496.2971 Da; putative annotation: N/A; putative formula: C26H44N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":993.598,"smiles":null,"spectrum_id":"CCMSLIB00017211900","spectrum_index":1986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380958-01!2-[[2-[2-[2-[2-[[2-[2-(2-hydroxypropanoylamino)-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoyl]oxypropanoylamino]-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoic acid (delta mass: 618.3721 Da; putative annotation: N/A; putative formula: C43H46N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1377.81,"smiles":null,"spectrum_id":"CCMSLIB00017211903","spectrum_index":1987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-(1Z-Hexadecenyl)-sn-glycero-3-phosphocholine from NIST14 (delta mass: 437.2498 Da; putative annotation: N/A; putative formula: C18H31N9O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":917.595,"smiles":null,"spectrum_id":"CCMSLIB00017211904","spectrum_index":1988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 131.059 Da; putative annotation: N/A; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.119,"smiles":null,"spectrum_id":"CCMSLIB00017211905","spectrum_index":1989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Val-Lys (delta mass: 18.0096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.223,"smiles":null,"spectrum_id":"CCMSLIB00017211907","spectrum_index":1990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyclohexylmethyl)proline (delta mass: 140.1203 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.285,"smiles":null,"spectrum_id":"CCMSLIB00017211908","spectrum_index":1991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Virginiaebutanolide C (delta mass: 52.0676 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.211,"smiles":null,"spectrum_id":"CCMSLIB00017211909","spectrum_index":1992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PYRROLE-2-CARBOXYLIC ACID CollisionEnergy:102040 (delta mass: 117.0568 Da; putative annotation: N/A; putative formula: C2H8N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.096,"smiles":null,"spectrum_id":"CCMSLIB00017211910","spectrum_index":1993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dichlorokynurenic acid (delta mass: 17.2276 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.199,"smiles":null,"spectrum_id":"CCMSLIB00017211913","spectrum_index":1994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 235.0764 Da; putative annotation: N/A; putative formula: C12H14NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.138,"smiles":null,"spectrum_id":"CCMSLIB00017211915","spectrum_index":1995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 240.0828 Da; putative annotation: N/A; putative formula: C5H8N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.137,"smiles":null,"spectrum_id":"CCMSLIB00017211916","spectrum_index":1996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 127.062 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.2,"smiles":null,"spectrum_id":"CCMSLIB00017211917","spectrum_index":1997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 63.0316 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.253,"smiles":null,"spectrum_id":"CCMSLIB00017211918","spectrum_index":1998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 54.0321 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.275,"smiles":null,"spectrum_id":"CCMSLIB00017211919","spectrum_index":1999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 27.0146 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.059,"smiles":null,"spectrum_id":"CCMSLIB00017211923","spectrum_index":2000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 44.974 Da; putative annotation: N/A; putative formula: NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.076,"smiles":null,"spectrum_id":"CCMSLIB00017211924","spectrum_index":2001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 258.2211 Da; putative annotation: N/A; putative formula: C16H26N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.36,"smiles":null,"spectrum_id":"CCMSLIB00017211925","spectrum_index":2002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxymorphinan (delta mass: 44.0279 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.198,"smiles":null,"spectrum_id":"CCMSLIB00017211926","spectrum_index":2003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-O-((2E,4E)-9-Carboxy-8-hydroxy-2,7-dimethylnona-2,4-dienoyl)-.beta.-D-glucopyranose (delta mass: 179.0805 Da; putative annotation: N/A; putative formula: C7H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.256,"smiles":null,"spectrum_id":"CCMSLIB00017211927","spectrum_index":2004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 559.2109 Da; putative annotation: N/A; putative formula: C27H37N5O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.286,"smiles":null,"spectrum_id":"CCMSLIB00017211928","spectrum_index":2005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 179.0395 Da; putative annotation: N/A; putative formula: C3H10N5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.163,"smiles":null,"spectrum_id":"CCMSLIB00017211929","spectrum_index":2006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017211931","spectrum_index":2007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 106.0634 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.28,"smiles":null,"spectrum_id":"CCMSLIB00017211934","spectrum_index":2008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 45.9879 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.23,"smiles":null,"spectrum_id":"CCMSLIB00017211935","spectrum_index":2009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 35.0137 Da; putative annotation: N/A; putative formula: C3HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.35,"smiles":null,"spectrum_id":"CCMSLIB00017211936","spectrum_index":2010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 277.073 Da; putative annotation: N/A; putative formula: CH11N9O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.18,"smiles":null,"spectrum_id":"CCMSLIB00017211937","spectrum_index":2011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 9.936 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.991,"smiles":null,"spectrum_id":"CCMSLIB00017211938","spectrum_index":2012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 10.0052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.06,"smiles":null,"spectrum_id":"CCMSLIB00017211939","spectrum_index":2013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 16.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.122,"smiles":null,"spectrum_id":"CCMSLIB00017211941","spectrum_index":2014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 158.0585 Da; putative annotation: N/A; putative formula: C8H14O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.119,"smiles":null,"spectrum_id":"CCMSLIB00017211942","spectrum_index":2015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 32.0256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.2,"smiles":null,"spectrum_id":"CCMSLIB00017211945","spectrum_index":2016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 364.102 Da; putative annotation: N/A; putative formula: C15H16N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.278,"smiles":null,"spectrum_id":"CCMSLIB00017211946","spectrum_index":2017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 1008.472 Da; putative annotation: N/A; putative formula: C60H64N8O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1230.57,"smiles":null,"spectrum_id":"CCMSLIB00017211947","spectrum_index":2018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,11E,13E)-18-(2,6-Dioxopiperidin-4-yl)-9-hydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11,13-tetraenoic acid (delta mass: 132.1006 Da; putative annotation: N/A; putative formula: C4H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.38,"smiles":null,"spectrum_id":"CCMSLIB00017211948","spectrum_index":2019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 162.154 Da; putative annotation: N/A; putative formula: C11H18N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.245,"smiles":null,"spectrum_id":"CCMSLIB00017211950","spectrum_index":2020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimetidine amide (delta mass: 73.0478 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.181,"smiles":null,"spectrum_id":"CCMSLIB00017211951","spectrum_index":2021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.29,"smiles":null,"spectrum_id":"CCMSLIB00017211952","spectrum_index":2022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 75.0402 Da; putative annotation: N/A; putative formula: CH5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.272,"smiles":null,"spectrum_id":"CCMSLIB00017211954","spectrum_index":2023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 288.2436 Da; putative annotation: N/A; putative formula: C14H33N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.519,"smiles":null,"spectrum_id":"CCMSLIB00017211956","spectrum_index":2024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 11(12)-EET from NIST14 (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.269,"smiles":null,"spectrum_id":"CCMSLIB00017211957","spectrum_index":2025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 142.0738 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.191,"smiles":null,"spectrum_id":"CCMSLIB00017211959","spectrum_index":2026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 270.1106 Da; putative annotation: N/A; putative formula: C13H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.244,"smiles":null,"spectrum_id":"CCMSLIB00017211960","spectrum_index":2027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,17-diol, (3.alpha.,5.alpha.,17.beta.)- (delta mass: 80.0621 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017211961","spectrum_index":2028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal (delta mass: 50.0528 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.102,"smiles":null,"spectrum_id":"CCMSLIB00017211962","spectrum_index":2029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 513.3288 Da; putative annotation: N/A; putative formula: C31H49NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.561,"smiles":null,"spectrum_id":"CCMSLIB00017211964","spectrum_index":2030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 708.6467 Da; putative annotation: N/A; putative formula: C45H88O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1301.92,"smiles":null,"spectrum_id":"CCMSLIB00017211967","spectrum_index":2031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 377.1512 Da; putative annotation: N/A; putative formula: C16H27NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.263,"smiles":null,"spectrum_id":"CCMSLIB00017211968","spectrum_index":2032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 247.2148 Da; putative annotation: N/A; putative formula: C14H25N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.368,"smiles":null,"spectrum_id":"CCMSLIB00017211969","spectrum_index":2033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017211970","spectrum_index":2034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 142.0974 Da; putative annotation: N/A; putative formula: C4H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.376,"smiles":null,"spectrum_id":"CCMSLIB00017211971","spectrum_index":2035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 935.3062 Da; putative annotation: N/A; putative formula: C67H42N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1098.37,"smiles":null,"spectrum_id":"CCMSLIB00017211972","spectrum_index":2036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 989.3435 Da; putative annotation: N/A; putative formula: C36H63NO30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1494.52,"smiles":null,"spectrum_id":"CCMSLIB00017211973","spectrum_index":2037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 908.2415 Da; putative annotation: N/A; putative formula: C39H36N14O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1413.42,"smiles":null,"spectrum_id":"CCMSLIB00017211977","spectrum_index":2038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4,8,12-Trimethylcyclotetradeca-3,7,11-trien-1-yl)propan-2-ol (delta mass: 213.2066 Da; putative annotation: N/A; putative formula: C9H23N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.475,"smiles":null,"spectrum_id":"CCMSLIB00017211978","spectrum_index":2039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 53.1048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.17,"smiles":null,"spectrum_id":"CCMSLIB00017211979","spectrum_index":2040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 112.0888 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.242,"smiles":null,"spectrum_id":"CCMSLIB00017211980","spectrum_index":2041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 145.0739 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.186,"smiles":null,"spectrum_id":"CCMSLIB00017211981","spectrum_index":2042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 392.188 Da; putative annotation: N/A; putative formula: C21H25N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.39,"smiles":null,"spectrum_id":"CCMSLIB00017211982","spectrum_index":2043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 738.7034 Da; putative annotation: N/A; putative formula: C54H90)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":963.815,"smiles":null,"spectrum_id":"CCMSLIB00017211984","spectrum_index":2044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid (delta mass: 76.067 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.419,"smiles":null,"spectrum_id":"CCMSLIB00017211987","spectrum_index":2045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (3R,7S,8S)-7-ethyl-5-methyl-10-oxo-5,12-diazatetracyclo[9.7.0.0,?.0,?]octadeca-1(11),13,15,17-tetraene-3-carboxylate (delta mass: 84.0219 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.224,"smiles":null,"spectrum_id":"CCMSLIB00017211988","spectrum_index":2046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 36.0362 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.299,"smiles":null,"spectrum_id":"CCMSLIB00017211989","spectrum_index":2047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.268,"smiles":null,"spectrum_id":"CCMSLIB00017211990","spectrum_index":2048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(Benzyloxy)-1H-indole (delta mass: 61.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.16,"smiles":null,"spectrum_id":"CCMSLIB00017211991","spectrum_index":2049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 290.7787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.85,"smiles":null,"spectrum_id":"CCMSLIB00017211993","spectrum_index":2050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 231.0917 Da; putative annotation: N/A; putative formula: C14H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.194,"smiles":null,"spectrum_id":"CCMSLIB00017211994","spectrum_index":2051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 134.0941 Da; putative annotation: N/A; putative formula: C7H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.284,"smiles":null,"spectrum_id":"CCMSLIB00017211996","spectrum_index":2052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 95.0952 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.463,"smiles":null,"spectrum_id":"CCMSLIB00017211998","spectrum_index":2053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,3-(2,3-Dihydroxypropyl)diindole (delta mass: 59.0364 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.181,"smiles":null,"spectrum_id":"CCMSLIB00017211999","spectrum_index":2054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 68.0726 Da; putative annotation: N/A; putative formula: C4H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.154,"smiles":null,"spectrum_id":"CCMSLIB00017212000","spectrum_index":2055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 64.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.295,"smiles":null,"spectrum_id":"CCMSLIB00017212002","spectrum_index":2056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 16.0407 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.347,"smiles":null,"spectrum_id":"CCMSLIB00017212003","spectrum_index":2057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 347.2667 Da; putative annotation: N/A; putative formula: C18H37NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.509,"smiles":null,"spectrum_id":"CCMSLIB00017212004","spectrum_index":2058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Ile (delta mass: 113.0834 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.254,"smiles":null,"spectrum_id":"CCMSLIB00017212006","spectrum_index":2059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 235.1419 Da; putative annotation: N/A; putative formula: C10H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.489,"smiles":null,"spectrum_id":"CCMSLIB00017212008","spectrum_index":2060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid, 4-(7,8,9,10-tetrahydro-5,7,7,10,10-pentamethyl-5H-benzo[e]naphtho[2,3-b][1,4]diazepin-13-yl)- (delta mass: 18.0191 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.257,"smiles":null,"spectrum_id":"CCMSLIB00017212009","spectrum_index":2061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 62.0158 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017212011","spectrum_index":2062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 68.0282 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.104,"smiles":null,"spectrum_id":"CCMSLIB00017212012","spectrum_index":2063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 294.256 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.432,"smiles":null,"spectrum_id":"CCMSLIB00017212013","spectrum_index":2064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 374.1137 Da; putative annotation: N/A; putative formula: C12H14N12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.205,"smiles":null,"spectrum_id":"CCMSLIB00017212014","spectrum_index":2065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 43.015 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.096,"smiles":null,"spectrum_id":"CCMSLIB00017212016","spectrum_index":2066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 25.0186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.115,"smiles":null,"spectrum_id":"CCMSLIB00017212019","spectrum_index":2067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 253.1163 Da; putative annotation: N/A; putative formula: C9H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.369,"smiles":null,"spectrum_id":"CCMSLIB00017212020","spectrum_index":2068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 489.369 Da; putative annotation: N/A; putative formula: C28H43N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.429,"smiles":null,"spectrum_id":"CCMSLIB00017212021","spectrum_index":2069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 67.1036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.2,"smiles":null,"spectrum_id":"CCMSLIB00017212022","spectrum_index":2070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thiodiglycol (delta mass: 102.1009 Da; putative annotation: N/A; putative formula: C2H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017212024","spectrum_index":2071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-hydroxybenzoic acid CollisionEnergy:102040 (delta mass: 32.0342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.084,"smiles":null,"spectrum_id":"CCMSLIB00017212025","spectrum_index":2072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 86.9818 Da; putative annotation: N/A; putative formula: C2H3NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.052,"smiles":null,"spectrum_id":"CCMSLIB00017212028","spectrum_index":2073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 431.29 Da; putative annotation: N/A; putative formula: C23H37N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.574,"smiles":null,"spectrum_id":"CCMSLIB00017212029","spectrum_index":2074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Bisabolol (delta mass: 92.0447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.25,"smiles":null,"spectrum_id":"CCMSLIB00017212031","spectrum_index":2075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 98.073 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017212032","spectrum_index":2076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 187.1066 Da; putative annotation: N/A; putative formula: C6H13N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.218,"smiles":null,"spectrum_id":"CCMSLIB00017212033","spectrum_index":2077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-Gentiobiose (delta mass: 199.0852 Da; putative annotation: N/A; putative formula: C10H17NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.209,"smiles":null,"spectrum_id":"CCMSLIB00017212034","spectrum_index":2078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 27.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.233,"smiles":null,"spectrum_id":"CCMSLIB00017212037","spectrum_index":2079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140301 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 85.0412 Da; putative annotation: N/A; putative formula: CH3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017212039","spectrum_index":2080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 70.0536 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.093,"smiles":null,"spectrum_id":"CCMSLIB00017212040","spectrum_index":2081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 42.0795 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.16,"smiles":null,"spectrum_id":"CCMSLIB00017212041","spectrum_index":2082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 183.0299 Da; putative annotation: N/A; putative formula: C4H10NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.09,"smiles":null,"spectrum_id":"CCMSLIB00017212042","spectrum_index":2083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 147.1624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017212043","spectrum_index":2084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminobenzoic acid - 30.0 eV (delta mass: 40.9874 Da; putative annotation: N/A; putative formula: CH-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.042,"smiles":null,"spectrum_id":"CCMSLIB00017212044","spectrum_index":2085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 14.015 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.273,"smiles":null,"spectrum_id":"CCMSLIB00017212047","spectrum_index":2086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Muricholic acid (delta mass: 48.0283 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.323,"smiles":null,"spectrum_id":"CCMSLIB00017212049","spectrum_index":2087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 106.0775 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.174,"smiles":null,"spectrum_id":"CCMSLIB00017212050","spectrum_index":2088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 161.1416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.379,"smiles":null,"spectrum_id":"CCMSLIB00017212051","spectrum_index":2089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lupinine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.165,"smiles":null,"spectrum_id":"CCMSLIB00017212052","spectrum_index":2090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 32.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.212,"smiles":null,"spectrum_id":"CCMSLIB00017212053","spectrum_index":2091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flindersine CollisionEnergy:102040 (delta mass: 46.0994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.201,"smiles":null,"spectrum_id":"CCMSLIB00017212054","spectrum_index":2092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 25.9793 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.055,"smiles":null,"spectrum_id":"CCMSLIB00017212058","spectrum_index":2093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 126.0838 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017212059","spectrum_index":2094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 414.1801 Da; putative annotation: N/A; putative formula: C23H30N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.26,"smiles":null,"spectrum_id":"CCMSLIB00017212060","spectrum_index":2095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 117.0419 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.134,"smiles":null,"spectrum_id":"CCMSLIB00017212061","spectrum_index":2096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 372.2738 Da; putative annotation: N/A; putative formula: C18H36N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.365,"smiles":null,"spectrum_id":"CCMSLIB00017212062","spectrum_index":2097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 116.0999 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.327,"smiles":null,"spectrum_id":"CCMSLIB00017212063","spectrum_index":2098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 493.2945 Da; putative annotation: N/A; putative formula: C30H43N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.371,"smiles":null,"spectrum_id":"CCMSLIB00017212064","spectrum_index":2099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 198.9565 Da; putative annotation: N/A; putative formula: H2N5O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.996,"smiles":null,"spectrum_id":"CCMSLIB00017212067","spectrum_index":2100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 90.0466 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.279,"smiles":null,"spectrum_id":"CCMSLIB00017212069","spectrum_index":2101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017212070","spectrum_index":2102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 59.0259 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.133,"smiles":null,"spectrum_id":"CCMSLIB00017212071","spectrum_index":2103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 161.4083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.5,"smiles":null,"spectrum_id":"CCMSLIB00017212072","spectrum_index":2104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Allyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol (delta mass: 46.009 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.173,"smiles":null,"spectrum_id":"CCMSLIB00017212073","spectrum_index":2105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 174.1168 Da; putative annotation: N/A; putative formula: C9H19OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.25,"smiles":null,"spectrum_id":"CCMSLIB00017212075","spectrum_index":2106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.4]nonane-2,4-dione (delta mass: 129.0784 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.16,"smiles":null,"spectrum_id":"CCMSLIB00017212076","spectrum_index":2107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 355.1117 Da; putative annotation: N/A; putative formula: C17H19N5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.182,"smiles":null,"spectrum_id":"CCMSLIB00017212079","spectrum_index":2108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic acid (9E,11E) from NIST14 (delta mass: 267.0934 Da; putative annotation: N/A; putative formula: C13H17NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.341,"smiles":null,"spectrum_id":"CCMSLIB00017212080","spectrum_index":2109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Ergothioneine (delta mass: 300.1709 Da; putative annotation: N/A; putative formula: C13H25N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.267,"smiles":null,"spectrum_id":"CCMSLIB00017212081","spectrum_index":2110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-methoxybenzenemethanol (delta mass: 64.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.123,"smiles":null,"spectrum_id":"CCMSLIB00017212082","spectrum_index":2111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 9.9845 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.102,"smiles":null,"spectrum_id":"CCMSLIB00017212084","spectrum_index":2112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 236.0641 Da; putative annotation: N/A; putative formula: C7H12N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.135,"smiles":null,"spectrum_id":"CCMSLIB00017212085","spectrum_index":2113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocortisol (delta mass: 735.3283 Da; putative annotation: N/A; putative formula: C50H45N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1102.58,"smiles":null,"spectrum_id":"CCMSLIB00017212086","spectrum_index":2114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4'-O,N-dimethylnorbelladine (delta mass: 86.0525 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.212,"smiles":null,"spectrum_id":"CCMSLIB00017212089","spectrum_index":2115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pesticide6_Ethirimol_C11H19N3O_882476 (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.223,"smiles":null,"spectrum_id":"CCMSLIB00017212090","spectrum_index":2116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 6.9971 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.068,"smiles":null,"spectrum_id":"CCMSLIB00017212092","spectrum_index":2117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 611.5471 Da; putative annotation: N/A; putative formula: C41H73NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.774,"smiles":null,"spectrum_id":"CCMSLIB00017212093","spectrum_index":2118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 196.1096 Da; putative annotation: N/A; putative formula: C11H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.191,"smiles":null,"spectrum_id":"CCMSLIB00017212094","spectrum_index":2119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 85.9736 Da; putative annotation: N/A; putative formula: C3H3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.086,"smiles":null,"spectrum_id":"CCMSLIB00017212095","spectrum_index":2120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 198.2085 Da; putative annotation: N/A; putative formula: C12H26N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.3,"smiles":null,"spectrum_id":"CCMSLIB00017212096","spectrum_index":2121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 20.0 eV (delta mass: 116.3557 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.442,"smiles":null,"spectrum_id":"CCMSLIB00017212098","spectrum_index":2122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 225.1711 Da; putative annotation: N/A; putative formula: C9H19N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.25,"smiles":null,"spectrum_id":"CCMSLIB00017212101","spectrum_index":2123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 117.0242 Da; putative annotation: N/A; putative formula: C4H7NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.126,"smiles":null,"spectrum_id":"CCMSLIB00017212102","spectrum_index":2124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 92.0633 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.316,"smiles":null,"spectrum_id":"CCMSLIB00017212103","spectrum_index":2125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3-Hydroxycapric acid from NIST14 (delta mass: 52.0684 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.217,"smiles":null,"spectrum_id":"CCMSLIB00017212104","spectrum_index":2126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 175.0428 Da; putative annotation: N/A; putative formula: C13H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.108,"smiles":null,"spectrum_id":"CCMSLIB00017212105","spectrum_index":2127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 42.0097 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.123,"smiles":null,"spectrum_id":"CCMSLIB00017212106","spectrum_index":2128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 222.0667 Da; putative annotation: N/A; putative formula: C9H19PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.153,"smiles":null,"spectrum_id":"CCMSLIB00017212109","spectrum_index":2129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 150.0683 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.15,"smiles":null,"spectrum_id":"CCMSLIB00017212111","spectrum_index":2130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 115.0634 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017212112","spectrum_index":2131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 110.9415 Da; putative annotation: N/A; putative formula: C2H-2N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.033,"smiles":null,"spectrum_id":"CCMSLIB00017212113","spectrum_index":2132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 161.1051 Da; putative annotation: N/A; putative formula: C7H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.353,"smiles":null,"spectrum_id":"CCMSLIB00017212114","spectrum_index":2133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Hydroxy-o-toluidine (delta mass: 42.0092 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.085,"smiles":null,"spectrum_id":"CCMSLIB00017212115","spectrum_index":2134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017212117","spectrum_index":2135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3'-Hydroxycotinine (delta mass: 151.0628 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.16,"smiles":null,"spectrum_id":"CCMSLIB00017212120","spectrum_index":2136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 302.0699 Da; putative annotation: N/A; putative formula: C11H10N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.13,"smiles":null,"spectrum_id":"CCMSLIB00017212121","spectrum_index":2137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 109.9587 Da; putative annotation: N/A; putative formula: C3N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.998,"smiles":null,"spectrum_id":"CCMSLIB00017212122","spectrum_index":2138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 101.0577 Da; putative annotation: N/A; putative formula: C3H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.092,"smiles":null,"spectrum_id":"CCMSLIB00017212123","spectrum_index":2139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 396.2274 Da; putative annotation: N/A; putative formula: C21H28N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.324,"smiles":null,"spectrum_id":"CCMSLIB00017212125","spectrum_index":2140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 147.0896 Da; putative annotation: N/A; putative formula: C6H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017212126","spectrum_index":2141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 92.0833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.196,"smiles":null,"spectrum_id":"CCMSLIB00017212127","spectrum_index":2142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 50.0531 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.254,"smiles":null,"spectrum_id":"CCMSLIB00017212130","spectrum_index":2143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 344.2245 Da; putative annotation: N/A; putative formula: C16H32N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.352,"smiles":null,"spectrum_id":"CCMSLIB00017212131","spectrum_index":2144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 409.1159 Da; putative annotation: N/A; putative formula: C22H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.187,"smiles":null,"spectrum_id":"CCMSLIB00017212133","spectrum_index":2145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017212134","spectrum_index":2146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 40.0316 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.098,"smiles":null,"spectrum_id":"CCMSLIB00017212135","spectrum_index":2147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 413.153 Da; putative annotation: N/A; putative formula: C28H19N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.213,"smiles":null,"spectrum_id":"CCMSLIB00017212136","spectrum_index":2148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 484.2319 Da; putative annotation: N/A; putative formula: C35H33P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.271,"smiles":null,"spectrum_id":"CCMSLIB00017212137","spectrum_index":2149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 243.2194 Da; putative annotation: N/A; putative formula: C14H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.322,"smiles":null,"spectrum_id":"CCMSLIB00017212140","spectrum_index":2150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 1-piperazinecarboxylate (delta mass: 27.9837 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017212142","spectrum_index":2151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 415.1689 Da; putative annotation: N/A; putative formula: C13H17N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.385,"smiles":null,"spectrum_id":"CCMSLIB00017212143","spectrum_index":2152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 208.0734 Da; putative annotation: N/A; putative formula: C11H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.18,"smiles":null,"spectrum_id":"CCMSLIB00017212144","spectrum_index":2153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 116.0995 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017212145","spectrum_index":2154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 133.0645 Da; putative annotation: N/A; putative formula: C7H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.199,"smiles":null,"spectrum_id":"CCMSLIB00017212146","spectrum_index":2155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 103.0783 Da; putative annotation: N/A; putative formula: C8H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.133,"smiles":null,"spectrum_id":"CCMSLIB00017212149","spectrum_index":2156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 87.068 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.154,"smiles":null,"spectrum_id":"CCMSLIB00017212151","spectrum_index":2157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 13.9935 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.048,"smiles":null,"spectrum_id":"CCMSLIB00017212152","spectrum_index":2158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxobenzo[cd]indol-1(2H)-yl)acetic acid (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.097,"smiles":null,"spectrum_id":"CCMSLIB00017212153","spectrum_index":2159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Diaminopimelic acid (delta mass: 35.0412 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.144,"smiles":null,"spectrum_id":"CCMSLIB00017212154","spectrum_index":2160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C9:0 (delta mass: 31.9643 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.171,"smiles":null,"spectrum_id":"CCMSLIB00017212156","spectrum_index":2161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carbonitrile (delta mass: 17.025 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.085,"smiles":null,"spectrum_id":"CCMSLIB00017212157","spectrum_index":2162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 283.0895 Da; putative annotation: N/A; putative formula: C14H13N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.274,"smiles":null,"spectrum_id":"CCMSLIB00017212160","spectrum_index":2163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 171.1621 Da; putative annotation: N/A; putative formula: C10H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.29,"smiles":null,"spectrum_id":"CCMSLIB00017212161","spectrum_index":2164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 247.141 Da; putative annotation: N/A; putative formula: C8H13N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.238,"smiles":null,"spectrum_id":"CCMSLIB00017212162","spectrum_index":2165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. alcohol methyl ether (delta mass: 613.4865 Da; putative annotation: N/A; putative formula: C42H63NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":968.771,"smiles":null,"spectrum_id":"CCMSLIB00017212164","spectrum_index":2166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Genipin (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.102,"smiles":null,"spectrum_id":"CCMSLIB00017212165","spectrum_index":2167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,19-Cyclolanost-25-ene-3,24-diol (delta mass: 104.0964 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.485,"smiles":null,"spectrum_id":"CCMSLIB00017212166","spectrum_index":2168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 28.0328 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.14,"smiles":null,"spectrum_id":"CCMSLIB00017212169","spectrum_index":2169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 688.972 Da; putative annotation: N/A; putative formula: C20H23N3O14S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.059,"smiles":null,"spectrum_id":"CCMSLIB00017212170","spectrum_index":2170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde - 40.0 eV (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.107,"smiles":null,"spectrum_id":"CCMSLIB00017212172","spectrum_index":2171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 752.2917 Da; putative annotation: N/A; putative formula: C48H41N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":951.378,"smiles":null,"spectrum_id":"CCMSLIB00017212173","spectrum_index":2172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AC-LYS-OH - 40.0 eV (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.192,"smiles":null,"spectrum_id":"CCMSLIB00017212174","spectrum_index":2173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxydodecanoic acid (delta mass: 66.0441 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.224,"smiles":null,"spectrum_id":"CCMSLIB00017212175","spectrum_index":2174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 332.3584 Da; putative annotation: N/A; putative formula: C23H44N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.643,"smiles":null,"spectrum_id":"CCMSLIB00017212176","spectrum_index":2175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-alpha-D-glucosamine - 40.0 eV (delta mass: 538.7244 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.822,"smiles":null,"spectrum_id":"CCMSLIB00017212179","spectrum_index":2176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1132.5673 Da; putative annotation: N/A; putative formula: C69H76N6O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1295.63,"smiles":null,"spectrum_id":"CCMSLIB00017212181","spectrum_index":2177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 107.0814 Da; putative annotation: N/A; putative formula: C6H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.215,"smiles":null,"spectrum_id":"CCMSLIB00017212182","spectrum_index":2178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Naltrexone (delta mass: 28.0314 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.201,"smiles":null,"spectrum_id":"CCMSLIB00017212183","spectrum_index":2179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 137.0834 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.154,"smiles":null,"spectrum_id":"CCMSLIB00017212184","spectrum_index":2180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 144.0378 Da; putative annotation: N/A; putative formula: C5H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.214,"smiles":null,"spectrum_id":"CCMSLIB00017212185","spectrum_index":2181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N-methyl-4-piperidinamine (delta mass: 55.9609 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.131,"smiles":null,"spectrum_id":"CCMSLIB00017212188","spectrum_index":2182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[(5aS,9R,9aR)-7-Hydroxy-8-(2-hydroxypropan-2-yl)-11-methoxy-4,5a,9-trimethyl-1-oxo-3,6,7,8,9a,10-hexahydro-[2]benzofuro[5,6-b]chromen-9-yl]propanoic acid (delta mass: 317.1876 Da; putative annotation: N/A; putative formula: C15H24N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.42,"smiles":null,"spectrum_id":"CCMSLIB00017212190","spectrum_index":2183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 63.9618 Da; putative annotation: N/A; putative formula: O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.043,"smiles":null,"spectrum_id":"CCMSLIB00017212191","spectrum_index":2184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 84.1012 Da; putative annotation: N/A; putative formula: C5H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.204,"smiles":null,"spectrum_id":"CCMSLIB00017212192","spectrum_index":2185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl hydrogen malonate (delta mass: 129.1517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.201,"smiles":null,"spectrum_id":"CCMSLIB00017212193","spectrum_index":2186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 134.1122 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.323,"smiles":null,"spectrum_id":"CCMSLIB00017212195","spectrum_index":2187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 343.271 Da; putative annotation: N/A; putative formula: CH25N23O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.473,"smiles":null,"spectrum_id":"CCMSLIB00017212198","spectrum_index":2188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 36.0456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.111,"smiles":null,"spectrum_id":"CCMSLIB00017212199","spectrum_index":2189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 365.1952 Da; putative annotation: N/A; putative formula: C18H27N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.26,"smiles":null,"spectrum_id":"CCMSLIB00017212200","spectrum_index":2190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetamide (delta mass: 88.0614 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.148,"smiles":null,"spectrum_id":"CCMSLIB00017212201","spectrum_index":2191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 17.0117 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.083,"smiles":null,"spectrum_id":"CCMSLIB00017212203","spectrum_index":2192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 116.0475 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.149,"smiles":null,"spectrum_id":"CCMSLIB00017212204","spectrum_index":2193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 342.2558 Da; putative annotation: N/A; putative formula: C23H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.326,"smiles":null,"spectrum_id":"CCMSLIB00017212206","spectrum_index":2194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 157.0501 Da; putative annotation: N/A; putative formula: C6H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.219,"smiles":null,"spectrum_id":"CCMSLIB00017212208","spectrum_index":2195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HYDROQUINIDINE (delta mass: 61.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.254,"smiles":null,"spectrum_id":"CCMSLIB00017212209","spectrum_index":2196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 85.0815 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.21,"smiles":null,"spectrum_id":"CCMSLIB00017212211","spectrum_index":2197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 142.0378 Da; putative annotation: N/A; putative formula: C5H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.108,"smiles":null,"spectrum_id":"CCMSLIB00017212212","spectrum_index":2198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 211.085 Da; putative annotation: N/A; putative formula: C11H17NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.187,"smiles":null,"spectrum_id":"CCMSLIB00017212213","spectrum_index":2199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 88.0584 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.16,"smiles":null,"spectrum_id":"CCMSLIB00017212216","spectrum_index":2200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyclohexylmethyl)proline (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017212217","spectrum_index":2201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2,2,6,6-tetramethyl-4-[3-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]butyl]cyclohex-4-ene-1,3-dione (delta mass: 165.0758 Da; putative annotation: N/A; putative formula: C5H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.313,"smiles":null,"spectrum_id":"CCMSLIB00017212219","spectrum_index":2202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 252.1366 Da; putative annotation: N/A; putative formula: C15H24O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.223,"smiles":null,"spectrum_id":"CCMSLIB00017212220","spectrum_index":2203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thymol (delta mass: 281.2716 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.383,"smiles":null,"spectrum_id":"CCMSLIB00017212221","spectrum_index":2204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,5,7,8-Pentamethyl-6-hydroxychroman (delta mass: 380.2712 Da; putative annotation: N/A; putative formula: C26H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.425,"smiles":null,"spectrum_id":"CCMSLIB00017212223","spectrum_index":2205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzoic acid (delta mass: 14.0144 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.053,"smiles":null,"spectrum_id":"CCMSLIB00017212225","spectrum_index":2206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 113.0483 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.15,"smiles":null,"spectrum_id":"CCMSLIB00017212226","spectrum_index":2207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylcyclohexanol (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.122,"smiles":null,"spectrum_id":"CCMSLIB00017212228","spectrum_index":2208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 278.2823 Da; putative annotation: N/A; putative formula: C17H34N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.374,"smiles":null,"spectrum_id":"CCMSLIB00017212229","spectrum_index":2209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 54.0102 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.096,"smiles":null,"spectrum_id":"CCMSLIB00017212231","spectrum_index":2210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosilybin B (delta mass: 193.0591 Da; putative annotation: N/A; putative formula: C7H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.188,"smiles":null,"spectrum_id":"CCMSLIB00017212233","spectrum_index":2211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 429.6994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.771,"smiles":null,"spectrum_id":"CCMSLIB00017212234","spectrum_index":2212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 205.1302 Da; putative annotation: N/A; putative formula: C9H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.378,"smiles":null,"spectrum_id":"CCMSLIB00017212236","spectrum_index":2213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-(2-Ethylphenyl)prop-2-enoic acid (delta mass: 306.0489 Da; putative annotation: N/A; putative formula: C13H10N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.14,"smiles":null,"spectrum_id":"CCMSLIB00017212237","spectrum_index":2214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-TRIHYDROXYBENZOIC ACID\"\" (delta mass: 296.0528 Da; putative annotation: N/A; putative formula: C9H20N2OP4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.082,"smiles":null,"spectrum_id":"CCMSLIB00017212238","spectrum_index":2215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.185,"smiles":null,"spectrum_id":"CCMSLIB00017212240","spectrum_index":2216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Ketofusidic acid (delta mass: 140.0981 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.435,"smiles":null,"spectrum_id":"CCMSLIB00017212242","spectrum_index":2217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,,3S,5Z)-3-hydroxy-1,5-octadien-1-yl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5Z)- (delta mass: 549.2699 Da; putative annotation: N/A; putative formula: C38H36N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.507,"smiles":null,"spectrum_id":"CCMSLIB00017212244","spectrum_index":2218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 280.135 Da; putative annotation: N/A; putative formula: C12H24O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.19,"smiles":null,"spectrum_id":"CCMSLIB00017212245","spectrum_index":2219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 685.2599 Da; putative annotation: N/A; putative formula: C38H31N13O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.32,"smiles":null,"spectrum_id":"CCMSLIB00017212246","spectrum_index":2220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 138.1104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.27,"smiles":null,"spectrum_id":"CCMSLIB00017212247","spectrum_index":2221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-2-hydroxybenzoic acid (delta mass: 11.0876 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.122,"smiles":null,"spectrum_id":"CCMSLIB00017212249","spectrum_index":2222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 167.1197 Da; putative annotation: N/A; putative formula: C7H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017212251","spectrum_index":2223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 38.0517 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.367,"smiles":null,"spectrum_id":"CCMSLIB00017212253","spectrum_index":2224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 156.1306 Da; putative annotation: N/A; putative formula: C13H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017212254","spectrum_index":2225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 162.1424 Da; putative annotation: N/A; putative formula: C12H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.374,"smiles":null,"spectrum_id":"CCMSLIB00017212255","spectrum_index":2226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 98.0369 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.085,"smiles":null,"spectrum_id":"CCMSLIB00017212256","spectrum_index":2227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 29.9224 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.014,"smiles":null,"spectrum_id":"CCMSLIB00017212257","spectrum_index":2228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.076,"smiles":null,"spectrum_id":"CCMSLIB00017212259","spectrum_index":2229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 204.2093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.269,"smiles":null,"spectrum_id":"CCMSLIB00017212262","spectrum_index":2230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-1-(2-Hydroxyethyl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol (delta mass: 36.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.253,"smiles":null,"spectrum_id":"CCMSLIB00017212263","spectrum_index":2231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 190.027 Da; putative annotation: N/A; putative formula: C3H6N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.092,"smiles":null,"spectrum_id":"CCMSLIB00017212264","spectrum_index":2232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 178.0634 Da; putative annotation: N/A; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.123,"smiles":null,"spectrum_id":"CCMSLIB00017212265","spectrum_index":2233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.alpha.-estrane-3.alpha.,17.beta.-diol (delta mass: 36.037 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.3,"smiles":null,"spectrum_id":"CCMSLIB00017212266","spectrum_index":2234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 92.0625 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.342,"smiles":null,"spectrum_id":"CCMSLIB00017212268","spectrum_index":2235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 152.1414 Da; putative annotation: N/A; putative formula: C8H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.254,"smiles":null,"spectrum_id":"CCMSLIB00017212271","spectrum_index":2236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 359.1431 Da; putative annotation: N/A; putative formula: C15H26N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.25,"smiles":null,"spectrum_id":"CCMSLIB00017212272","spectrum_index":2237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 46.0782 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.143,"smiles":null,"spectrum_id":"CCMSLIB00017212273","spectrum_index":2238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenethyl alcohol (delta mass: 117.0693 Da; putative annotation: N/A; putative formula: C7H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.145,"smiles":null,"spectrum_id":"CCMSLIB00017212274","spectrum_index":2239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 127.0149 Da; putative annotation: N/A; putative formula: C2HN5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.049,"smiles":null,"spectrum_id":"CCMSLIB00017212275","spectrum_index":2240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Acetyl-11-keto-.beta.-boswellic acid (delta mass: 86.0527 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.41,"smiles":null,"spectrum_id":"CCMSLIB00017212276","spectrum_index":2241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[5-[(3Z,6Z)-2,12-Dihydroxydodeca-3,6-dienyl]oxolan-2-yl]acetic acid (delta mass: 36.0359 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.253,"smiles":null,"spectrum_id":"CCMSLIB00017212278","spectrum_index":2242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 277.1509 Da; putative annotation: N/A; putative formula: C16H25NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.373,"smiles":null,"spectrum_id":"CCMSLIB00017212279","spectrum_index":2243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 309.2775 Da; putative annotation: N/A; putative formula: C18H35N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.359,"smiles":null,"spectrum_id":"CCMSLIB00017212282","spectrum_index":2244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 149.1032 Da; putative annotation: N/A; putative formula: C2H11N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.206,"smiles":null,"spectrum_id":"CCMSLIB00017212283","spectrum_index":2245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.206,"smiles":null,"spectrum_id":"CCMSLIB00017212284","spectrum_index":2246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ascorbic acid 6-palmitate (delta mass: 87.0136 Da; putative annotation: N/A; putative formula: C3H5NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.283,"smiles":null,"spectrum_id":"CCMSLIB00017212285","spectrum_index":2247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 73.0526 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017212287","spectrum_index":2248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 87.0321 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.082,"smiles":null,"spectrum_id":"CCMSLIB00017212288","spectrum_index":2249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 296.0528 Da; putative annotation: N/A; putative formula: C9H20N2OP4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.155,"smiles":null,"spectrum_id":"CCMSLIB00017212289","spectrum_index":2250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutaecarpine (delta mass: 28.0299 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.143,"smiles":null,"spectrum_id":"CCMSLIB00017212290","spectrum_index":2251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 135.0321 Da; putative annotation: 5-Aminosalicylic acid; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.113,"smiles":null,"spectrum_id":"CCMSLIB00017212292","spectrum_index":2252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Phe from NIST14 (delta mass: 147.0683 Da; putative annotation: DL-Phenylalanine; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.187,"smiles":null,"spectrum_id":"CCMSLIB00017212294","spectrum_index":2253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00244969-01!4-[[2-[(E)-3-hydroxybut-1-enyl]-5-oxooxolan-3-yl]amino]benzaldehyde (delta mass: 102.0485 Da; putative annotation: 4-Vinylphenol; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.172,"smiles":null,"spectrum_id":"CCMSLIB00017212296","spectrum_index":2254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 213.0105 Da; putative annotation: Acetaminophen sulfate; putative formula: C8H7NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.092,"smiles":null,"spectrum_id":"CCMSLIB00017212297","spectrum_index":2255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Asp (delta mass: 97.0522 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.15,"smiles":null,"spectrum_id":"CCMSLIB00017212298","spectrum_index":2256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Gly-Ile (delta mass: 170.1076 Da; putative annotation: Leu-Gly; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.315,"smiles":null,"spectrum_id":"CCMSLIB00017212299","spectrum_index":2257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 120.0573 Da; putative annotation: 2-Methoxybenzenemethanol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017212300","spectrum_index":2258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 376.262 Da; putative annotation: Butaprost (free acid); putative formula: C23H36O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.478,"smiles":null,"spectrum_id":"CCMSLIB00017212301","spectrum_index":2259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monopalmitolein (9c) from NIST14 (delta mass: 238.2296 Da; putative annotation: 2-Hexyldecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.498,"smiles":null,"spectrum_id":"CCMSLIB00017212302","spectrum_index":2260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 294.2183 Da; putative annotation: (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid; putative formula: C18H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.44,"smiles":null,"spectrum_id":"CCMSLIB00017212303","spectrum_index":2261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 53.063 Da; putative annotation: Pyrrolidine; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.149,"smiles":null,"spectrum_id":"CCMSLIB00017212307","spectrum_index":2262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Phe (delta mass: 129.0418 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.171,"smiles":null,"spectrum_id":"CCMSLIB00017212308","spectrum_index":2263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocorticosterone (delta mass: 473.2973 Da; putative annotation: Oleana-1,9(11)-dien-28-oic acid, 2-cyano-3,12-dioxo-; putative formula: C31H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.55,"smiles":null,"spectrum_id":"CCMSLIB00017212309","spectrum_index":2264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311078 Coumaroyl putrescin (delta mass: 308.0888 Da; putative annotation: NCGC00169406-02_C15H18O8_2-Propenoic acid, 3-[4-(beta-D-glucopyranosyloxy)phenyl]-, (2E)-; putative formula: C15H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.233,"smiles":null,"spectrum_id":"CCMSLIB00017212310","spectrum_index":2265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 1088.5445 Da; putative annotation: NCGC00180022-02!6-[[(3S,4S,6aR,8aR,9S,10R,12aS,14bR)-9-[3,5-dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid; putative formula: C53H84O23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1269.62,"smiles":null,"spectrum_id":"CCMSLIB00017212311","spectrum_index":2266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 302.1856 Da; putative annotation: 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE; putative formula: C19H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.256,"smiles":null,"spectrum_id":"CCMSLIB00017212312","spectrum_index":2267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Isolongifolol (delta mass: 264.2455 Da; putative annotation: trans-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.451,"smiles":null,"spectrum_id":"CCMSLIB00017212313","spectrum_index":2268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 197.0287 Da; putative annotation: 2-[(3,5-Difluorophenyl)formamido]acetic acid; putative formula: C9H5F2NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.12,"smiles":null,"spectrum_id":"CCMSLIB00017212314","spectrum_index":2269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 88.0524 Da; putative annotation: (S)-(-)-1,2,4-Butanetriol; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017212315","spectrum_index":2270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eicosapentaenoyl ethanolamide (delta mass: 306.2179 Da; putative annotation: allo-Protolichesterinic acid; putative formula: C19H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.492,"smiles":null,"spectrum_id":"CCMSLIB00017212318","spectrum_index":2271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxypyridine-2-methanol (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.066,"smiles":null,"spectrum_id":"CCMSLIB00017212320","spectrum_index":2272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 147.0532 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.145,"smiles":null,"spectrum_id":"CCMSLIB00017212321","spectrum_index":2273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 224.1777 Da; putative annotation: N/A; putative formula: C14H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.248,"smiles":null,"spectrum_id":"CCMSLIB00017212322","spectrum_index":2274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Arg (delta mass: 128.0581 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.236,"smiles":null,"spectrum_id":"CCMSLIB00017212323","spectrum_index":2275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-5Z,9E,11Z,14Z,17Z-eicosapentaenoic acid (delta mass: 51.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017212324","spectrum_index":2276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 173.1052 Da; putative annotation: N/A; putative formula: C8H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.238,"smiles":null,"spectrum_id":"CCMSLIB00017212325","spectrum_index":2277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 183.126 Da; putative annotation: N/A; putative formula: C10H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.358,"smiles":null,"spectrum_id":"CCMSLIB00017212329","spectrum_index":2278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Norketamine (delta mass: 386.1698 Da; putative annotation: N/A; putative formula: C18H30N2O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.253,"smiles":null,"spectrum_id":"CCMSLIB00017212330","spectrum_index":2279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 777.7488 Da; putative annotation: N/A; putative formula: C50H100NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":887.82,"smiles":null,"spectrum_id":"CCMSLIB00017212331","spectrum_index":2280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 14.017 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.259,"smiles":null,"spectrum_id":"CCMSLIB00017212332","spectrum_index":2281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroandrographolide (delta mass: 66.0465 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.253,"smiles":null,"spectrum_id":"CCMSLIB00017212333","spectrum_index":2282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304041 p-Coumaraldehyde (delta mass: 32.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.086,"smiles":null,"spectrum_id":"CCMSLIB00017212334","spectrum_index":2283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 74.0371 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.186,"smiles":null,"spectrum_id":"CCMSLIB00017212335","spectrum_index":2284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dioctadecanoyl-sn-glycerol (delta mass: 90.0837 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.66,"smiles":null,"spectrum_id":"CCMSLIB00017212338","spectrum_index":2285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-DEOXYGUANOSINE - 20.0 eV (delta mass: 604.1991 Da; putative annotation: N/A; putative formula: C30H38O9P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.303,"smiles":null,"spectrum_id":"CCMSLIB00017212340","spectrum_index":2286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 306.0957 Da; putative annotation: N/A; putative formula: C15H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.187,"smiles":null,"spectrum_id":"CCMSLIB00017212341","spectrum_index":2287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 78.0466 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.383,"smiles":null,"spectrum_id":"CCMSLIB00017212342","spectrum_index":2288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.,17.alpha.-Dimethyl-5.beta.-androstane-3.alpha.,17.beta.-diol (delta mass: 103.0863 Da; putative annotation: N/A; putative formula: C2H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.365,"smiles":null,"spectrum_id":"CCMSLIB00017212343","spectrum_index":2289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 146.1091 Da; putative annotation: N/A; putative formula: C11H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.367,"smiles":null,"spectrum_id":"CCMSLIB00017212344","spectrum_index":2290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 699.441 Da; putative annotation: N/A; putative formula: C47H53N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":976.657,"smiles":null,"spectrum_id":"CCMSLIB00017212345","spectrum_index":2291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 115.0269 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.196,"smiles":null,"spectrum_id":"CCMSLIB00017212349","spectrum_index":2292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bis(2-hydroxyethyl) phthalate (delta mass: 215.1159 Da; putative annotation: N/A; putative formula: C10H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.202,"smiles":null,"spectrum_id":"CCMSLIB00017212350","spectrum_index":2293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 190.0497 Da; putative annotation: N/A; putative formula: C8H16O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.12,"smiles":null,"spectrum_id":"CCMSLIB00017212351","spectrum_index":2294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 270.1563 Da; putative annotation: N/A; putative formula: C17H22N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.248,"smiles":null,"spectrum_id":"CCMSLIB00017212352","spectrum_index":2295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ellipticine (delta mass: 46.0125 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.135,"smiles":null,"spectrum_id":"CCMSLIB00017212353","spectrum_index":2296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylparaben (delta mass: 56.026 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.096,"smiles":null,"spectrum_id":"CCMSLIB00017212354","spectrum_index":2297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 alcohol (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.295,"smiles":null,"spectrum_id":"CCMSLIB00017212356","spectrum_index":2298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-10-Hydroxycamptothecin (delta mass: 17.9968 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.11,"smiles":null,"spectrum_id":"CCMSLIB00017212359","spectrum_index":2299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 376.1357 Da; putative annotation: N/A; putative formula: C20H26O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.217,"smiles":null,"spectrum_id":"CCMSLIB00017212360","spectrum_index":2300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 780.4663 Da; putative annotation: N/A; putative formula: C42H68O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.537,"smiles":null,"spectrum_id":"CCMSLIB00017212361","spectrum_index":2301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 118.0636 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017212362","spectrum_index":2302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ329902 Dopamine|4-(2-aminoethyl)benzene-1,2-diol (delta mass: 73.0156 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.102,"smiles":null,"spectrum_id":"CCMSLIB00017212363","spectrum_index":2303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxycoumarin (delta mass: 94.0421 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.081,"smiles":null,"spectrum_id":"CCMSLIB00017212364","spectrum_index":2304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aleuretic Acid (delta mass: 80.0625 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.295,"smiles":null,"spectrum_id":"CCMSLIB00017212365","spectrum_index":2305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 432.1626 Da; putative annotation: N/A; putative formula: C32H20N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.317,"smiles":null,"spectrum_id":"CCMSLIB00017212367","spectrum_index":2306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asperilin (delta mass: 284.1664 Da; putative annotation: N/A; putative formula: C13H24N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.315,"smiles":null,"spectrum_id":"CCMSLIB00017212370","spectrum_index":2307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 244.1204 Da; putative annotation: N/A; putative formula: C14H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.212,"smiles":null,"spectrum_id":"CCMSLIB00017212371","spectrum_index":2308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 114.032 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.082,"smiles":null,"spectrum_id":"CCMSLIB00017212372","spectrum_index":2309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 340.2424 Da; putative annotation: N/A; putative formula: C22H33N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.464,"smiles":null,"spectrum_id":"CCMSLIB00017212373","spectrum_index":2310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 259.0471 Da; putative annotation: N/A; putative formula: C10HN11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.316,"smiles":null,"spectrum_id":"CCMSLIB00017212374","spectrum_index":2311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 74.0421 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.165,"smiles":null,"spectrum_id":"CCMSLIB00017212375","spectrum_index":2312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 55.0796 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.203,"smiles":null,"spectrum_id":"CCMSLIB00017212376","spectrum_index":2313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxy-2,2-dimethyl-4-chromanol (delta mass: 56.0265 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.144,"smiles":null,"spectrum_id":"CCMSLIB00017212379","spectrum_index":2314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 327.3157 Da; putative annotation: N/A; putative formula: C19H42N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.548,"smiles":null,"spectrum_id":"CCMSLIB00017212381","spectrum_index":2315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 95.0954 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.322,"smiles":null,"spectrum_id":"CCMSLIB00017212382","spectrum_index":2316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 116.0259 Da; putative annotation: N/A; putative formula: C8H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.096,"smiles":null,"spectrum_id":"CCMSLIB00017212383","spectrum_index":2317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Amino-2-methylphenyl)-2-piperidinone (delta mass: 71.0468 Da; putative annotation: N/A; putative formula: C2H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.18,"smiles":null,"spectrum_id":"CCMSLIB00017212384","spectrum_index":2318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 515.3093 Da; putative annotation: N/A; putative formula: C26H45NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.38,"smiles":null,"spectrum_id":"CCMSLIB00017212385","spectrum_index":2319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3'-Hydroxycotinine (delta mass: 40.9828 Da; putative annotation: N/A; putative formula: CNO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.08,"smiles":null,"spectrum_id":"CCMSLIB00017212387","spectrum_index":2320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 104.0981 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.341,"smiles":null,"spectrum_id":"CCMSLIB00017212389","spectrum_index":2321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 54.0309 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.284,"smiles":null,"spectrum_id":"CCMSLIB00017212391","spectrum_index":2322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxytestosterone (delta mass: 127.058 Da; putative annotation: N/A; putative formula: C5H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.269,"smiles":null,"spectrum_id":"CCMSLIB00017212392","spectrum_index":2323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 36.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.154,"smiles":null,"spectrum_id":"CCMSLIB00017212393","spectrum_index":2324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 184.1566 Da; putative annotation: N/A; putative formula: C10H20N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.222,"smiles":null,"spectrum_id":"CCMSLIB00017212395","spectrum_index":2325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 50.0 eV (delta mass: 387.0743 Da; putative annotation: N/A; putative formula: C22H13NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.166,"smiles":null,"spectrum_id":"CCMSLIB00017212396","spectrum_index":2326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 88.0529 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.15,"smiles":null,"spectrum_id":"CCMSLIB00017212397","spectrum_index":2327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 147.051 Da; putative annotation: N/A; putative formula: C9H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.115,"smiles":null,"spectrum_id":"CCMSLIB00017212399","spectrum_index":2328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 46.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.253,"smiles":null,"spectrum_id":"CCMSLIB00017212400","spectrum_index":2329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 138.0681 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.17,"smiles":null,"spectrum_id":"CCMSLIB00017212402","spectrum_index":2330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.29,"smiles":null,"spectrum_id":"CCMSLIB00017212403","spectrum_index":2331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 272.1989 Da; putative annotation: N/A; putative formula: C15H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.295,"smiles":null,"spectrum_id":"CCMSLIB00017212404","spectrum_index":2332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 118.0792 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.421,"smiles":null,"spectrum_id":"CCMSLIB00017212405","spectrum_index":2333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-5Z,8Z,11Z,13E,17Z-eicosapentaenoic acid (delta mass: 176.0686 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.295,"smiles":null,"spectrum_id":"CCMSLIB00017212408","spectrum_index":2334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 81.9722 Da; putative annotation: N/A; putative formula: C2H-1N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.199,"smiles":null,"spectrum_id":"CCMSLIB00017212410","spectrum_index":2335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-4-methylcoumarin (delta mass: 80.0254 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.08,"smiles":null,"spectrum_id":"CCMSLIB00017212411","spectrum_index":2336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 5.0502 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.137,"smiles":null,"spectrum_id":"CCMSLIB00017212412","spectrum_index":2337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 38.0448 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.099,"smiles":null,"spectrum_id":"CCMSLIB00017212413","spectrum_index":2338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetinic acid (delta mass: 170.1518 Da; putative annotation: N/A; putative formula: C8H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.499,"smiles":null,"spectrum_id":"CCMSLIB00017212414","spectrum_index":2339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 749.471 Da; putative annotation: N/A; putative formula: C54H59N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1076.6,"smiles":null,"spectrum_id":"CCMSLIB00017212415","spectrum_index":2340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 772.3502 Da; putative annotation: N/A; putative formula: C44H49N6O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":903.42,"smiles":null,"spectrum_id":"CCMSLIB00017212419","spectrum_index":2341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 101.0314 Da; putative annotation: N/A; putative formula: C4H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.093,"smiles":null,"spectrum_id":"CCMSLIB00017212420","spectrum_index":2342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 192.1859 Da; putative annotation: N/A; putative formula: C14H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.283,"smiles":null,"spectrum_id":"CCMSLIB00017212421","spectrum_index":2343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 367.1844 Da; putative annotation: N/A; putative formula: C15H29NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.255,"smiles":null,"spectrum_id":"CCMSLIB00017212422","spectrum_index":2344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hautriwaic acid (delta mass: 66.0468 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.253,"smiles":null,"spectrum_id":"CCMSLIB00017212423","spectrum_index":2345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 64.067 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.252,"smiles":null,"spectrum_id":"CCMSLIB00017212424","spectrum_index":2346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydrohistidyl-tryptophanyl-diketopiperazine (delta mass: 132.0411 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.171,"smiles":null,"spectrum_id":"CCMSLIB00017212425","spectrum_index":2347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lanosterol (delta mass: 147.0518 Da; putative annotation: N/A; putative formula: C9H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.445,"smiles":null,"spectrum_id":"CCMSLIB00017212428","spectrum_index":2348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 187.1196 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.185,"smiles":null,"spectrum_id":"CCMSLIB00017212430","spectrum_index":2349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 230.1617 Da; putative annotation: N/A; putative formula: C13H27O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.253,"smiles":null,"spectrum_id":"CCMSLIB00017212431","spectrum_index":2350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 84.9287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017212432","spectrum_index":2351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HOMOGENTISATE (delta mass: 36.0505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017212433","spectrum_index":2352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 10.0095 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":120.081,"smiles":null,"spectrum_id":"CCMSLIB00017212434","spectrum_index":2353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-(2,3-Dihydroxypropoxy)-9-oxononanoic acid (delta mass: 123.0079 Da; putative annotation: N/A; putative formula: C2H6NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.157,"smiles":null,"spectrum_id":"CCMSLIB00017212437","spectrum_index":2354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 138.1401 Da; putative annotation: N/A; putative formula: C10H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.273,"smiles":null,"spectrum_id":"CCMSLIB00017212439","spectrum_index":2355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 9H-carbazole-3-carboxylate (delta mass: 90.0316 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.134,"smiles":null,"spectrum_id":"CCMSLIB00017212440","spectrum_index":2356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 119.9258 Da; putative annotation: N/A; putative formula: C2HPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.131,"smiles":null,"spectrum_id":"CCMSLIB00017212441","spectrum_index":2357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 223.0489 Da; putative annotation: N/A; putative formula: C11H13NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.093,"smiles":null,"spectrum_id":"CCMSLIB00017212442","spectrum_index":2358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 539.5267 Da; putative annotation: N/A; putative formula: C34H69NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.732,"smiles":null,"spectrum_id":"CCMSLIB00017212443","spectrum_index":2359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 230.1235 Da; putative annotation: N/A; putative formula: C6H14N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.171,"smiles":null,"spectrum_id":"CCMSLIB00017212445","spectrum_index":2360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 302.126 Da; putative annotation: N/A; putative formula: C18H23PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.318,"smiles":null,"spectrum_id":"CCMSLIB00017212448","spectrum_index":2361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 62.0038 Da; putative annotation: N/A; putative formula: H3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.081,"smiles":null,"spectrum_id":"CCMSLIB00017212449","spectrum_index":2362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hellebrigenin-3-O-.beta.-glucoside (delta mass: 595.3025 Da; putative annotation: N/A; putative formula: C27H49NO11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1174.58,"smiles":null,"spectrum_id":"CCMSLIB00017212450","spectrum_index":2363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 584.1471 Da; putative annotation: N/A; putative formula: C36H24O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.188,"smiles":null,"spectrum_id":"CCMSLIB00017212451","spectrum_index":2364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Furanacetic acid, tetrahydro-5-(2-hydroxybutyl)-.alpha.-methyl-, 1-[[5-(1-carboxyethyl)tetrahydro-2-furanyl]methyl]propyl ester (delta mass: 297.1885 Da; putative annotation: N/A; putative formula: C15H29N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.458,"smiles":null,"spectrum_id":"CCMSLIB00017212452","spectrum_index":2365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)ethanol (delta mass: 132.0517 Da; putative annotation: N/A; putative formula: C6H13O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.185,"smiles":null,"spectrum_id":"CCMSLIB00017212453","spectrum_index":2366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 94.079 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.212,"smiles":null,"spectrum_id":"CCMSLIB00017212455","spectrum_index":2367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 261.2455 Da; putative annotation: N/A; putative formula: C18H31N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.332,"smiles":null,"spectrum_id":"CCMSLIB00017212458","spectrum_index":2368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 223.178 Da; putative annotation: N/A; putative formula: C11H21N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.254,"smiles":null,"spectrum_id":"CCMSLIB00017212459","spectrum_index":2369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 34.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.118,"smiles":null,"spectrum_id":"CCMSLIB00017212460","spectrum_index":2370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 42.0136 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.062,"smiles":null,"spectrum_id":"CCMSLIB00017212461","spectrum_index":2371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 235.1709 Da; putative annotation: N/A; putative formula: C18H21NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.232,"smiles":null,"spectrum_id":"CCMSLIB00017212462","spectrum_index":2372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 257.0998 Da; putative annotation: N/A; putative formula: C7H7N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.154,"smiles":null,"spectrum_id":"CCMSLIB00017212464","spectrum_index":2373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 236.1077 Da; putative annotation: N/A; putative formula: C12H17N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.169,"smiles":null,"spectrum_id":"CCMSLIB00017212465","spectrum_index":2374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-7-methoxy-9H-pyrido[3,4-b]indol-8-yl)-2-methyl- (delta mass: 10.0175 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.113,"smiles":null,"spectrum_id":"CCMSLIB00017212468","spectrum_index":2375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 96.0936 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.352,"smiles":null,"spectrum_id":"CCMSLIB00017212469","spectrum_index":2376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-4-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 393.2724 Da; putative annotation: N/A; putative formula: C19H39NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.442,"smiles":null,"spectrum_id":"CCMSLIB00017212470","spectrum_index":2377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 346.14 Da; putative annotation: N/A; putative formula: C16H22N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.419,"smiles":null,"spectrum_id":"CCMSLIB00017212472","spectrum_index":2378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 122.0228 Da; putative annotation: N/A; putative formula: C4H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.234,"smiles":null,"spectrum_id":"CCMSLIB00017212473","spectrum_index":2379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 387.2989 Da; putative annotation: N/A; putative formula: C22H45NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.526,"smiles":null,"spectrum_id":"CCMSLIB00017212474","spectrum_index":2380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 68.0107 Da; putative annotation: N/A; putative formula: CN4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.097,"smiles":null,"spectrum_id":"CCMSLIB00017212477","spectrum_index":2381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Epiandrographolide (delta mass: 136.0881 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.305,"smiles":null,"spectrum_id":"CCMSLIB00017212478","spectrum_index":2382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 118.0769 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.46,"smiles":null,"spectrum_id":"CCMSLIB00017212480","spectrum_index":2383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 513.2054 Da; putative annotation: N/A; putative formula: C33H27N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.286,"smiles":null,"spectrum_id":"CCMSLIB00017212481","spectrum_index":2384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 341.293 Da; putative annotation: N/A; putative formula: C20H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.395,"smiles":null,"spectrum_id":"CCMSLIB00017212482","spectrum_index":2385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 36.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017212483","spectrum_index":2386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310835 LPE 18:2 (delta mass: 678.3817 Da; putative annotation: N/A; putative formula: C38H54N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1156.67,"smiles":null,"spectrum_id":"CCMSLIB00017212484","spectrum_index":2387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .omega.-3 Arachidonic acid from NIST14 (delta mass: 197.0885 Da; putative annotation: N/A; putative formula: C10H15NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.336,"smiles":null,"spectrum_id":"CCMSLIB00017212488","spectrum_index":2388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Zymosterol from NIST14 (delta mass: 69.0235 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.37,"smiles":null,"spectrum_id":"CCMSLIB00017212489","spectrum_index":2389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-3-Methyl-5-(1,2,5,5-tetramethyl-7-oxo-3,4,4a,6-tetrahydro-2H-naphthalen-1-yl)pent-2-enoic acid (delta mass: 116.0986 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.325,"smiles":null,"spectrum_id":"CCMSLIB00017212490","spectrum_index":2390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 647.7655 Da; putative annotation: N/A; putative formula: C20H12N2O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.826,"smiles":null,"spectrum_id":"CCMSLIB00017212491","spectrum_index":2391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatol (delta mass: 132.053 Da; putative annotation: N/A; putative formula: C6H13O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.134,"smiles":null,"spectrum_id":"CCMSLIB00017212492","spectrum_index":2392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 576.3532 Da; putative annotation: N/A; putative formula: C31H52N4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.429,"smiles":null,"spectrum_id":"CCMSLIB00017212493","spectrum_index":2393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 280.3053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":873.581,"smiles":null,"spectrum_id":"CCMSLIB00017212495","spectrum_index":2394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017212498","spectrum_index":2395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[3-[3-Hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxyphenyl]-5-oxo-2H-furan-2-yl]acetic acid (delta mass: 249.147 Da; putative annotation: N/A; putative formula: C13H19N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.254,"smiles":null,"spectrum_id":"CCMSLIB00017212499","spectrum_index":2396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-glutamic acid (delta mass: 126.1045 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017212500","spectrum_index":2397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 50.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.269,"smiles":null,"spectrum_id":"CCMSLIB00017212501","spectrum_index":2398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 115.0268 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.104,"smiles":null,"spectrum_id":"CCMSLIB00017212502","spectrum_index":2399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 50.0 eV (delta mass: 75.0578 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017212504","spectrum_index":2400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12-Ketodeoxycholic acid from NIST14 (delta mass: 1075.4539 Da; putative annotation: N/A; putative formula: C64H69NO12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1466.74,"smiles":null,"spectrum_id":"CCMSLIB00017212507","spectrum_index":2401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 507.3058 Da; putative annotation: N/A; putative formula: C25H41N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.574,"smiles":null,"spectrum_id":"CCMSLIB00017212508","spectrum_index":2402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 194.041 Da; putative annotation: N/A; putative formula: C3H10N6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.106,"smiles":null,"spectrum_id":"CCMSLIB00017212509","spectrum_index":2403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 163.1045 Da; putative annotation: N/A; putative formula: C4H13N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.152,"smiles":null,"spectrum_id":"CCMSLIB00017212510","spectrum_index":2404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 20.0243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.084,"smiles":null,"spectrum_id":"CCMSLIB00017212511","spectrum_index":2405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GUANINE (delta mass: 59.0551 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.112,"smiles":null,"spectrum_id":"CCMSLIB00017212513","spectrum_index":2406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 90.0424 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.118,"smiles":null,"spectrum_id":"CCMSLIB00017212515","spectrum_index":2407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 280.24 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.451,"smiles":null,"spectrum_id":"CCMSLIB00017212517","spectrum_index":2408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 280.2856 Da; putative annotation: N/A; putative formula: C18H36N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.352,"smiles":null,"spectrum_id":"CCMSLIB00017212518","spectrum_index":2409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 208.1328 Da; putative annotation: N/A; putative formula: C10H16N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.256,"smiles":null,"spectrum_id":"CCMSLIB00017212519","spectrum_index":2410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 301.2984 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.546,"smiles":null,"spectrum_id":"CCMSLIB00017212520","spectrum_index":2411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 17.0097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.065,"smiles":null,"spectrum_id":"CCMSLIB00017212522","spectrum_index":2412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 116.0615 Da; putative annotation: N/A; putative formula: C3H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.127,"smiles":null,"spectrum_id":"CCMSLIB00017212524","spectrum_index":2413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 337.3329 Da; putative annotation: N/A; putative formula: C18H39N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":954.847,"smiles":null,"spectrum_id":"CCMSLIB00017212526","spectrum_index":2414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 72.0431 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.28,"smiles":null,"spectrum_id":"CCMSLIB00017212527","spectrum_index":2415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-8,11,14-Eicosatrienoic acid (delta mass: 191.1287 Da; putative annotation: N/A; putative formula: C8H13N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.392,"smiles":null,"spectrum_id":"CCMSLIB00017212528","spectrum_index":2416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 118.0786 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.29,"smiles":null,"spectrum_id":"CCMSLIB00017212529","spectrum_index":2417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Didodecyl 3,3'-thiodipropionate oxide from NIST14 - Hydroxylated variant ? (delta mass: 547.4284 Da; putative annotation: N/A; putative formula: C31H57N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1078.84,"smiles":null,"spectrum_id":"CCMSLIB00017212531","spectrum_index":2418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 445.1599 Da; putative annotation: N/A; putative formula: C20H23N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.22,"smiles":null,"spectrum_id":"CCMSLIB00017212533","spectrum_index":2419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-1,3-Dihydroxydammara-12,24-dien-26-oic acid (delta mass: 124.0674 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.43,"smiles":null,"spectrum_id":"CCMSLIB00017212535","spectrum_index":2420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Palmitelaidic acid from NIST14 (delta mass: 224.2493 Da; putative annotation: N/A; putative formula: C16H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.481,"smiles":null,"spectrum_id":"CCMSLIB00017212536","spectrum_index":2421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Arg (delta mass: 115.0263 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.214,"smiles":null,"spectrum_id":"CCMSLIB00017212538","spectrum_index":2422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 96.021 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.145,"smiles":null,"spectrum_id":"CCMSLIB00017212539","spectrum_index":2423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cinnamylpiperazine (delta mass: 146.061 Da; putative annotation: N/A; putative formula: C5H11N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.215,"smiles":null,"spectrum_id":"CCMSLIB00017212540","spectrum_index":2424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 279.4882 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.764,"smiles":null,"spectrum_id":"CCMSLIB00017212542","spectrum_index":2425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 165.173 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.27,"smiles":null,"spectrum_id":"CCMSLIB00017212545","spectrum_index":2426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 162.0494 Da; putative annotation: N/A; putative formula: C4H11N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.12,"smiles":null,"spectrum_id":"CCMSLIB00017212546","spectrum_index":2427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Perillyl alcohol (delta mass: 45.9878 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.115,"smiles":null,"spectrum_id":"CCMSLIB00017212547","spectrum_index":2428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 72.0418 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.3,"smiles":null,"spectrum_id":"CCMSLIB00017212548","spectrum_index":2429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Lys (delta mass: 113.0844 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.219,"smiles":null,"spectrum_id":"CCMSLIB00017212549","spectrum_index":2430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR101043 Indole-3-carboxyaldehyde|Indole-3-aldehyde|3-Formylindole|1H-indole-3-carbaldehyde|beta-Indolylaldehyde (delta mass: 44.0171 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.077,"smiles":null,"spectrum_id":"CCMSLIB00017212550","spectrum_index":2431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 175.0673 Da; putative annotation: N/A; putative formula: C7H15NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.164,"smiles":null,"spectrum_id":"CCMSLIB00017212554","spectrum_index":2432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of decursinol (delta mass: 372.1554 Da; putative annotation: N/A; putative formula: C18H24N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.252,"smiles":null,"spectrum_id":"CCMSLIB00017212555","spectrum_index":2433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU099405 8-Hydroxyquinoline|quinolin-8-ol (delta mass: 43.0056 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.066,"smiles":null,"spectrum_id":"CCMSLIB00017212556","spectrum_index":2434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl hydrogen azelate (delta mass: 145.0749 Da; putative annotation: N/A; putative formula: C7H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.203,"smiles":null,"spectrum_id":"CCMSLIB00017212557","spectrum_index":2435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 71.0623 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017212558","spectrum_index":2436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 113.0107 Da; putative annotation: N/A; putative formula: C4H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.086,"smiles":null,"spectrum_id":"CCMSLIB00017212559","spectrum_index":2437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 146.0528 Da; putative annotation: N/A; putative formula: C5H12N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.119,"smiles":null,"spectrum_id":"CCMSLIB00017212562","spectrum_index":2438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 258.1828 Da; putative annotation: N/A; putative formula: C14H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.254,"smiles":null,"spectrum_id":"CCMSLIB00017212564","spectrum_index":2439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 200.0316 Da; putative annotation: N/A; putative formula: C8H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.123,"smiles":null,"spectrum_id":"CCMSLIB00017212565","spectrum_index":2440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 32.0404 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.137,"smiles":null,"spectrum_id":"CCMSLIB00017212566","spectrum_index":2441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 13.0141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.111,"smiles":null,"spectrum_id":"CCMSLIB00017212567","spectrum_index":2442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 45.9952 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.071,"smiles":null,"spectrum_id":"CCMSLIB00017212568","spectrum_index":2443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 41.0224 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.124,"smiles":null,"spectrum_id":"CCMSLIB00017212570","spectrum_index":2444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 24.0121 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.084,"smiles":null,"spectrum_id":"CCMSLIB00017212573","spectrum_index":2445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 55.0118 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.077,"smiles":null,"spectrum_id":"CCMSLIB00017212574","spectrum_index":2446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 86.055 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.12,"smiles":null,"spectrum_id":"CCMSLIB00017212575","spectrum_index":2447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 431.2879 Da; putative annotation: N/A; putative formula: C22H41NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.421,"smiles":null,"spectrum_id":"CCMSLIB00017212576","spectrum_index":2448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 74.0 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.087,"smiles":null,"spectrum_id":"CCMSLIB00017212577","spectrum_index":2449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 18.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.164,"smiles":null,"spectrum_id":"CCMSLIB00017212578","spectrum_index":2450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 373.1697 Da; putative annotation: N/A; putative formula: C25H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.256,"smiles":null,"spectrum_id":"CCMSLIB00017212580","spectrum_index":2451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 301.1529 Da; putative annotation: N/A; putative formula: C14H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.213,"smiles":null,"spectrum_id":"CCMSLIB00017212581","spectrum_index":2452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,2,3,4-Tetrahydro-9H-carbazol-9-yl)propanohydrazide (delta mass: 175.0939 Da; putative annotation: N/A; putative formula: C2H9N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.254,"smiles":null,"spectrum_id":"CCMSLIB00017212584","spectrum_index":2453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Acetyl-L-serine - 40.0 eV (delta mass: 124.0887 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.149,"smiles":null,"spectrum_id":"CCMSLIB00017212585","spectrum_index":2454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid (delta mass: 293.2726 Da; putative annotation: N/A; putative formula: C19H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.515,"smiles":null,"spectrum_id":"CCMSLIB00017212586","spectrum_index":2455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 72.1281 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.183,"smiles":null,"spectrum_id":"CCMSLIB00017212588","spectrum_index":2456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 100.0502 Da; putative annotation: N/A; putative formula: CH4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.094,"smiles":null,"spectrum_id":"CCMSLIB00017212589","spectrum_index":2457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 56.0264 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017212590","spectrum_index":2458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 102.0681 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.148,"smiles":null,"spectrum_id":"CCMSLIB00017212593","spectrum_index":2459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 44.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.143,"smiles":null,"spectrum_id":"CCMSLIB00017212594","spectrum_index":2460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 80.0257 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.247,"smiles":null,"spectrum_id":"CCMSLIB00017212596","spectrum_index":2461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 13.0145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.08,"smiles":null,"spectrum_id":"CCMSLIB00017212597","spectrum_index":2462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 59.0392 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.407,"smiles":null,"spectrum_id":"CCMSLIB00017212598","spectrum_index":2463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 161.0756 Da; putative annotation: N/A; putative formula: C10H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.171,"smiles":null,"spectrum_id":"CCMSLIB00017212600","spectrum_index":2464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid (delta mass: 41.0375 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.177,"smiles":null,"spectrum_id":"CCMSLIB00017212601","spectrum_index":2465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 306.0963 Da; putative annotation: N/A; putative formula: C23H15O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.162,"smiles":null,"spectrum_id":"CCMSLIB00017212602","spectrum_index":2466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10-Hydroxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl) (Z)-2-methylbut-2-enoate (delta mass: 87.0681 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.201,"smiles":null,"spectrum_id":"CCMSLIB00017212604","spectrum_index":2467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 106.0414 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017212606","spectrum_index":2468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ356601 Haloperidol|4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butan-1-one (delta mass: 246.1168 Da; putative annotation: N/A; putative formula: C9H20N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.264,"smiles":null,"spectrum_id":"CCMSLIB00017212607","spectrum_index":2469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 64.0159 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017212608","spectrum_index":2470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 126.088 Da; putative annotation: N/A; putative formula: C8H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.221,"smiles":null,"spectrum_id":"CCMSLIB00017212609","spectrum_index":2471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Aminocyclopentanecarboxylic acid (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.097,"smiles":null,"spectrum_id":"CCMSLIB00017212611","spectrum_index":2472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 13.0314 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.263,"smiles":null,"spectrum_id":"CCMSLIB00017212612","spectrum_index":2473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 659.532 Da; putative annotation: N/A; putative formula: C34H65N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.748,"smiles":null,"spectrum_id":"CCMSLIB00017212613","spectrum_index":2474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 264.2469 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.437,"smiles":null,"spectrum_id":"CCMSLIB00017212615","spectrum_index":2475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 105.1854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.246,"smiles":null,"spectrum_id":"CCMSLIB00017212617","spectrum_index":2476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 129.0551 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.215,"smiles":null,"spectrum_id":"CCMSLIB00017212618","spectrum_index":2477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 649.4792 Da; putative annotation: N/A; putative formula: C36H59N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":956.742,"smiles":null,"spectrum_id":"CCMSLIB00017212620","spectrum_index":2478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Pyridinyl)ethanol (delta mass: 41.0 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.076,"smiles":null,"spectrum_id":"CCMSLIB00017212621","spectrum_index":2479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 140.0834 Da; putative annotation: N/A; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.32,"smiles":null,"spectrum_id":"CCMSLIB00017212622","spectrum_index":2480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 8.9891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.091,"smiles":null,"spectrum_id":"CCMSLIB00017212623","spectrum_index":2481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 74.058 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.217,"smiles":null,"spectrum_id":"CCMSLIB00017212624","spectrum_index":2482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 298.2506 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.316,"smiles":null,"spectrum_id":"CCMSLIB00017212626","spectrum_index":2483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250806 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 68.0263 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.086,"smiles":null,"spectrum_id":"CCMSLIB00017212628","spectrum_index":2484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 80.0633 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.301,"smiles":null,"spectrum_id":"CCMSLIB00017212630","spectrum_index":2485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 70.0526 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.113,"smiles":null,"spectrum_id":"CCMSLIB00017212631","spectrum_index":2486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Hydroxy-L-proline (delta mass: 42.0218 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.087,"smiles":null,"spectrum_id":"CCMSLIB00017212632","spectrum_index":2487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.076,"smiles":null,"spectrum_id":"CCMSLIB00017212633","spectrum_index":2488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 42.011 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.287,"smiles":null,"spectrum_id":"CCMSLIB00017212635","spectrum_index":2489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 359.2313 Da; putative annotation: N/A; putative formula: C19H37NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.291,"smiles":null,"spectrum_id":"CCMSLIB00017212638","spectrum_index":2490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 783.6015 Da; putative annotation: N/A; putative formula: C48H81NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1158.89,"smiles":null,"spectrum_id":"CCMSLIB00017212639","spectrum_index":2491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 78.0219 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017212640","spectrum_index":2492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 84.0577 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.243,"smiles":null,"spectrum_id":"CCMSLIB00017212641","spectrum_index":2493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 224.1857 Da; putative annotation: N/A; putative formula: C9H20N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.252,"smiles":null,"spectrum_id":"CCMSLIB00017212643","spectrum_index":2494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.066,"smiles":null,"spectrum_id":"CCMSLIB00017212645","spectrum_index":2495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 134.1091 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.341,"smiles":null,"spectrum_id":"CCMSLIB00017212647","spectrum_index":2496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 160.0724 Da; putative annotation: N/A; putative formula: C7H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.32,"smiles":null,"spectrum_id":"CCMSLIB00017212648","spectrum_index":2497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 53.0265 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017212650","spectrum_index":2498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 663.2688 Da; putative annotation: N/A; putative formula: C37H45NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.35,"smiles":null,"spectrum_id":"CCMSLIB00017212652","spectrum_index":2499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 12-hydroxystearate (delta mass: 38.0518 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.341,"smiles":null,"spectrum_id":"CCMSLIB00017212654","spectrum_index":2500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 259.1783 Da; putative annotation: N/A; putative formula: C13H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.27,"smiles":null,"spectrum_id":"CCMSLIB00017212655","spectrum_index":2501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 27.9258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.996,"smiles":null,"spectrum_id":"CCMSLIB00017212657","spectrum_index":2502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Euscaphic acid (delta mass: 341.1343 Da; putative annotation: N/A; putative formula: C14H23N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.492,"smiles":null,"spectrum_id":"CCMSLIB00017212658","spectrum_index":2503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 300.2284 Da; putative annotation: N/A; putative formula: C21H32O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.418,"smiles":null,"spectrum_id":"CCMSLIB00017212659","spectrum_index":2504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexamethyleneimine (delta mass: 127.0271 Da; putative annotation: N/A; putative formula: C5H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.139,"smiles":null,"spectrum_id":"CCMSLIB00017212662","spectrum_index":2505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 25.0936 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.17,"smiles":null,"spectrum_id":"CCMSLIB00017212664","spectrum_index":2506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 116.0698 Da; putative annotation: N/A; putative formula: C3H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.156,"smiles":null,"spectrum_id":"CCMSLIB00017212665","spectrum_index":2507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Pregnen-17.alpha., 20.alpha.-diol-3-one (delta mass: 79.957 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.199,"smiles":null,"spectrum_id":"CCMSLIB00017212666","spectrum_index":2508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 341.1513 Da; putative annotation: N/A; putative formula: C13H27NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.228,"smiles":null,"spectrum_id":"CCMSLIB00017212667","spectrum_index":2509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 48.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.155,"smiles":null,"spectrum_id":"CCMSLIB00017212669","spectrum_index":2510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 163.1302 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.31,"smiles":null,"spectrum_id":"CCMSLIB00017212672","spectrum_index":2511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 60.1294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.231,"smiles":null,"spectrum_id":"CCMSLIB00017212673","spectrum_index":2512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 148.0888 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.31,"smiles":null,"spectrum_id":"CCMSLIB00017212674","spectrum_index":2513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 62.0518 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.315,"smiles":null,"spectrum_id":"CCMSLIB00017212675","spectrum_index":2514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 560.2417 Da; putative annotation: N/A; putative formula: C26H36N6O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.453,"smiles":null,"spectrum_id":"CCMSLIB00017212676","spectrum_index":2515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.097,"smiles":null,"spectrum_id":"CCMSLIB00017212678","spectrum_index":2516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017212681","spectrum_index":2517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Morpholinyl)-1-phenylethanol (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017212682","spectrum_index":2518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 55.0308 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.18,"smiles":null,"spectrum_id":"CCMSLIB00017212683","spectrum_index":2519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 219.1472 Da; putative annotation: N/A; putative formula: C10H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.29,"smiles":null,"spectrum_id":"CCMSLIB00017212684","spectrum_index":2520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 114.0359 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.07,"smiles":null,"spectrum_id":"CCMSLIB00017212685","spectrum_index":2521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Butenoic acid, 2-ethyl-, (Z)- (delta mass: 250.1778 Da; putative annotation: N/A; putative formula: C9H18N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.253,"smiles":null,"spectrum_id":"CCMSLIB00017212687","spectrum_index":2522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 1056.7438 Da; putative annotation: N/A; putative formula: C57H104N2O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1440.89,"smiles":null,"spectrum_id":"CCMSLIB00017212690","spectrum_index":2523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 193.0681 Da; putative annotation: N/A; putative formula: C2H3N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.155,"smiles":null,"spectrum_id":"CCMSLIB00017212691","spectrum_index":2524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 75.0432 Da; putative annotation: N/A; putative formula: CH5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.27,"smiles":null,"spectrum_id":"CCMSLIB00017212692","spectrum_index":2525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MMV687145 (delta mass: 59.0735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.185,"smiles":null,"spectrum_id":"CCMSLIB00017212693","spectrum_index":2526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 171.1981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.504,"smiles":null,"spectrum_id":"CCMSLIB00017212695","spectrum_index":2527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 207.1112 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.417,"smiles":null,"spectrum_id":"CCMSLIB00017212696","spectrum_index":2528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 117.1041 Da; putative annotation: N/A; putative formula: C3H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017212699","spectrum_index":2529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.305,"smiles":null,"spectrum_id":"CCMSLIB00017212700","spectrum_index":2530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 46.0426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.259,"smiles":null,"spectrum_id":"CCMSLIB00017212701","spectrum_index":2531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Azelaic acid from NIST14 (delta mass: 102.0688 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.181,"smiles":null,"spectrum_id":"CCMSLIB00017212702","spectrum_index":2532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,18-Dihydroxykaurenolide (delta mass: 122.0728 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.279,"smiles":null,"spectrum_id":"CCMSLIB00017212704","spectrum_index":2533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norverapamil (delta mass: 381.0727 Da; putative annotation: N/A; putative formula: C15H16N3O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.347,"smiles":null,"spectrum_id":"CCMSLIB00017212705","spectrum_index":2534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 602.1447 Da; putative annotation: N/A; putative formula: C23H31N4O11PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.215,"smiles":null,"spectrum_id":"CCMSLIB00017212708","spectrum_index":2535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 41.0015 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.103,"smiles":null,"spectrum_id":"CCMSLIB00017212709","spectrum_index":2536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 280.0094 Da; putative annotation: N/A; putative formula: C7H9N2O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.069,"smiles":null,"spectrum_id":"CCMSLIB00017212710","spectrum_index":2537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 356.1622 Da; putative annotation: N/A; putative formula: C21H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.275,"smiles":null,"spectrum_id":"CCMSLIB00017212712","spectrum_index":2538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycerol (delta mass: 302.2314 Da; putative annotation: N/A; putative formula: C14H30N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":923.777,"smiles":null,"spectrum_id":"CCMSLIB00017212713","spectrum_index":2539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 67.0232 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.058,"smiles":null,"spectrum_id":"CCMSLIB00017212715","spectrum_index":2540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 168.0485 Da; putative annotation: N/A; putative formula: C12H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.123,"smiles":null,"spectrum_id":"CCMSLIB00017212717","spectrum_index":2541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 80.0621 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017212718","spectrum_index":2542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Isolongifolol (delta mass: 205.2175 Da; putative annotation: N/A; putative formula: C15H27NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.423,"smiles":null,"spectrum_id":"CCMSLIB00017212720","spectrum_index":2543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 83.0451 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.23,"smiles":null,"spectrum_id":"CCMSLIB00017212721","spectrum_index":2544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1071.1006 Da; putative annotation: N/A; putative formula: C73H138N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1293.2,"smiles":null,"spectrum_id":"CCMSLIB00017212722","spectrum_index":2545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 182.1708 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.241,"smiles":null,"spectrum_id":"CCMSLIB00017212724","spectrum_index":2546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 70.0278 Da; putative annotation: N/A; putative formula: CH2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.114,"smiles":null,"spectrum_id":"CCMSLIB00017212726","spectrum_index":2547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 162.0313 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.134,"smiles":null,"spectrum_id":"CCMSLIB00017212728","spectrum_index":2548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 326.1838 Da; putative annotation: N/A; putative formula: C16H26N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.275,"smiles":null,"spectrum_id":"CCMSLIB00017212729","spectrum_index":2549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 60.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.305,"smiles":null,"spectrum_id":"CCMSLIB00017212730","spectrum_index":2550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetraethylene glycol monomethyl ether (delta mass: 213.2453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.384,"smiles":null,"spectrum_id":"CCMSLIB00017212731","spectrum_index":2551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 97.0415 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017212735","spectrum_index":2552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 40.0114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.108,"smiles":null,"spectrum_id":"CCMSLIB00017212736","spectrum_index":2553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 946.2924 Da; putative annotation: N/A; putative formula: C58H46N2O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1167.48,"smiles":null,"spectrum_id":"CCMSLIB00017212737","spectrum_index":2554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carteolol (delta mass: 589.3137 Da; putative annotation: N/A; putative formula: C31H35N13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.5,"smiles":null,"spectrum_id":"CCMSLIB00017212738","spectrum_index":2555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 90.0853 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.33,"smiles":null,"spectrum_id":"CCMSLIB00017212739","spectrum_index":2556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 60.0182 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.146,"smiles":null,"spectrum_id":"CCMSLIB00017212740","spectrum_index":2557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 169.0372 Da; putative annotation: N/A; putative formula: C7H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.113,"smiles":null,"spectrum_id":"CCMSLIB00017212743","spectrum_index":2558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Leu-Glu from NIST14 (delta mass: 210.1006 Da; putative annotation: N/A; putative formula: C10H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.245,"smiles":null,"spectrum_id":"CCMSLIB00017212745","spectrum_index":2559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 128.106 Da; putative annotation: N/A; putative formula: C5H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.353,"smiles":null,"spectrum_id":"CCMSLIB00017212746","spectrum_index":2560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 968.5001 Da; putative annotation: N/A; putative formula: C64H60N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1149.57,"smiles":null,"spectrum_id":"CCMSLIB00017212747","spectrum_index":2561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 565.4193 Da; putative annotation: N/A; putative formula: C29H59NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.511,"smiles":null,"spectrum_id":"CCMSLIB00017212748","spectrum_index":2562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 153.0779 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.128,"smiles":null,"spectrum_id":"CCMSLIB00017212749","spectrum_index":2563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 801.3702 Da; putative annotation: N/A; putative formula: C49H55NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1000.46,"smiles":null,"spectrum_id":"CCMSLIB00017212752","spectrum_index":2564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5470-37-1 CollisionEnergy:205060 (delta mass: 221.0898 Da; putative annotation: N/A; putative formula: C8H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.203,"smiles":null,"spectrum_id":"CCMSLIB00017212754","spectrum_index":2565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 53.0266 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.269,"smiles":null,"spectrum_id":"CCMSLIB00017212755","spectrum_index":2566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 3.44 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.5,"smiles":null,"spectrum_id":"CCMSLIB00017212756","spectrum_index":2567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 67.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.29,"smiles":null,"spectrum_id":"CCMSLIB00017212757","spectrum_index":2568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 345.2517 Da; putative annotation: N/A; putative formula: C18H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.51,"smiles":null,"spectrum_id":"CCMSLIB00017212758","spectrum_index":2569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 83.0618 Da; putative annotation: N/A; putative formula: C2H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.062,"smiles":null,"spectrum_id":"CCMSLIB00017212761","spectrum_index":2570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 492.7593 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.83,"smiles":null,"spectrum_id":"CCMSLIB00017212763","spectrum_index":2571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1119.5483 Da; putative annotation: N/A; putative formula: C55H77N9O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1312.62,"smiles":null,"spectrum_id":"CCMSLIB00017212764","spectrum_index":2572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ginsenoside F1 (delta mass: 118.0723 Da; putative annotation: N/A; putative formula: H6N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.519,"smiles":null,"spectrum_id":"CCMSLIB00017212765","spectrum_index":2573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rabelomycin (delta mass: 14.0137 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.1,"smiles":null,"spectrum_id":"CCMSLIB00017212766","spectrum_index":2574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 111.0112 Da; putative annotation: N/A; putative formula: C8HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.135,"smiles":null,"spectrum_id":"CCMSLIB00017212767","spectrum_index":2575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 51.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017212769","spectrum_index":2576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 104.0586 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017212772","spectrum_index":2577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 178.0256 Da; putative annotation: N/A; putative formula: C3H7N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.128,"smiles":null,"spectrum_id":"CCMSLIB00017212773","spectrum_index":2578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 606.9304 Da; putative annotation: N/A; putative formula: C18H9N9O6S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.022,"smiles":null,"spectrum_id":"CCMSLIB00017212774","spectrum_index":2579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 326.0988 Da; putative annotation: N/A; putative formula: C12H10N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.138,"smiles":null,"spectrum_id":"CCMSLIB00017212775","spectrum_index":2580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 70.0179 Da; putative annotation: N/A; putative formula: C2H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.094,"smiles":null,"spectrum_id":"CCMSLIB00017212776","spectrum_index":2581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxybenzoic acid (delta mass: 112.1253 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017212778","spectrum_index":2582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 106.0785 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.138,"smiles":null,"spectrum_id":"CCMSLIB00017212781","spectrum_index":2583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 46.0432 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.097,"smiles":null,"spectrum_id":"CCMSLIB00017212782","spectrum_index":2584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310786 Glutamyl-S-(C4H7O2)-cysteinylglycine (delta mass: 393.1211 Da; putative annotation: N/A; putative formula: C22H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":787.249,"smiles":null,"spectrum_id":"CCMSLIB00017212783","spectrum_index":2585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,24-Dihydroxyvitamin D3 (delta mass: 154.0996 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.436,"smiles":null,"spectrum_id":"CCMSLIB00017212784","spectrum_index":2586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 79.0634 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.29,"smiles":null,"spectrum_id":"CCMSLIB00017212785","spectrum_index":2587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 157.0448 Da; putative annotation: N/A; putative formula: C10H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.131,"smiles":null,"spectrum_id":"CCMSLIB00017212787","spectrum_index":2588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 41.9746 Da; putative annotation: N/A; putative formula: CH-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017212789","spectrum_index":2589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnan-3.alpha.,17,20.beta.,21-tetrol-11-one (delta mass: 94.0767 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.325,"smiles":null,"spectrum_id":"CCMSLIB00017212791","spectrum_index":2590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SINAPIC ACID CollisionEnergy:205060 (delta mass: 210.9558 Da; putative annotation: N/A; putative formula: CH2N5O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.031,"smiles":null,"spectrum_id":"CCMSLIB00017212792","spectrum_index":2591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 234.1239 Da; putative annotation: N/A; putative formula: C8H19N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.335,"smiles":null,"spectrum_id":"CCMSLIB00017212793","spectrum_index":2592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-3.alpha.-ol-11,20-dione (delta mass: 76.0299 Da; putative annotation: N/A; putative formula: H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.272,"smiles":null,"spectrum_id":"CCMSLIB00017212794","spectrum_index":2593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 321.2751 Da; putative annotation: N/A; putative formula: C15H31N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.316,"smiles":null,"spectrum_id":"CCMSLIB00017212796","spectrum_index":2594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Arg-Ile from NIST14 (delta mass: 209.0438 Da; putative annotation: N/A; putative formula: C8H7N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.247,"smiles":null,"spectrum_id":"CCMSLIB00017212797","spectrum_index":2595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 121.1118 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.188,"smiles":null,"spectrum_id":"CCMSLIB00017212800","spectrum_index":2596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 42.0218 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.092,"smiles":null,"spectrum_id":"CCMSLIB00017212801","spectrum_index":2597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ357803 Aspirin|Acetyl salicilic acid|2-acetyloxybenzoic acid (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017212802","spectrum_index":2598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 63.0187 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.11,"smiles":null,"spectrum_id":"CCMSLIB00017212803","spectrum_index":2599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 150.0527 Da; putative annotation: N/A; putative formula: C5H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.123,"smiles":null,"spectrum_id":"CCMSLIB00017212805","spectrum_index":2600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methoxycarbonyl)but-3-enoic acid (delta mass: 67.0633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.113,"smiles":null,"spectrum_id":"CCMSLIB00017212806","spectrum_index":2601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 98.082 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017212809","spectrum_index":2602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Digoxigenin (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.259,"smiles":null,"spectrum_id":"CCMSLIB00017212810","spectrum_index":2603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Amyrin (delta mass: 104.0955 Da; putative annotation: N/A; putative formula: H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.489,"smiles":null,"spectrum_id":"CCMSLIB00017212811","spectrum_index":2604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 90.0101 Da; putative annotation: N/A; putative formula: C6H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.134,"smiles":null,"spectrum_id":"CCMSLIB00017212812","spectrum_index":2605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 72.0362 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.284,"smiles":null,"spectrum_id":"CCMSLIB00017212813","spectrum_index":2606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 445.1438 Da; putative annotation: N/A; putative formula: C18H28N3O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.329,"smiles":null,"spectrum_id":"CCMSLIB00017212814","spectrum_index":2607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 531.2544 Da; putative annotation: N/A; putative formula: C22H37N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.315,"smiles":null,"spectrum_id":"CCMSLIB00017212816","spectrum_index":2608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:KO009069 Muramate|2-Amino-3-O-D-1-carboxyethyl-2-deoxy-D-glucose|3-O-alpha-Carboxyethyl-D-glucosamine|Muramic acid (delta mass: 187.1009 Da; putative annotation: N/A; putative formula: C12H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.209,"smiles":null,"spectrum_id":"CCMSLIB00017212818","spectrum_index":2609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 305.1058 Da; putative annotation: N/A; putative formula: C17H14F3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.187,"smiles":null,"spectrum_id":"CCMSLIB00017212820","spectrum_index":2610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. isopropyl ester (delta mass: 38.0145 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.309,"smiles":null,"spectrum_id":"CCMSLIB00017212821","spectrum_index":2611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 110.0564 Da; putative annotation: N/A; putative formula: C7H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.137,"smiles":null,"spectrum_id":"CCMSLIB00017212822","spectrum_index":2612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 119.0583 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.29,"smiles":null,"spectrum_id":"CCMSLIB00017212824","spectrum_index":2613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 186.1085 Da; putative annotation: N/A; putative formula: C10H20O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.224,"smiles":null,"spectrum_id":"CCMSLIB00017212825","spectrum_index":2614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 14.0084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.085,"smiles":null,"spectrum_id":"CCMSLIB00017212828","spectrum_index":2615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 313.13 Da; putative annotation: N/A; putative formula: C12H20N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.338,"smiles":null,"spectrum_id":"CCMSLIB00017212829","spectrum_index":2616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 157.0571 Da; putative annotation: N/A; putative formula: H3N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.105,"smiles":null,"spectrum_id":"CCMSLIB00017212830","spectrum_index":2617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 26.0168 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.259,"smiles":null,"spectrum_id":"CCMSLIB00017212832","spectrum_index":2618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Sitosterol (delta mass: 218.2166 Da; putative annotation: N/A; putative formula: C15H26N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.61,"smiles":null,"spectrum_id":"CCMSLIB00017212833","spectrum_index":2619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid (delta mass: 482.1944 Da; putative annotation: N/A; putative formula: C22H27N8O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.285,"smiles":null,"spectrum_id":"CCMSLIB00017212834","spectrum_index":2620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jasmonic acid (delta mass: 57.0217 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.155,"smiles":null,"spectrum_id":"CCMSLIB00017212837","spectrum_index":2621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Iodo-1H-pyrazolo[3,4-c]pyridine (delta mass: 126.9059 Da; putative annotation: N/A; putative formula: HNO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.858,"smiles":null,"spectrum_id":"CCMSLIB00017212838","spectrum_index":2622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 299.2835 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.531,"smiles":null,"spectrum_id":"CCMSLIB00017212839","spectrum_index":2623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 186.1185 Da; putative annotation: N/A; putative formula: C9H18N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.218,"smiles":null,"spectrum_id":"CCMSLIB00017212841","spectrum_index":2624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 26.9997 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.055,"smiles":null,"spectrum_id":"CCMSLIB00017212842","spectrum_index":2625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 76.0686 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.29,"smiles":null,"spectrum_id":"CCMSLIB00017212843","spectrum_index":2626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 651.5467 Da; putative annotation: N/A; putative formula: C40H69N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":928.763,"smiles":null,"spectrum_id":"CCMSLIB00017212845","spectrum_index":2627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 435.3611 Da; putative annotation: N/A; putative formula: C29H45N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.421,"smiles":null,"spectrum_id":"CCMSLIB00017212846","spectrum_index":2628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 256.1894 Da; putative annotation: N/A; putative formula: C12H24N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.313,"smiles":null,"spectrum_id":"CCMSLIB00017212847","spectrum_index":2629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 42.0456 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017212849","spectrum_index":2630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 27.9953 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.379,"smiles":null,"spectrum_id":"CCMSLIB00017212851","spectrum_index":2631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 72.1081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.319,"smiles":null,"spectrum_id":"CCMSLIB00017212852","spectrum_index":2632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvaol (delta mass: 158.1443 Da; putative annotation: N/A; putative formula: C13H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.533,"smiles":null,"spectrum_id":"CCMSLIB00017212854","spectrum_index":2633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 17.0048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.07,"smiles":null,"spectrum_id":"CCMSLIB00017212855","spectrum_index":2634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.alpha.-estrane-3.alpha.,17.beta.-diol (delta mass: 142.1179 Da; putative annotation: N/A; putative formula: C9H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.381,"smiles":null,"spectrum_id":"CCMSLIB00017212856","spectrum_index":2635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 218.0399 Da; putative annotation: N/A; putative formula: C14H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.131,"smiles":null,"spectrum_id":"CCMSLIB00017212857","spectrum_index":2636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP007402 Glycohyocholic acid|AM022340|2-[4-(3,6,7-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid (delta mass: 429.2861 Da; putative annotation: N/A; putative formula: C30H39NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.602,"smiles":null,"spectrum_id":"CCMSLIB00017212860","spectrum_index":2637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 18.0169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017212862","spectrum_index":2638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-TRIHYDROXYBENZOIC ACID\"\" (delta mass: 24.0841 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.113,"smiles":null,"spectrum_id":"CCMSLIB00017212863","spectrum_index":2639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperazinyl)nicotinonitrile (delta mass: 149.0392 Da; putative annotation: N/A; putative formula: C8H8NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.153,"smiles":null,"spectrum_id":"CCMSLIB00017212864","spectrum_index":2640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 100.0928 Da; putative annotation: N/A; putative formula: C6H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.232,"smiles":null,"spectrum_id":"CCMSLIB00017212865","spectrum_index":2641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 101.1559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.196,"smiles":null,"spectrum_id":"CCMSLIB00017212866","spectrum_index":2642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP017002 Salicylic acid (delta mass: 58.0522 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.091,"smiles":null,"spectrum_id":"CCMSLIB00017212868","spectrum_index":2643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 17.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017212871","spectrum_index":2644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylhistamine CollisionEnergy:102040 (delta mass: 27.9838 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.086,"smiles":null,"spectrum_id":"CCMSLIB00017212872","spectrum_index":2645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 115.0233 Da; putative annotation: N/A; putative formula: HN7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.125,"smiles":null,"spectrum_id":"CCMSLIB00017212873","spectrum_index":2646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 52.0675 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017212874","spectrum_index":2647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 216.1413 Da; putative annotation: N/A; putative formula: C9H20N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.197,"smiles":null,"spectrum_id":"CCMSLIB00017212875","spectrum_index":2648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 74.0369 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.129,"smiles":null,"spectrum_id":"CCMSLIB00017212877","spectrum_index":2649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 289.062 Da; putative annotation: N/A; putative formula: C11H15NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.195,"smiles":null,"spectrum_id":"CCMSLIB00017212879","spectrum_index":2650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11,14-Eicosadienoic acid (delta mass: 106.0787 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.358,"smiles":null,"spectrum_id":"CCMSLIB00017212881","spectrum_index":2651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Hydroxy-6-ketocholesterol (delta mass: 164.0992 Da; putative annotation: N/A; putative formula: C14H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.451,"smiles":null,"spectrum_id":"CCMSLIB00017212882","spectrum_index":2652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 97.0535 Da; putative annotation: PROLINE; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.193,"smiles":null,"spectrum_id":"CCMSLIB00017212883","spectrum_index":2653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-L-.gamma.-Glutamyl-L-leucine (delta mass: 113.0841 Da; putative annotation: Massbank:CE000612 Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017212884","spectrum_index":2654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 120.0576 Da; putative annotation: 4-Methoxybenzenemethanol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017212885","spectrum_index":2655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 132.0579 Da; putative annotation: 2,3-Dimethylbenzoic acid; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.106,"smiles":null,"spectrum_id":"CCMSLIB00017212886","spectrum_index":2656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 280.2404 Da; putative annotation: 8-(3-Octyl-2-oxiranyl)octanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.451,"smiles":null,"spectrum_id":"CCMSLIB00017212890","spectrum_index":2657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 340.303 Da; putative annotation: Spectral Match to Glycerol 1-stearate from NIST14; putative formula: C21H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.519,"smiles":null,"spectrum_id":"CCMSLIB00017212891","spectrum_index":2658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 314.2242 Da; putative annotation: .DELTA.2-Androstene-1.alpha.,17.beta.-diol acetate; putative formula: C21H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.348,"smiles":null,"spectrum_id":"CCMSLIB00017212892","spectrum_index":2659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 204.1879 Da; putative annotation: .alpha.-Bisabolol; putative formula: C15H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.393,"smiles":null,"spectrum_id":"CCMSLIB00017212893","spectrum_index":2660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulin (delta mass: 202.1704 Da; putative annotation: (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol; putative formula: C15H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.559,"smiles":null,"spectrum_id":"CCMSLIB00017212894","spectrum_index":2661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 600.5121 Da; putative annotation: 1-Linoleoyl-2-oleoyl-rac-glycerol; putative formula: C39H68O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.775,"smiles":null,"spectrum_id":"CCMSLIB00017212895","spectrum_index":2662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 159.067 Da; putative annotation: N-Cyclopropyl-2-hydroxybenzamide; putative formula: C10H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017212896","spectrum_index":2663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 208.1828 Da; putative annotation: Myristoleic acid; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.425,"smiles":null,"spectrum_id":"CCMSLIB00017212897","spectrum_index":2664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 331.2728 Da; putative annotation: Arachidonoyl-2'-fluoroethylamide; putative formula: C22H34FN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.489,"smiles":null,"spectrum_id":"CCMSLIB00017212900","spectrum_index":2665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hecogenin (delta mass: 148.0885 Da; putative annotation: (S)-Perillic acid; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.404,"smiles":null,"spectrum_id":"CCMSLIB00017212902","spectrum_index":2666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 270.2184 Da; putative annotation: NCGC00381202-01!3,15-dihydroxyhexadecanoic acid; putative formula: C16H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.477,"smiles":null,"spectrum_id":"CCMSLIB00017212903","spectrum_index":2667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MELIBIOSE (delta mass: 162.0497 Da; putative annotation: D-(+)-Mannose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.173,"smiles":null,"spectrum_id":"CCMSLIB00017212904","spectrum_index":2668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Arachidonoylglycerol (delta mass: 303.2561 Da; putative annotation: Massbank:RP003403 alpha-Linolenoyl Ethanolamide|(9Z,12Z,15Z)-N-(2-hydroxyethyl)octadeca-9,12,15-trienamide; putative formula: C20H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.54,"smiles":null,"spectrum_id":"CCMSLIB00017212905","spectrum_index":2669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 296.2349 Da; putative annotation: 12,13-Dihydroxy-9Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.467,"smiles":null,"spectrum_id":"CCMSLIB00017212906","spectrum_index":2670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-linoleoyl-rac-glycerol (delta mass: 283.2879 Da; putative annotation: D-erythro-Sphinganine; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.818,"smiles":null,"spectrum_id":"CCMSLIB00017212907","spectrum_index":2671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 388.3002 Da; putative annotation: Methyl Deoxycholate; putative formula: C25H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.548,"smiles":null,"spectrum_id":"CCMSLIB00017212909","spectrum_index":2672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130033 (delta mass: 434.2009 Da; putative annotation: [5-ethenyl-3-hydroxy-4-(3-hydroxyprop-1-en-2-yl)-2-(3-methoxy-3-oxoprop-1-en-2-yl)-5-methylcyclohexyl] 4-acetyloxy-3-hydroxy-2-methylidenebutanoate; putative formula: C23H30O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":852.387,"smiles":null,"spectrum_id":"CCMSLIB00017212912","spectrum_index":2673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 272.1758 Da; putative annotation: h_92_oxabolone; putative formula: C18H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.444,"smiles":null,"spectrum_id":"CCMSLIB00017212913","spectrum_index":2674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxocholesterol (delta mass: 184.11 Da; putative annotation: Sebacic acid; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.451,"smiles":null,"spectrum_id":"CCMSLIB00017212914","spectrum_index":2675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 85.089 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.165,"smiles":null,"spectrum_id":"CCMSLIB00017212915","spectrum_index":2676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 122.0941 Da; putative annotation: N/A; putative formula: C6H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.29,"smiles":null,"spectrum_id":"CCMSLIB00017212916","spectrum_index":2677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 229.1274 Da; putative annotation: N/A; putative formula: C7H15N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.162,"smiles":null,"spectrum_id":"CCMSLIB00017212919","spectrum_index":2678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 25.9792 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.081,"smiles":null,"spectrum_id":"CCMSLIB00017212920","spectrum_index":2679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-(2-oxo-2-phenylethyl)-1,3-dihydro-2H-indol-2-one (delta mass: 164.0826 Da; putative annotation: N/A; putative formula: C4H13N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.179,"smiles":null,"spectrum_id":"CCMSLIB00017212921","spectrum_index":2680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arthrobactin (delta mass: 232.1198 Da; putative annotation: N/A; putative formula: C9H12N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.375,"smiles":null,"spectrum_id":"CCMSLIB00017212922","spectrum_index":2681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 251.1131 Da; putative annotation: N/A; putative formula: C9H13N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.329,"smiles":null,"spectrum_id":"CCMSLIB00017212923","spectrum_index":2682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 177.0631 Da; putative annotation: N/A; putative formula: C6H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.316,"smiles":null,"spectrum_id":"CCMSLIB00017212924","spectrum_index":2683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 54.0473 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.19,"smiles":null,"spectrum_id":"CCMSLIB00017212926","spectrum_index":2684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.029,"smiles":null,"spectrum_id":"CCMSLIB00017212927","spectrum_index":2685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 97.0663 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017212930","spectrum_index":2686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 298.1191 Da; putative annotation: N/A; putative formula: C12H19N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.351,"smiles":null,"spectrum_id":"CCMSLIB00017212931","spectrum_index":2687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 234.1846 Da; putative annotation: N/A; putative formula: C13H22N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.255,"smiles":null,"spectrum_id":"CCMSLIB00017212932","spectrum_index":2688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 23.016 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.149,"smiles":null,"spectrum_id":"CCMSLIB00017212933","spectrum_index":2689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ent-15-Hydroxy-8(17)-labden-2-one (delta mass: 299.1228 Da; putative annotation: N/A; putative formula: C21H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.386,"smiles":null,"spectrum_id":"CCMSLIB00017212934","spectrum_index":2690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-DEOXYGUANOSINE - 20.0 eV (delta mass: 720.2413 Da; putative annotation: N/A; putative formula: C51H32N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":988.345,"smiles":null,"spectrum_id":"CCMSLIB00017212936","spectrum_index":2691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:205060 (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.07,"smiles":null,"spectrum_id":"CCMSLIB00017212937","spectrum_index":2692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 246.2324 Da; putative annotation: N/A; putative formula: C18H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.501,"smiles":null,"spectrum_id":"CCMSLIB00017212938","spectrum_index":2693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,3-Dimethylglutaric acid (delta mass: 78.0218 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.103,"smiles":null,"spectrum_id":"CCMSLIB00017212941","spectrum_index":2694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 312.2303 Da; putative annotation: N/A; putative formula: C18H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.446,"smiles":null,"spectrum_id":"CCMSLIB00017212942","spectrum_index":2695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,3S)-3-hydroxy-1-octen-1-yl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5Z)- (delta mass: 435.2622 Da; putative annotation: N/A; putative formula: C24H37NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.515,"smiles":null,"spectrum_id":"CCMSLIB00017212943","spectrum_index":2696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,19-Dihydroxy-3-oxo-12-ursen-28-oic acid (delta mass: 90.0842 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.426,"smiles":null,"spectrum_id":"CCMSLIB00017212944","spectrum_index":2697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 105.0424 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.103,"smiles":null,"spectrum_id":"CCMSLIB00017212946","spectrum_index":2698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid (delta mass: 103.0093 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.242,"smiles":null,"spectrum_id":"CCMSLIB00017212947","spectrum_index":2699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 73.0311 Da; putative annotation: N/A; putative formula: C6H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.133,"smiles":null,"spectrum_id":"CCMSLIB00017212948","spectrum_index":2700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380727-01_C23H32O6_(4R,4aS,8aS)-1-Hydroxy-2-(hydroxymethyl)-5,5,8a-trimethyl-4-[(2E,4E,6E)-2,4,6-octatrienoyloxy]-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenecarboxylic acid (delta mass: 425.2185 Da; putative annotation: N/A; putative formula: C22H23N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.446,"smiles":null,"spectrum_id":"CCMSLIB00017212951","spectrum_index":2701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC 18:3 (delta mass: 18.0126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.337,"smiles":null,"spectrum_id":"CCMSLIB00017212952","spectrum_index":2702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,5R,9S,13R)-14-formyl-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadec-14-ene-5-carboxylic acid (delta mass: 160.0588 Da; putative annotation: N/A; putative formula: C6H13N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.27,"smiles":null,"spectrum_id":"CCMSLIB00017212953","spectrum_index":2703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-hydroxy-1-methoxy-3-methylbutyl)-6-methyl-5H-[1,3]dioxolo[4,5-c]pyridin-4-one (delta mass: 269.1282 Da; putative annotation: N/A; putative formula: C6H21N7OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.262,"smiles":null,"spectrum_id":"CCMSLIB00017212955","spectrum_index":2704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 115.0627 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.305,"smiles":null,"spectrum_id":"CCMSLIB00017212956","spectrum_index":2705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 178.0988 Da; putative annotation: N/A; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.237,"smiles":null,"spectrum_id":"CCMSLIB00017212957","spectrum_index":2706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-8-Methyl-6-nonenoic acid (delta mass: 96.0575 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017212959","spectrum_index":2707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA001379 Coniine (delta mass: 228.1361 Da; putative annotation: N/A; putative formula: C12H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.28,"smiles":null,"spectrum_id":"CCMSLIB00017212961","spectrum_index":2708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(4-Fluorophenyl)-1H-indole (delta mass: 193.0612 Da; putative annotation: N/A; putative formula: C5H12N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.148,"smiles":null,"spectrum_id":"CCMSLIB00017212963","spectrum_index":2709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Carboxyibuprofen from NIST14 (delta mass: 61.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.165,"smiles":null,"spectrum_id":"CCMSLIB00017212964","spectrum_index":2710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 98.0852 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.182,"smiles":null,"spectrum_id":"CCMSLIB00017212965","spectrum_index":2711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 92.0375 Da; putative annotation: N/A; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.098,"smiles":null,"spectrum_id":"CCMSLIB00017212966","spectrum_index":2712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 224.163 Da; putative annotation: N/A; putative formula: C11H20N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.254,"smiles":null,"spectrum_id":"CCMSLIB00017212968","spectrum_index":2713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 79.0427 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017212971","spectrum_index":2714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Perillyl alcohol (delta mass: 115.027 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.154,"smiles":null,"spectrum_id":"CCMSLIB00017212972","spectrum_index":2715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 77.0848 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.327,"smiles":null,"spectrum_id":"CCMSLIB00017212973","spectrum_index":2716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 60.0372 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.28,"smiles":null,"spectrum_id":"CCMSLIB00017212974","spectrum_index":2717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 41.0268 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017212976","spectrum_index":2718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 98.0727 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.284,"smiles":null,"spectrum_id":"CCMSLIB00017212978","spectrum_index":2719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 101.9694 Da; putative annotation: N/A; putative formula: C3H3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017212979","spectrum_index":2720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 146.0568 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.19,"smiles":null,"spectrum_id":"CCMSLIB00017212980","spectrum_index":2721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Acetyloxy)lanosta-8,24-dien-21-oic acid (delta mass: 130.079 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.457,"smiles":null,"spectrum_id":"CCMSLIB00017212981","spectrum_index":2722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 121.0889 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.222,"smiles":null,"spectrum_id":"CCMSLIB00017212982","spectrum_index":2723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzoyl-N'-tert-butylthiourea (delta mass: 76.0371 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.143,"smiles":null,"spectrum_id":"CCMSLIB00017212983","spectrum_index":2724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)acetamide (delta mass: 88.0159 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.134,"smiles":null,"spectrum_id":"CCMSLIB00017212986","spectrum_index":2725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-mannosamine - 40.0 eV (delta mass: 817.5138 Da; putative annotation: N/A; putative formula: C42H71N7O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1039.61,"smiles":null,"spectrum_id":"CCMSLIB00017212988","spectrum_index":2726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 187.1209 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.379,"smiles":null,"spectrum_id":"CCMSLIB00017212989","spectrum_index":2727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 331.1735 Da; putative annotation: N/A; putative formula: C16H30NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.239,"smiles":null,"spectrum_id":"CCMSLIB00017212990","spectrum_index":2728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 118.0769 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.314,"smiles":null,"spectrum_id":"CCMSLIB00017212991","spectrum_index":2729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 72.0212 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.284,"smiles":null,"spectrum_id":"CCMSLIB00017212992","spectrum_index":2730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 283.0696 Da; putative annotation: N/A; putative formula: C15H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.13,"smiles":null,"spectrum_id":"CCMSLIB00017212994","spectrum_index":2731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 172.1541 Da; putative annotation: N/A; putative formula: C9H20N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.256,"smiles":null,"spectrum_id":"CCMSLIB00017212996","spectrum_index":2732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 56.0638 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.177,"smiles":null,"spectrum_id":"CCMSLIB00017212998","spectrum_index":2733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 50.0502 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.157,"smiles":null,"spectrum_id":"CCMSLIB00017212999","spectrum_index":2734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 177.4188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.5,"smiles":null,"spectrum_id":"CCMSLIB00017213000","spectrum_index":2735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 142.0999 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.248,"smiles":null,"spectrum_id":"CCMSLIB00017213001","spectrum_index":2736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 24.036 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.284,"smiles":null,"spectrum_id":"CCMSLIB00017213003","spectrum_index":2737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 98.9485 Da; putative annotation: N/A; putative formula: C2H-2NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.013,"smiles":null,"spectrum_id":"CCMSLIB00017213004","spectrum_index":2738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 514.2545 Da; putative annotation: N/A; putative formula: C22H43O11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.366,"smiles":null,"spectrum_id":"CCMSLIB00017213007","spectrum_index":2739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 427.1473 Da; putative annotation: N/A; putative formula: C32H17N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.218,"smiles":null,"spectrum_id":"CCMSLIB00017213008","spectrum_index":2740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 74.0606 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.34,"smiles":null,"spectrum_id":"CCMSLIB00017213009","spectrum_index":2741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-{2-hydroxy-7-[5-(1,4,5-trihydroxynonadecyl)oxolan-2-yl]heptyl}-5-methyl-2,5-dihydrofuran-2-one (delta mass: 45.0586 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.531,"smiles":null,"spectrum_id":"CCMSLIB00017213010","spectrum_index":2742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 98.0515 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.299,"smiles":null,"spectrum_id":"CCMSLIB00017213012","spectrum_index":2743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 113.0829 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.206,"smiles":null,"spectrum_id":"CCMSLIB00017213013","spectrum_index":2744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 72.0212 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.076,"smiles":null,"spectrum_id":"CCMSLIB00017213015","spectrum_index":2745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 54.0181 Da; putative annotation: N/A; putative formula: C2H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.276,"smiles":null,"spectrum_id":"CCMSLIB00017213017","spectrum_index":2746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 78.0903 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.19,"smiles":null,"spectrum_id":"CCMSLIB00017213018","spectrum_index":2747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 141.0415 Da; putative annotation: N/A; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.133,"smiles":null,"spectrum_id":"CCMSLIB00017213020","spectrum_index":2748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYBENZOIC ACID (delta mass: 66.061 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017213021","spectrum_index":2749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androstan-3.beta.-ol (delta mass: 297.1448 Da; putative annotation: N/A; putative formula: C13H15N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.397,"smiles":null,"spectrum_id":"CCMSLIB00017213022","spectrum_index":2750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Pro-Lys (delta mass: 85.0898 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.282,"smiles":null,"spectrum_id":"CCMSLIB00017213023","spectrum_index":2751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000497 3-Acetylindole|1-(1H-indol-3-yl)ethanone (delta mass: 94.0629 Da; putative annotation: N/A; putative formula: C4H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017213025","spectrum_index":2752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 404.1443 Da; putative annotation: N/A; putative formula: C17H20N6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":777.309,"smiles":null,"spectrum_id":"CCMSLIB00017213027","spectrum_index":2753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 36.0337 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.334,"smiles":null,"spectrum_id":"CCMSLIB00017213029","spectrum_index":2754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 337.1119 Da; putative annotation: N/A; putative formula: C9H7N17O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.24,"smiles":null,"spectrum_id":"CCMSLIB00017213030","spectrum_index":2755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Sitosterol (delta mass: 161.1427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.536,"smiles":null,"spectrum_id":"CCMSLIB00017213031","spectrum_index":2756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 60.0116 Da; putative annotation: N/A; putative formula: C4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.127,"smiles":null,"spectrum_id":"CCMSLIB00017213032","spectrum_index":2757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin D (delta mass: 45.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017213034","spectrum_index":2758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-Gln (delta mass: 210.0992 Da; putative annotation: N/A; putative formula: C12H19O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.213,"smiles":null,"spectrum_id":"CCMSLIB00017213036","spectrum_index":2759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 42.0211 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.071,"smiles":null,"spectrum_id":"CCMSLIB00017213038","spectrum_index":2760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 341.1321 Da; putative annotation: N/A; putative formula: C12H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.256,"smiles":null,"spectrum_id":"CCMSLIB00017213039","spectrum_index":2761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 117.0777 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.19,"smiles":null,"spectrum_id":"CCMSLIB00017213040","spectrum_index":2762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 73.0891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.149,"smiles":null,"spectrum_id":"CCMSLIB00017213041","spectrum_index":2763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 63.0212 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.207,"smiles":null,"spectrum_id":"CCMSLIB00017213042","spectrum_index":2764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 179.0789 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.233,"smiles":null,"spectrum_id":"CCMSLIB00017213044","spectrum_index":2765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 25.9806 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.029,"smiles":null,"spectrum_id":"CCMSLIB00017213046","spectrum_index":2766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(R)-Hydroxyprostaglandin E2 (delta mass: 94.0047 Da; putative annotation: N/A; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.232,"smiles":null,"spectrum_id":"CCMSLIB00017213048","spectrum_index":2767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde (delta mass: 52.0324 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.077,"smiles":null,"spectrum_id":"CCMSLIB00017213049","spectrum_index":2768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 12.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017213050","spectrum_index":2769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 33.0294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.079,"smiles":null,"spectrum_id":"CCMSLIB00017213051","spectrum_index":2770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 223.1267 Da; putative annotation: N/A; putative formula: C10H17N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.207,"smiles":null,"spectrum_id":"CCMSLIB00017213053","spectrum_index":2771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026502 5?-CHOLANIC ACID-3?_ 12?-DIOL-7-ONE|7-Ketodeoxycholic acid|(4R)-4-[(3R,5S,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]ph (delta mass: 407.7796 Da; putative annotation: N/A; putative formula: C11H4O-1S9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":815.059,"smiles":null,"spectrum_id":"CCMSLIB00017213054","spectrum_index":2772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 75.0319 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017213057","spectrum_index":2773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 170.1092 Da; putative annotation: N/A; putative formula: C13H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.336,"smiles":null,"spectrum_id":"CCMSLIB00017213058","spectrum_index":2774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 298.251 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.498,"smiles":null,"spectrum_id":"CCMSLIB00017213059","spectrum_index":2775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 256.2392 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.276,"smiles":null,"spectrum_id":"CCMSLIB00017213060","spectrum_index":2776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 370.159 Da; putative annotation: N/A; putative formula: C13H26N2O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.25,"smiles":null,"spectrum_id":"CCMSLIB00017213061","spectrum_index":2777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385466-01_C27H32O14_(1S,4aS,6S,7aS)-6-Hydroxy-1-({6-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoyl]-beta-D-glucopyranosyl}oxy)-7-methylene-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid (delta mass: 156.0167 Da; putative annotation: N/A; putative formula: C5H4N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.203,"smiles":null,"spectrum_id":"CCMSLIB00017213062","spectrum_index":2778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PIMELIC ACID (delta mass: 98.0368 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.118,"smiles":null,"spectrum_id":"CCMSLIB00017213064","spectrum_index":2779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Retinol (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.247,"smiles":null,"spectrum_id":"CCMSLIB00017213066","spectrum_index":2780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 286.226 Da; putative annotation: N/A; putative formula: C15H30N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.339,"smiles":null,"spectrum_id":"CCMSLIB00017213067","spectrum_index":2781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxydecanoic acid (delta mass: 322.2521 Da; putative annotation: N/A; putative formula: C21H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.401,"smiles":null,"spectrum_id":"CCMSLIB00017213069","spectrum_index":2782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 27.9943 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.037,"smiles":null,"spectrum_id":"CCMSLIB00017213070","spectrum_index":2783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Keto-1-methyl-3H-imidazo[4,5-b]pyridin-6-yl)benzamide (delta mass: 160.0762 Da; putative annotation: N/A; putative formula: C6H13N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.18,"smiles":null,"spectrum_id":"CCMSLIB00017213071","spectrum_index":2784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 130.1357 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.206,"smiles":null,"spectrum_id":"CCMSLIB00017213074","spectrum_index":2785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 106.9274 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.939,"smiles":null,"spectrum_id":"CCMSLIB00017213075","spectrum_index":2786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 50.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.222,"smiles":null,"spectrum_id":"CCMSLIB00017213077","spectrum_index":2787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 161.1188 Da; putative annotation: N/A; putative formula: C11H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.221,"smiles":null,"spectrum_id":"CCMSLIB00017213078","spectrum_index":2788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 138.0444 Da; putative annotation: N/A; putative formula: C5H7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.157,"smiles":null,"spectrum_id":"CCMSLIB00017213079","spectrum_index":2789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 70.0423 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.29,"smiles":null,"spectrum_id":"CCMSLIB00017213080","spectrum_index":2790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 181.261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.42,"smiles":null,"spectrum_id":"CCMSLIB00017213082","spectrum_index":2791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperazinyl)acetamide (delta mass: 45.0465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.16,"smiles":null,"spectrum_id":"CCMSLIB00017213085","spectrum_index":2792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 148.073 Da; putative annotation: N/A; putative formula: C6H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017213086","spectrum_index":2793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 63.0106 Da; putative annotation: N/A; putative formula: C4HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.253,"smiles":null,"spectrum_id":"CCMSLIB00017213087","spectrum_index":2794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 190.1006 Da; putative annotation: N/A; putative formula: C5H14N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.197,"smiles":null,"spectrum_id":"CCMSLIB00017213088","spectrum_index":2795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 93.083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.18,"smiles":null,"spectrum_id":"CCMSLIB00017213089","spectrum_index":2796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 86.0581 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.133,"smiles":null,"spectrum_id":"CCMSLIB00017213090","spectrum_index":2797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-hydroxybenzoate (delta mass: 79.0437 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.098,"smiles":null,"spectrum_id":"CCMSLIB00017213092","spectrum_index":2798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 180.0507 Da; putative annotation: N/A; putative formula: C4H4N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.085,"smiles":null,"spectrum_id":"CCMSLIB00017213095","spectrum_index":2799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 662.2215 Da; putative annotation: N/A; putative formula: C35H39N2O7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.303,"smiles":null,"spectrum_id":"CCMSLIB00017213096","spectrum_index":2800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosahexaenoylglycine (delta mass: 164.1046 Da; putative annotation: N/A; putative formula: C8H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.374,"smiles":null,"spectrum_id":"CCMSLIB00017213097","spectrum_index":2801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 305.2567 Da; putative annotation: N/A; putative formula: C17H31N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.499,"smiles":null,"spectrum_id":"CCMSLIB00017213098","spectrum_index":2802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Tyr (delta mass: 27.9954 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.109,"smiles":null,"spectrum_id":"CCMSLIB00017213099","spectrum_index":2803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mellein (delta mass: 70.0419 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017213101","spectrum_index":2804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 306.0952 Da; putative annotation: N/A; putative formula: C12H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1135.38,"smiles":null,"spectrum_id":"CCMSLIB00017213104","spectrum_index":2805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 28.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.103,"smiles":null,"spectrum_id":"CCMSLIB00017213105","spectrum_index":2806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 94.0836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.142,"smiles":null,"spectrum_id":"CCMSLIB00017213106","spectrum_index":2807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 234.1623 Da; putative annotation: N/A; putative formula: C15H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.285,"smiles":null,"spectrum_id":"CCMSLIB00017213107","spectrum_index":2808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 167.0572 Da; putative annotation: N/A; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.107,"smiles":null,"spectrum_id":"CCMSLIB00017213108","spectrum_index":2809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 5.0377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.082,"smiles":null,"spectrum_id":"CCMSLIB00017213110","spectrum_index":2810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fucosterol (delta mass: 533.479 Da; putative annotation: N/A; putative formula: C30H59N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.857,"smiles":null,"spectrum_id":"CCMSLIB00017213113","spectrum_index":2811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 76.0671 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.419,"smiles":null,"spectrum_id":"CCMSLIB00017213114","spectrum_index":2812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 27.9953 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.18,"smiles":null,"spectrum_id":"CCMSLIB00017213115","spectrum_index":2813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoolein (delta mass: 68.0625 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.362,"smiles":null,"spectrum_id":"CCMSLIB00017213116","spectrum_index":2814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 24.9954 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.077,"smiles":null,"spectrum_id":"CCMSLIB00017213117","spectrum_index":2815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 166.172 Da; putative annotation: N/A; putative formula: C12H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.216,"smiles":null,"spectrum_id":"CCMSLIB00017213118","spectrum_index":2816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 63.0704 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.146,"smiles":null,"spectrum_id":"CCMSLIB00017213119","spectrum_index":2817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 112.0624 Da; putative annotation: N/A; putative formula: C5H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.43,"smiles":null,"spectrum_id":"CCMSLIB00017213121","spectrum_index":2818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 154.0788 Da; putative annotation: N/A; putative formula: C12H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.155,"smiles":null,"spectrum_id":"CCMSLIB00017213124","spectrum_index":2819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monopalmitolein (9c) from NIST14 (delta mass: 226.0142 Da; putative annotation: N/A; putative formula: C11H-2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.283,"smiles":null,"spectrum_id":"CCMSLIB00017213125","spectrum_index":2820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 258.0739 Da; putative annotation: N/A; putative formula: C11H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.139,"smiles":null,"spectrum_id":"CCMSLIB00017213126","spectrum_index":2821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Indolinone (delta mass: 9.9845 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.044,"smiles":null,"spectrum_id":"CCMSLIB00017213127","spectrum_index":2822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 104.0609 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.152,"smiles":null,"spectrum_id":"CCMSLIB00017213128","spectrum_index":2823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Heptynoic acid (delta mass: 42.0115 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.087,"smiles":null,"spectrum_id":"CCMSLIB00017213129","spectrum_index":2824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 46.1141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.206,"smiles":null,"spectrum_id":"CCMSLIB00017213131","spectrum_index":2825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 95.0303 Da; putative annotation: N/A; putative formula: C5H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.121,"smiles":null,"spectrum_id":"CCMSLIB00017213134","spectrum_index":2826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzenemethanol (delta mass: 42.0577 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.133,"smiles":null,"spectrum_id":"CCMSLIB00017213135","spectrum_index":2827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 17.0272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.317,"smiles":null,"spectrum_id":"CCMSLIB00017213136","spectrum_index":2828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; CorrDec (delta mass: 28.03 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":114.09,"smiles":null,"spectrum_id":"CCMSLIB00017213137","spectrum_index":2829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 137.0696 Da; putative annotation: N/A; putative formula: C5H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.333,"smiles":null,"spectrum_id":"CCMSLIB00017213138","spectrum_index":2830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 163.0887 Da; putative annotation: N/A; putative formula: C5H14N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.155,"smiles":null,"spectrum_id":"CCMSLIB00017213140","spectrum_index":2831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 166.0625 Da; putative annotation: N/A; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.123,"smiles":null,"spectrum_id":"CCMSLIB00017213143","spectrum_index":2832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 58.04 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.168,"smiles":null,"spectrum_id":"CCMSLIB00017213144","spectrum_index":2833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017213145","spectrum_index":2834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 323.2674 Da; putative annotation: N/A; putative formula: C17H33N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.619,"smiles":null,"spectrum_id":"CCMSLIB00017213146","spectrum_index":2835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Panglimycin E (delta mass: 58.9831 Da; putative annotation: N/A; putative formula: CHNS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.101,"smiles":null,"spectrum_id":"CCMSLIB00017213147","spectrum_index":2836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 198.1621 Da; putative annotation: N/A; putative formula: C12H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.21,"smiles":null,"spectrum_id":"CCMSLIB00017213150","spectrum_index":2837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl morpholine-2-carboxylate (delta mass: 95.0721 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.169,"smiles":null,"spectrum_id":"CCMSLIB00017213152","spectrum_index":2838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 103.9795 Da; putative annotation: N/A; putative formula: N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.206,"smiles":null,"spectrum_id":"CCMSLIB00017213155","spectrum_index":2839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 69.0944 Da; putative annotation: N/A; putative formula: C5H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017213157","spectrum_index":2840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 12.9954 Da; putative annotation: N/A; putative formula: C22H32N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.045,"smiles":null,"spectrum_id":"CCMSLIB00017213158","spectrum_index":2841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 336.1413 Da; putative annotation: N/A; putative formula: C19H20N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.217,"smiles":null,"spectrum_id":"CCMSLIB00017213159","spectrum_index":2842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 94.1106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.186,"smiles":null,"spectrum_id":"CCMSLIB00017213160","spectrum_index":2843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 657.394 Da; putative annotation: N/A; putative formula: C36H51N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.47,"smiles":null,"spectrum_id":"CCMSLIB00017213161","spectrum_index":2844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 17.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.112,"smiles":null,"spectrum_id":"CCMSLIB00017213162","spectrum_index":2845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 16.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.128,"smiles":null,"spectrum_id":"CCMSLIB00017213164","spectrum_index":2846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-methoxybenzoic acid (delta mass: 8.0401 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.106,"smiles":null,"spectrum_id":"CCMSLIB00017213166","spectrum_index":2847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 123.126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.316,"smiles":null,"spectrum_id":"CCMSLIB00017213167","spectrum_index":2848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 86.0459 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.117,"smiles":null,"spectrum_id":"CCMSLIB00017213168","spectrum_index":2849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 25.0313 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.113,"smiles":null,"spectrum_id":"CCMSLIB00017213169","spectrum_index":2850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 28.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.16,"smiles":null,"spectrum_id":"CCMSLIB00017213170","spectrum_index":2851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid ethyl ester (delta mass: 82.042 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017213171","spectrum_index":2852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 477.3315 Da; putative annotation: N/A; putative formula: C25H43N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.402,"smiles":null,"spectrum_id":"CCMSLIB00017213174","spectrum_index":2853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6.alpha.,11.beta.)-11-hydroxy-6-methylpregn-4-ene-3,20-dione (delta mass: 66.0456 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.288,"smiles":null,"spectrum_id":"CCMSLIB00017213176","spectrum_index":2854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR302669 Pelargonidin-3-O-glucoside (delta mass: 366.1187 Da; putative annotation: N/A; putative formula: C10H25N8O-1P3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.232,"smiles":null,"spectrum_id":"CCMSLIB00017213177","spectrum_index":2855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Castanospermine (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017213178","spectrum_index":2856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 108.0933 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.325,"smiles":null,"spectrum_id":"CCMSLIB00017213179","spectrum_index":2857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 60.0217 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.134,"smiles":null,"spectrum_id":"CCMSLIB00017213180","spectrum_index":2858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 290.1597 Da; putative annotation: N/A; putative formula: C12H26N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.272,"smiles":null,"spectrum_id":"CCMSLIB00017213181","spectrum_index":2859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 197.0359 Da; putative annotation: N/A; putative formula: C5H11NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.132,"smiles":null,"spectrum_id":"CCMSLIB00017213183","spectrum_index":2860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 169.074 Da; putative annotation: N/A; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.124,"smiles":null,"spectrum_id":"CCMSLIB00017213186","spectrum_index":2861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 162.1005 Da; putative annotation: N/A; putative formula: C6H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.197,"smiles":null,"spectrum_id":"CCMSLIB00017213187","spectrum_index":2862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 136.0512 Da; putative annotation: N/A; putative formula: C2H9N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.216,"smiles":null,"spectrum_id":"CCMSLIB00017213188","spectrum_index":2863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017213189","spectrum_index":2864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Syringaresinol (delta mass: 197.1277 Da; putative annotation: N/A; putative formula: C8H15N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.298,"smiles":null,"spectrum_id":"CCMSLIB00017213190","spectrum_index":2865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 44.026 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017213192","spectrum_index":2866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Propylhexedrine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.185,"smiles":null,"spectrum_id":"CCMSLIB00017213194","spectrum_index":2867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyquinuclidine-3-carbonitrile (delta mass: 95.0641 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.166,"smiles":null,"spectrum_id":"CCMSLIB00017213195","spectrum_index":2868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 14.0151 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.226,"smiles":null,"spectrum_id":"CCMSLIB00017213196","spectrum_index":2869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.-Hydroxyetiocholanolone (delta mass: 33.0217 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.249,"smiles":null,"spectrum_id":"CCMSLIB00017213197","spectrum_index":2870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl hydrogen malonate (delta mass: 120.0733 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.123,"smiles":null,"spectrum_id":"CCMSLIB00017213198","spectrum_index":2871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 175.0479 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.108,"smiles":null,"spectrum_id":"CCMSLIB00017213200","spectrum_index":2872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 163.9476 Da; putative annotation: N/A; putative formula: CN4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.008,"smiles":null,"spectrum_id":"CCMSLIB00017213202","spectrum_index":2873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 58.0412 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.101,"smiles":null,"spectrum_id":"CCMSLIB00017213204","spectrum_index":2874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 161.0742 Da; putative annotation: N/A; putative formula: C10H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.303,"smiles":null,"spectrum_id":"CCMSLIB00017213205","spectrum_index":2875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-6-Octadecenoic acid (delta mass: 293.2717 Da; putative annotation: N/A; putative formula: C19H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.535,"smiles":null,"spectrum_id":"CCMSLIB00017213206","spectrum_index":2876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 35.0453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.147,"smiles":null,"spectrum_id":"CCMSLIB00017213207","spectrum_index":2877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 111.9923 Da; putative annotation: N/A; putative formula: C3N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.068,"smiles":null,"spectrum_id":"CCMSLIB00017213209","spectrum_index":2878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 94.0416 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.117,"smiles":null,"spectrum_id":"CCMSLIB00017213210","spectrum_index":2879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Dehydroshikimic acid (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.055,"smiles":null,"spectrum_id":"CCMSLIB00017213213","spectrum_index":2880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 60.0205 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.112,"smiles":null,"spectrum_id":"CCMSLIB00017213214","spectrum_index":2881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-methylglutaric acid (delta mass: 383.1792 Da; putative annotation: N/A; putative formula: C15H29NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.239,"smiles":null,"spectrum_id":"CCMSLIB00017213215","spectrum_index":2882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 193.0674 Da; putative annotation: N/A; putative formula: C9H11N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.129,"smiles":null,"spectrum_id":"CCMSLIB00017213217","spectrum_index":2883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 274.1529 Da; putative annotation: N/A; putative formula: C12H22N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.213,"smiles":null,"spectrum_id":"CCMSLIB00017213218","spectrum_index":2884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 291.243 Da; putative annotation: N/A; putative formula: C16H29N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.329,"smiles":null,"spectrum_id":"CCMSLIB00017213219","spectrum_index":2885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinic Acid (delta mass: 254.0429 Da; putative annotation: N/A; putative formula: C14H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.114,"smiles":null,"spectrum_id":"CCMSLIB00017213222","spectrum_index":2886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-OxoOTrE from NIST14 (delta mass: 52.0353 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.246,"smiles":null,"spectrum_id":"CCMSLIB00017213224","spectrum_index":2887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactarolide A (delta mass: 49.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.207,"smiles":null,"spectrum_id":"CCMSLIB00017213225","spectrum_index":2888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 660.4243 Da; putative annotation: N/A; putative formula: C41H61N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.495,"smiles":null,"spectrum_id":"CCMSLIB00017213226","spectrum_index":2889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 117.0393 Da; putative annotation: N/A; putative formula: H3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.166,"smiles":null,"spectrum_id":"CCMSLIB00017213227","spectrum_index":2890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 239.0642 Da; putative annotation: N/A; putative formula: C7H13NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.244,"smiles":null,"spectrum_id":"CCMSLIB00017213228","spectrum_index":2891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 91.0634 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.327,"smiles":null,"spectrum_id":"CCMSLIB00017213232","spectrum_index":2892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-L-.gamma.-Glutamyl-L-leucine (delta mass: 113.0838 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.228,"smiles":null,"spectrum_id":"CCMSLIB00017213233","spectrum_index":2893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 758.2481 Da; putative annotation: N/A; putative formula: C30H46O22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":921.308,"smiles":null,"spectrum_id":"CCMSLIB00017213234","spectrum_index":2894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 377.1532 Da; putative annotation: N/A; putative formula: C18H19N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.432,"smiles":null,"spectrum_id":"CCMSLIB00017213235","spectrum_index":2895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 494.1281 Da; putative annotation: N/A; putative formula: C25H28N4O-1P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.209,"smiles":null,"spectrum_id":"CCMSLIB00017213236","spectrum_index":2896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 605.447 Da; putative annotation: N/A; putative formula: C38H60N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.507,"smiles":null,"spectrum_id":"CCMSLIB00017213238","spectrum_index":2897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 79.9571 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.033,"smiles":null,"spectrum_id":"CCMSLIB00017213241","spectrum_index":2898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.165,"smiles":null,"spectrum_id":"CCMSLIB00017213242","spectrum_index":2899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholic Acid, Methyl Ester (delta mass: 74.0523 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.363,"smiles":null,"spectrum_id":"CCMSLIB00017213243","spectrum_index":2900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacillomycin_D2;_Raubitschek_substance_28810_dereplictor_pv_9.27648e-33 (delta mass: 17.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1048.57,"smiles":null,"spectrum_id":"CCMSLIB00017213244","spectrum_index":2901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 104.0627 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017213245","spectrum_index":2902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.alpha.-estrane-3.alpha.,17.beta.-diol (delta mass: 128.0256 Da; putative annotation: N/A; putative formula: C3H5N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.289,"smiles":null,"spectrum_id":"CCMSLIB00017213248","spectrum_index":2903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6.alpha.,11.beta.)-11-hydroxy-6-methylpregn-4-ene-3,20-dione (delta mass: 180.115 Da; putative annotation: N/A; putative formula: C11H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.357,"smiles":null,"spectrum_id":"CCMSLIB00017213250","spectrum_index":2904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monopalmitolein (9c) from NIST14 (delta mass: 96.9929 Da; putative annotation: N/A; putative formula: CN5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.262,"smiles":null,"spectrum_id":"CCMSLIB00017213251","spectrum_index":2905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 406.2929 Da; putative annotation: N/A; putative formula: C21H42O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.515,"smiles":null,"spectrum_id":"CCMSLIB00017213252","spectrum_index":2906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000510 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 19.0194 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.09,"smiles":null,"spectrum_id":"CCMSLIB00017213253","spectrum_index":2907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 85.0892 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.186,"smiles":null,"spectrum_id":"CCMSLIB00017213254","spectrum_index":2908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 36.0377 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.126,"smiles":null,"spectrum_id":"CCMSLIB00017213256","spectrum_index":2909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 64.0674 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.32,"smiles":null,"spectrum_id":"CCMSLIB00017213259","spectrum_index":2910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pumilacidin_C_14344_dereplictor_pv_2.93242e-26 (delta mass: 17.0228 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1095.76,"smiles":null,"spectrum_id":"CCMSLIB00017213260","spectrum_index":2911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 102.0793 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.155,"smiles":null,"spectrum_id":"CCMSLIB00017213261","spectrum_index":2912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 58.0421 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.232,"smiles":null,"spectrum_id":"CCMSLIB00017213262","spectrum_index":2913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 18.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.175,"smiles":null,"spectrum_id":"CCMSLIB00017213264","spectrum_index":2914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 461.1597 Da; putative annotation: N/A; putative formula: C26H27N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.262,"smiles":null,"spectrum_id":"CCMSLIB00017213266","spectrum_index":2915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 63.9984 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.09,"smiles":null,"spectrum_id":"CCMSLIB00017213267","spectrum_index":2916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1-Pyrrolidinylcarbonyl)piperidine (delta mass: 103.0281 Da; putative annotation: N/A; putative formula: C4HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.177,"smiles":null,"spectrum_id":"CCMSLIB00017213268","spectrum_index":2917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(5-Bromo-2-pyrimidinyl)-3-piperidinol (delta mass: 103.0267 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.05,"smiles":null,"spectrum_id":"CCMSLIB00017213269","spectrum_index":2918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 268.1311 Da; putative annotation: N/A; putative formula: C14H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.202,"smiles":null,"spectrum_id":"CCMSLIB00017213270","spectrum_index":2919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 83.0394 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.11,"smiles":null,"spectrum_id":"CCMSLIB00017213273","spectrum_index":2920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311155 Vanillic acid (not validated) (delta mass: 66.045 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.11,"smiles":null,"spectrum_id":"CCMSLIB00017213275","spectrum_index":2921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 163.0848 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.176,"smiles":null,"spectrum_id":"CCMSLIB00017213276","spectrum_index":2922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 211.0693 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.228,"smiles":null,"spectrum_id":"CCMSLIB00017213277","spectrum_index":2923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 84.0534 Da; putative annotation: N/A; putative formula: CH4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.181,"smiles":null,"spectrum_id":"CCMSLIB00017213278","spectrum_index":2924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 90.0664 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.314,"smiles":null,"spectrum_id":"CCMSLIB00017213280","spectrum_index":2925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.383,"smiles":null,"spectrum_id":"CCMSLIB00017213281","spectrum_index":2926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOATE (delta mass: 83.0401 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.09,"smiles":null,"spectrum_id":"CCMSLIB00017213283","spectrum_index":2927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 74.0593 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.13,"smiles":null,"spectrum_id":"CCMSLIB00017213284","spectrum_index":2928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 388.1481 Da; putative annotation: N/A; putative formula: C16H24N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":893.324,"smiles":null,"spectrum_id":"CCMSLIB00017213286","spectrum_index":2929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[3,2-f]quinazoline-1,3-diamine, N3-cyclopropyl-7-[[4-(1-methylethyl)phenyl]methyl]- (delta mass: 128.1173 Da; putative annotation: N/A; putative formula: C4H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.336,"smiles":null,"spectrum_id":"CCMSLIB00017213288","spectrum_index":2930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 162.0525 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.222,"smiles":null,"spectrum_id":"CCMSLIB00017213290","spectrum_index":2931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000104 5-hydroxyculmorin|(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol (delta mass: 23.016 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.211,"smiles":null,"spectrum_id":"CCMSLIB00017213291","spectrum_index":2932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dichloro-1H-indole-2-carboxylic acid (delta mass: 82.993 Da; putative annotation: N/A; putative formula: C3H2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.97,"smiles":null,"spectrum_id":"CCMSLIB00017213292","spectrum_index":2933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 38.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.378,"smiles":null,"spectrum_id":"CCMSLIB00017213293","spectrum_index":2934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 19.0181 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.25,"smiles":null,"spectrum_id":"CCMSLIB00017213294","spectrum_index":2935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 92.0604 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.256,"smiles":null,"spectrum_id":"CCMSLIB00017213296","spectrum_index":2936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 50.0523 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.279,"smiles":null,"spectrum_id":"CCMSLIB00017213298","spectrum_index":2937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phytomonic acid (delta mass: 66.0829 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.362,"smiles":null,"spectrum_id":"CCMSLIB00017213300","spectrum_index":2938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 160.0725 Da; putative annotation: N/A; putative formula: C7H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.148,"smiles":null,"spectrum_id":"CCMSLIB00017213301","spectrum_index":2939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linalool oxide (delta mass: 119.9796 Da; putative annotation: N/A; putative formula: C3H5OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.118,"smiles":null,"spectrum_id":"CCMSLIB00017213302","spectrum_index":2940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 112.0307 Da; putative annotation: N/A; putative formula: C3H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017213303","spectrum_index":2941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dobutamine (delta mass: 118.0475 Da; putative annotation: N/A; putative formula: C5H12O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.223,"smiles":null,"spectrum_id":"CCMSLIB00017213304","spectrum_index":2942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 45.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.076,"smiles":null,"spectrum_id":"CCMSLIB00017213306","spectrum_index":2943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 200.1571 Da; putative annotation: N/A; putative formula: C15H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.42,"smiles":null,"spectrum_id":"CCMSLIB00017213308","spectrum_index":2944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.alpha.-estrane-3.alpha.,17.beta.-diol (delta mass: 66.0478 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.311,"smiles":null,"spectrum_id":"CCMSLIB00017213309","spectrum_index":2945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 76.0663 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.34,"smiles":null,"spectrum_id":"CCMSLIB00017213310","spectrum_index":2946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 133.1332 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.36,"smiles":null,"spectrum_id":"CCMSLIB00017213311","spectrum_index":2947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 295.1282 Da; putative annotation: N/A; putative formula: C12H17N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.199,"smiles":null,"spectrum_id":"CCMSLIB00017213313","spectrum_index":2948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 102.5874 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.652,"smiles":null,"spectrum_id":"CCMSLIB00017213315","spectrum_index":2949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 180.0632 Da; putative annotation: N/A; putative formula: C7H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.144,"smiles":null,"spectrum_id":"CCMSLIB00017213317","spectrum_index":2950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10-2 (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.274,"smiles":null,"spectrum_id":"CCMSLIB00017213318","spectrum_index":2951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.315,"smiles":null,"spectrum_id":"CCMSLIB00017213319","spectrum_index":2952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycerol 1-myristate (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.315,"smiles":null,"spectrum_id":"CCMSLIB00017213320","spectrum_index":2953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 264.1527 Da; putative annotation: N/A; putative formula: C12H20N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.432,"smiles":null,"spectrum_id":"CCMSLIB00017213322","spectrum_index":2954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 217.1681 Da; putative annotation: N/A; putative formula: C11H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.416,"smiles":null,"spectrum_id":"CCMSLIB00017213324","spectrum_index":2955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(R)-Hydroxydocosahexaenoic acid (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017213326","spectrum_index":2956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 195.1619 Da; putative annotation: N/A; putative formula: C12H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.446,"smiles":null,"spectrum_id":"CCMSLIB00017213327","spectrum_index":2957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 132.0662 Da; putative annotation: N/A; putative formula: C3H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.152,"smiles":null,"spectrum_id":"CCMSLIB00017213328","spectrum_index":2958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 133.0379 Da; putative annotation: N/A; putative formula: C4H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.14,"smiles":null,"spectrum_id":"CCMSLIB00017213329","spectrum_index":2959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 48.0355 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.241,"smiles":null,"spectrum_id":"CCMSLIB00017213331","spectrum_index":2960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 14.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.279,"smiles":null,"spectrum_id":"CCMSLIB00017213332","spectrum_index":2961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10-Nonadecenoic acid (delta mass: 36.0366 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.315,"smiles":null,"spectrum_id":"CCMSLIB00017213333","spectrum_index":2962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 143.1388 Da; putative annotation: N/A; putative formula: C7H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.22,"smiles":null,"spectrum_id":"CCMSLIB00017213335","spectrum_index":2963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-indol-3-yl)butan-2-one (delta mass: 33.0453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.152,"smiles":null,"spectrum_id":"CCMSLIB00017213336","spectrum_index":2964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 27.9833 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.065,"smiles":null,"spectrum_id":"CCMSLIB00017213337","spectrum_index":2965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 189.1154 Da; putative annotation: N/A; putative formula: C12H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.18,"smiles":null,"spectrum_id":"CCMSLIB00017213338","spectrum_index":2966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 175.0958 Da; putative annotation: N/A; putative formula: C6H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.198,"smiles":null,"spectrum_id":"CCMSLIB00017213339","spectrum_index":2967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 188.1543 Da; putative annotation: N/A; putative formula: C8H21N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.214,"smiles":null,"spectrum_id":"CCMSLIB00017213341","spectrum_index":2968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 106.0033 Da; putative annotation: N/A; putative formula: C2H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.058,"smiles":null,"spectrum_id":"CCMSLIB00017213343","spectrum_index":2969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 189.0957 Da; putative annotation: N/A; putative formula: C7H17N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.214,"smiles":null,"spectrum_id":"CCMSLIB00017213345","spectrum_index":2970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxyquinoline-2-carboxylic acid CollisionEnergy:102040 (delta mass: 59.0737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017213346","spectrum_index":2971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MAG (delta mass: 340.18 Da; putative annotation: N/A; putative formula: C22H28OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.48,"smiles":null,"spectrum_id":"CCMSLIB00017213347","spectrum_index":2972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINOSALICYLIC ACID (delta mass: 44.0026 Da; putative annotation: N/A; putative formula: N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.053,"smiles":null,"spectrum_id":"CCMSLIB00017213348","spectrum_index":2973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 126.1045 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.243,"smiles":null,"spectrum_id":"CCMSLIB00017213349","spectrum_index":2974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 26.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017213351","spectrum_index":2975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 46.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.149,"smiles":null,"spectrum_id":"CCMSLIB00017213352","spectrum_index":2976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 72.0324 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.124,"smiles":null,"spectrum_id":"CCMSLIB00017213355","spectrum_index":2977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 327.183 Da; putative annotation: N/A; putative formula: C20H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.248,"smiles":null,"spectrum_id":"CCMSLIB00017213356","spectrum_index":2978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 28.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.195,"smiles":null,"spectrum_id":"CCMSLIB00017213357","spectrum_index":2979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dimyristoyl-sn-glycero-3-phosphoethanolamine (delta mass: 84.099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":720.559,"smiles":null,"spectrum_id":"CCMSLIB00017213358","spectrum_index":2980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 275.1371 Da; putative annotation: N/A; putative formula: C12H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.197,"smiles":null,"spectrum_id":"CCMSLIB00017213360","spectrum_index":2981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androstan-3.beta.-ol (delta mass: 29.9734 Da; putative annotation: N/A; putative formula: H-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.226,"smiles":null,"spectrum_id":"CCMSLIB00017213361","spectrum_index":2982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 151.1197 Da; putative annotation: N/A; putative formula: C7H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.404,"smiles":null,"spectrum_id":"CCMSLIB00017213364","spectrum_index":2983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,12.alpha.-Epidioxy-13(14)-abieten-18-oic acid (delta mass: 74.0508 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.272,"smiles":null,"spectrum_id":"CCMSLIB00017213365","spectrum_index":2984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 100.0171 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.077,"smiles":null,"spectrum_id":"CCMSLIB00017213366","spectrum_index":2985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 117.0401 Da; putative annotation: N/A; putative formula: H3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.116,"smiles":null,"spectrum_id":"CCMSLIB00017213367","spectrum_index":2986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381307-01!1-[2,4-dihydroxy-3-(2-hydroxyethyl)-6-methoxyphenyl]butan-1-one (delta mass: 28.0314 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.154,"smiles":null,"spectrum_id":"CCMSLIB00017213368","spectrum_index":2987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin C (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.19,"smiles":null,"spectrum_id":"CCMSLIB00017213370","spectrum_index":2988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 1215.9779 Da; putative annotation: N/A; putative formula: C80H129NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1559.1,"smiles":null,"spectrum_id":"CCMSLIB00017213371","spectrum_index":2989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 86.052 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017213374","spectrum_index":2990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,9-Dihydroxy-5Z,11Z,14Z-eicosatrienoic acid (delta mass: 34.017 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.27,"smiles":null,"spectrum_id":"CCMSLIB00017213375","spectrum_index":2991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 69.0187 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.11,"smiles":null,"spectrum_id":"CCMSLIB00017213376","spectrum_index":2992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 100.0743 Da; putative annotation: N/A; putative formula: C3H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.15,"smiles":null,"spectrum_id":"CCMSLIB00017213377","spectrum_index":2993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 231.0745 Da; putative annotation: N/A; putative formula: C9H13NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.166,"smiles":null,"spectrum_id":"CCMSLIB00017213379","spectrum_index":2994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 197.0908 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.38,"smiles":null,"spectrum_id":"CCMSLIB00017213380","spectrum_index":2995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 67.0423 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017213383","spectrum_index":2996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydrozingerone (delta mass: 78.0318 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.118,"smiles":null,"spectrum_id":"CCMSLIB00017213384","spectrum_index":2997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoylecgonine (delta mass: 58.0528 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.191,"smiles":null,"spectrum_id":"CCMSLIB00017213385","spectrum_index":2998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C5:0 (delta mass: 132.0423 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.187,"smiles":null,"spectrum_id":"CCMSLIB00017213386","spectrum_index":2999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 60.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.211,"smiles":null,"spectrum_id":"CCMSLIB00017213388","spectrum_index":3000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 112.9881 Da; putative annotation: N/A; putative formula: CN5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.079,"smiles":null,"spectrum_id":"CCMSLIB00017213389","spectrum_index":3001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 282.15 Da; putative annotation: N/A; putative formula: C14H23N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.189,"smiles":null,"spectrum_id":"CCMSLIB00017213390","spectrum_index":3002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP012803 Benzoic acid (delta mass: 35.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017213392","spectrum_index":3003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Penten-1-ol, 5-phenyl-, (4E)- (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.107,"smiles":null,"spectrum_id":"CCMSLIB00017213394","spectrum_index":3004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 179.0802 Da; putative annotation: N/A; putative formula: C7H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.276,"smiles":null,"spectrum_id":"CCMSLIB00017213395","spectrum_index":3005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Phe (delta mass: 23.0162 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.145,"smiles":null,"spectrum_id":"CCMSLIB00017213396","spectrum_index":3006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 17.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.263,"smiles":null,"spectrum_id":"CCMSLIB00017213398","spectrum_index":3007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 137.0682 Da; putative annotation: N/A; putative formula: C8H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.128,"smiles":null,"spectrum_id":"CCMSLIB00017213399","spectrum_index":3008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 78.047 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.19,"smiles":null,"spectrum_id":"CCMSLIB00017213401","spectrum_index":3009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 31.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017213402","spectrum_index":3010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.341,"smiles":null,"spectrum_id":"CCMSLIB00017213403","spectrum_index":3011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.269,"smiles":null,"spectrum_id":"CCMSLIB00017213404","spectrum_index":3012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 239.1065 Da; putative annotation: N/A; putative formula: C7H13N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.178,"smiles":null,"spectrum_id":"CCMSLIB00017213405","spectrum_index":3013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 268.2409 Da; putative annotation: N/A; putative formula: C17H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.468,"smiles":null,"spectrum_id":"CCMSLIB00017213407","spectrum_index":3014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4'-Ethenyl-2'-hydroxy-1,4',4a-trimethyl-5-oxospiro[2,3,4,7,8,8a-hexahydronaphthalene-6,1'-cyclopentane]-1-carboxylic acid (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.274,"smiles":null,"spectrum_id":"CCMSLIB00017213408","spectrum_index":3015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 673.4687 Da; putative annotation: N/A; putative formula: C32H59N13OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":952.701,"smiles":null,"spectrum_id":"CCMSLIB00017213409","spectrum_index":3016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvaol (delta mass: 106.0805 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.469,"smiles":null,"spectrum_id":"CCMSLIB00017213411","spectrum_index":3017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Val (delta mass: 147.068 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.202,"smiles":null,"spectrum_id":"CCMSLIB00017213413","spectrum_index":3018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 103.0628 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.222,"smiles":null,"spectrum_id":"CCMSLIB00017213414","spectrum_index":3019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl .beta.-carboline-3-carboxylate (delta mass: 41.0336 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.131,"smiles":null,"spectrum_id":"CCMSLIB00017213416","spectrum_index":3020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 125.1049 Da; putative annotation: N/A; putative formula: C5H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.337,"smiles":null,"spectrum_id":"CCMSLIB00017213417","spectrum_index":3021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Salicylic acid (delta mass: 355.193 Da; putative annotation: N/A; putative formula: C25H25NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.232,"smiles":null,"spectrum_id":"CCMSLIB00017213418","spectrum_index":3022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 33.0352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.094,"smiles":null,"spectrum_id":"CCMSLIB00017213419","spectrum_index":3023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 847.3713 Da; putative annotation: N/A; putative formula: C45H57N3O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.443,"smiles":null,"spectrum_id":"CCMSLIB00017213421","spectrum_index":3024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 334.1732 Da; putative annotation: N/A; putative formula: C16H31O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.249,"smiles":null,"spectrum_id":"CCMSLIB00017213423","spectrum_index":3025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-2-methylpropiophenone (delta mass: 9.0206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.112,"smiles":null,"spectrum_id":"CCMSLIB00017213425","spectrum_index":3026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 223.1407 Da; putative annotation: N/A; putative formula: C6H13N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.362,"smiles":null,"spectrum_id":"CCMSLIB00017213426","spectrum_index":3027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 43.1137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017213427","spectrum_index":3028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 94.0782 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.357,"smiles":null,"spectrum_id":"CCMSLIB00017213428","spectrum_index":3029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-Pantetheine (delta mass: 114.032 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.169,"smiles":null,"spectrum_id":"CCMSLIB00017213429","spectrum_index":3030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 724.2374 Da; putative annotation: N/A; putative formula: C51H28N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.319,"smiles":null,"spectrum_id":"CCMSLIB00017213431","spectrum_index":3031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 80.0371 Da; putative annotation: N/A; putative formula: C4H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.124,"smiles":null,"spectrum_id":"CCMSLIB00017213434","spectrum_index":3032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,18.Xi.)-3-Oxolup-20(29)-ene-27,28-dioic acid (delta mass: 120.094 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.42,"smiles":null,"spectrum_id":"CCMSLIB00017213435","spectrum_index":3033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 31.0396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.12,"smiles":null,"spectrum_id":"CCMSLIB00017213436","spectrum_index":3034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 132.0423 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.103,"smiles":null,"spectrum_id":"CCMSLIB00017213437","spectrum_index":3035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 86.0982 Da; putative annotation: N/A; putative formula: C3H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017213438","spectrum_index":3036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D3 (delta mass: 18.0131 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.354,"smiles":null,"spectrum_id":"CCMSLIB00017213440","spectrum_index":3037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 176.0312 Da; putative annotation: N/A; putative formula: C10H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.191,"smiles":null,"spectrum_id":"CCMSLIB00017213441","spectrum_index":3038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 285.1575 Da; putative annotation: N/A; putative formula: C14H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.233,"smiles":null,"spectrum_id":"CCMSLIB00017213444","spectrum_index":3039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosahexaenoylglycine (delta mass: 90.0471 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.316,"smiles":null,"spectrum_id":"CCMSLIB00017213445","spectrum_index":3040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvidin C (delta mass: 92.0991 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.295,"smiles":null,"spectrum_id":"CCMSLIB00017213446","spectrum_index":3041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 85.0526 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.16,"smiles":null,"spectrum_id":"CCMSLIB00017213448","spectrum_index":3042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 353.9 Da; putative annotation: N/A; putative formula: CH2N6O10S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.974,"smiles":null,"spectrum_id":"CCMSLIB00017213449","spectrum_index":3043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 14.9424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.008,"smiles":null,"spectrum_id":"CCMSLIB00017213450","spectrum_index":3044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 292.0911 Da; putative annotation: N/A; putative formula: C12H23O2P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.172,"smiles":null,"spectrum_id":"CCMSLIB00017213453","spectrum_index":3045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 35.0377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.249,"smiles":null,"spectrum_id":"CCMSLIB00017213454","spectrum_index":3046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11,14-Eicosadienoic acid (delta mass: 36.0215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.3,"smiles":null,"spectrum_id":"CCMSLIB00017213455","spectrum_index":3047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 237.1569 Da; putative annotation: N/A; putative formula: C7H15N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.222,"smiles":null,"spectrum_id":"CCMSLIB00017213457","spectrum_index":3048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 56.0605 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.215,"smiles":null,"spectrum_id":"CCMSLIB00017213458","spectrum_index":3049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 69.0578 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.135,"smiles":null,"spectrum_id":"CCMSLIB00017213459","spectrum_index":3050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 154.1347 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.268,"smiles":null,"spectrum_id":"CCMSLIB00017213460","spectrum_index":3051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 52.0314 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.081,"smiles":null,"spectrum_id":"CCMSLIB00017213463","spectrum_index":3052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 401.3088 Da; putative annotation: N/A; putative formula: C14H35N13O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.39,"smiles":null,"spectrum_id":"CCMSLIB00017213465","spectrum_index":3053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Thienyl)-1H-imidazole (delta mass: 144.0292 Da; putative annotation: N/A; putative formula: C4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.062,"smiles":null,"spectrum_id":"CCMSLIB00017213466","spectrum_index":3054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 173.0519 Da; putative annotation: N/A; putative formula: C7H11NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.153,"smiles":null,"spectrum_id":"CCMSLIB00017213467","spectrum_index":3055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 100.9935 Da; putative annotation: N/A; putative formula: C3H3NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.075,"smiles":null,"spectrum_id":"CCMSLIB00017213468","spectrum_index":3056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indole-3-carbonitrile (delta mass: 43.0124 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.063,"smiles":null,"spectrum_id":"CCMSLIB00017213469","spectrum_index":3057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 110.0729 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017213470","spectrum_index":3058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nordeprenyl (delta mass: 91.0269 Da; putative annotation: N/A; putative formula: C2H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017213472","spectrum_index":3059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 54.9942 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.081,"smiles":null,"spectrum_id":"CCMSLIB00017213474","spectrum_index":3060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 499.3871 Da; putative annotation: N/A; putative formula: C28H53NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.489,"smiles":null,"spectrum_id":"CCMSLIB00017213476","spectrum_index":3061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 104.0268 Da; putative annotation: N/A; putative formula: H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.076,"smiles":null,"spectrum_id":"CCMSLIB00017213477","spectrum_index":3062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 95.0373 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017213478","spectrum_index":3063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyluridine (delta mass: 247.0741 Da; putative annotation: N/A; putative formula: C7H13N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.167,"smiles":null,"spectrum_id":"CCMSLIB00017213479","spectrum_index":3064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 107.0373 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.124,"smiles":null,"spectrum_id":"CCMSLIB00017213481","spectrum_index":3065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 158.0944 Da; putative annotation: N/A; putative formula: C8H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.16,"smiles":null,"spectrum_id":"CCMSLIB00017213482","spectrum_index":3066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 46.0143 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.069,"smiles":null,"spectrum_id":"CCMSLIB00017213484","spectrum_index":3067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 55.0387 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.105,"smiles":null,"spectrum_id":"CCMSLIB00017213486","spectrum_index":3068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 219.1828 Da; putative annotation: N/A; putative formula: C12H21N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.258,"smiles":null,"spectrum_id":"CCMSLIB00017213487","spectrum_index":3069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 122.1559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017213488","spectrum_index":3070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 94.1246 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017213490","spectrum_index":3071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,17-diol, (3.alpha.,5.alpha.,17.beta.)- (delta mass: 48.0359 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.283,"smiles":null,"spectrum_id":"CCMSLIB00017213491","spectrum_index":3072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S-Hydroxy-9E,11Z,14Z-eicosatrienoic acid (delta mass: 361.3179 Da; putative annotation: N/A; putative formula: C24H43NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.576,"smiles":null,"spectrum_id":"CCMSLIB00017213492","spectrum_index":3073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(1H-Indol-3-yl)ethyl]propanamide (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.128,"smiles":null,"spectrum_id":"CCMSLIB00017213493","spectrum_index":3074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.118,"smiles":null,"spectrum_id":"CCMSLIB00017213495","spectrum_index":3075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trichoclin (delta mass: 79.9663 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.058,"smiles":null,"spectrum_id":"CCMSLIB00017213497","spectrum_index":3076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 66.0469 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.18,"smiles":null,"spectrum_id":"CCMSLIB00017213499","spectrum_index":3077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 100.065 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.313,"smiles":null,"spectrum_id":"CCMSLIB00017213500","spectrum_index":3078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-mannosamine - 40.0 eV (delta mass: 837.3505 Da; putative annotation: N/A; putative formula: C45H52N5O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1059.45,"smiles":null,"spectrum_id":"CCMSLIB00017213501","spectrum_index":3079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 126.0186 Da; putative annotation: N/A; putative formula: C3H2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.115,"smiles":null,"spectrum_id":"CCMSLIB00017213502","spectrum_index":3080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 130.0867 Da; putative annotation: N/A; putative formula: C4H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.319,"smiles":null,"spectrum_id":"CCMSLIB00017213504","spectrum_index":3081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Val (delta mass: 99.0686 Da; putative annotation: L-Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.197,"smiles":null,"spectrum_id":"CCMSLIB00017213505","spectrum_index":3082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 132.0941 Da; putative annotation: Carvacrol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.196,"smiles":null,"spectrum_id":"CCMSLIB00017213507","spectrum_index":3083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 97.0526 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.123,"smiles":null,"spectrum_id":"CCMSLIB00017213509","spectrum_index":3084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 236.2134 Da; putative annotation: (2R)-1-(2-Hydroxyethyl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.461,"smiles":null,"spectrum_id":"CCMSLIB00017213510","spectrum_index":3085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 278.2233 Da; putative annotation: Laetisaric acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.466,"smiles":null,"spectrum_id":"CCMSLIB00017213511","spectrum_index":3086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 280.2395 Da; putative annotation: 8-(3-Octyl-2-oxiranyl)octanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.524,"smiles":null,"spectrum_id":"CCMSLIB00017213512","spectrum_index":3087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pristanic acid (delta mass: 574.4855 Da; putative annotation: 1-Palmitoyl-2-linoleoyl-rac-glycerol; putative formula: C37H66O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":873.78,"smiles":null,"spectrum_id":"CCMSLIB00017213513","spectrum_index":3088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 296.2353 Da; putative annotation: 12,13-Dihydroxy-9Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.493,"smiles":null,"spectrum_id":"CCMSLIB00017213515","spectrum_index":3089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 298.1932 Da; putative annotation: Cafestol; putative formula: C20H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.269,"smiles":null,"spectrum_id":"CCMSLIB00017213518","spectrum_index":3090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 345.2712 Da; putative annotation: 20-Hydroxy-N-(2-hydroxyethyl)-5Z,8Z,11Z,14Z-eicosatetraenamide; putative formula: C22H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.514,"smiles":null,"spectrum_id":"CCMSLIB00017213519","spectrum_index":3091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 690.4984 Da; putative annotation: Ionomycin; putative formula: C41H70O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":967.715,"smiles":null,"spectrum_id":"CCMSLIB00017213520","spectrum_index":3092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 314.2248 Da; putative annotation: Oxymetholone; putative formula: C21H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.348,"smiles":null,"spectrum_id":"CCMSLIB00017213521","spectrum_index":3093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 279.256 Da; putative annotation: Palmitoleoyl ethanolamide; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.498,"smiles":null,"spectrum_id":"CCMSLIB00017213523","spectrum_index":3094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 296.2353 Da; putative annotation: 12,13-Dihydroxy-9Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.425,"smiles":null,"spectrum_id":"CCMSLIB00017213524","spectrum_index":3095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 348.2275 Da; putative annotation: 3.beta.-Allotetrahydrocortisol; putative formula: C21H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.351,"smiles":null,"spectrum_id":"CCMSLIB00017213527","spectrum_index":3096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 316.2404 Da; putative annotation: 5-Pregnene-3.beta.,17,20.alpha.-triol; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.301,"smiles":null,"spectrum_id":"CCMSLIB00017213528","spectrum_index":3097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 243.1106 Da; putative annotation: NCGC00384570-01_C11H19NO6_Butanenitrile, 2-(beta-D-glucopyranosyloxy)-2-methyl-; putative formula: C11H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.171,"smiles":null,"spectrum_id":"CCMSLIB00017213529","spectrum_index":3098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 257.0917 Da; putative annotation: 4-Ethyl-N-(4-methylphenyl)benzenesulfonamide; putative formula: C15H15NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.146,"smiles":null,"spectrum_id":"CCMSLIB00017213531","spectrum_index":3099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 282.2551 Da; putative annotation: Spectral Match to 3-Hydroxyoctadecanoic Acid from NIST14; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.534,"smiles":null,"spectrum_id":"CCMSLIB00017213532","spectrum_index":3100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 309.2664 Da; putative annotation: Gly-C17:0; putative formula: C19H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.514,"smiles":null,"spectrum_id":"CCMSLIB00017213533","spectrum_index":3101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 281.2716 Da; putative annotation: 2S-Amino-4E-octadecene-1,3S-diol; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.53,"smiles":null,"spectrum_id":"CCMSLIB00017213534","spectrum_index":3102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Arachidonoylglycerol (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017213537","spectrum_index":3103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid (delta mass: 64.0672 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.315,"smiles":null,"spectrum_id":"CCMSLIB00017213545","spectrum_index":3104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 181.0736 Da; putative annotation: N/A; putative formula: C9H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.138,"smiles":null,"spectrum_id":"CCMSLIB00017213546","spectrum_index":3105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 17.9888 Da; putative annotation: N/A; putative formula: C3H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.07,"smiles":null,"spectrum_id":"CCMSLIB00017213547","spectrum_index":3106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10-2 (delta mass: 225.1359 Da; putative annotation: N/A; putative formula: C12H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.383,"smiles":null,"spectrum_id":"CCMSLIB00017213548","spectrum_index":3107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 32.0141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.11,"smiles":null,"spectrum_id":"CCMSLIB00017213549","spectrum_index":3108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 142.0855 Da; putative annotation: N/A; putative formula: C5H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.188,"smiles":null,"spectrum_id":"CCMSLIB00017213551","spectrum_index":3109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 106.0381 Da; putative annotation: N/A; putative formula: C2H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.119,"smiles":null,"spectrum_id":"CCMSLIB00017213552","spectrum_index":3110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 168.1362 Da; putative annotation: N/A; putative formula: C8H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.488,"smiles":null,"spectrum_id":"CCMSLIB00017213555","spectrum_index":3111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 126.2207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.347,"smiles":null,"spectrum_id":"CCMSLIB00017213556","spectrum_index":3112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 101.0594 Da; putative annotation: N/A; putative formula: C3H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.075,"smiles":null,"spectrum_id":"CCMSLIB00017213557","spectrum_index":3113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 299.1229 Da; putative annotation: N/A; putative formula: C11H17N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.386,"smiles":null,"spectrum_id":"CCMSLIB00017213558","spectrum_index":3114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (delta mass: 252.0853 Da; putative annotation: N/A; putative formula: C10H20O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.189,"smiles":null,"spectrum_id":"CCMSLIB00017213559","spectrum_index":3115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 158.147 Da; putative annotation: N/A; putative formula: C13H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.405,"smiles":null,"spectrum_id":"CCMSLIB00017213561","spectrum_index":3116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 40.0426 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.124,"smiles":null,"spectrum_id":"CCMSLIB00017213562","spectrum_index":3117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 401.3512 Da; putative annotation: N/A; putative formula: C24H43N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.422,"smiles":null,"spectrum_id":"CCMSLIB00017213565","spectrum_index":3118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 54.0107 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017213566","spectrum_index":3119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 96.0213 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.264,"smiles":null,"spectrum_id":"CCMSLIB00017213567","spectrum_index":3120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 168.0412 Da; putative annotation: N/A; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.138,"smiles":null,"spectrum_id":"CCMSLIB00017213568","spectrum_index":3121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 112.0522 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017213570","spectrum_index":3122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 79.957 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.211,"smiles":null,"spectrum_id":"CCMSLIB00017213571","spectrum_index":3123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 723.4185 Da; putative annotation: N/A; putative formula: C43H57N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1066.54,"smiles":null,"spectrum_id":"CCMSLIB00017213572","spectrum_index":3124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 99.0326 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.161,"smiles":null,"spectrum_id":"CCMSLIB00017213575","spectrum_index":3125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-{2-[(2-Amino-6-hydroxy-9H-purin-9-yl)methoxy]ethoxy}-3-methyl-1-oxo-2-butanamine (delta mass: 82.0591 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.221,"smiles":null,"spectrum_id":"CCMSLIB00017213576","spectrum_index":3126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 187.0842 Da; putative annotation: N/A; putative formula: C8H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.176,"smiles":null,"spectrum_id":"CCMSLIB00017213578","spectrum_index":3127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 24.0366 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.107,"smiles":null,"spectrum_id":"CCMSLIB00017213579","spectrum_index":3128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380550-01_C24H40O5_4-{[5-(6-Hydroxy-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl)-3-methylpentyl]oxy}-4-oxobutanoic acid (delta mass: 15.9962 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.291,"smiles":null,"spectrum_id":"CCMSLIB00017213580","spectrum_index":3129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hederagenin (delta mass: 162.0582 Da; putative annotation: N/A; putative formula: C12H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.421,"smiles":null,"spectrum_id":"CCMSLIB00017213581","spectrum_index":3130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 197.3045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.5,"smiles":null,"spectrum_id":"CCMSLIB00017213583","spectrum_index":3131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid (delta mass: 235.1061 Da; putative annotation: N/A; putative formula: C10H21NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.349,"smiles":null,"spectrum_id":"CCMSLIB00017213584","spectrum_index":3132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 354.2067 Da; putative annotation: N/A; putative formula: C20H36O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.486,"smiles":null,"spectrum_id":"CCMSLIB00017213587","spectrum_index":3133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 156.1227 Da; putative annotation: N/A; putative formula: C4H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.36,"smiles":null,"spectrum_id":"CCMSLIB00017213588","spectrum_index":3134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 69.0414 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.138,"smiles":null,"spectrum_id":"CCMSLIB00017213589","spectrum_index":3135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 134.0578 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.134,"smiles":null,"spectrum_id":"CCMSLIB00017213590","spectrum_index":3136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.123,"smiles":null,"spectrum_id":"CCMSLIB00017213592","spectrum_index":3137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU279501 5-Hydroxyindole-3-acetic acid|2-(5-hydroxy-1H-indol-3-yl)acetic acid (delta mass: 26.0155 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.081,"smiles":null,"spectrum_id":"CCMSLIB00017213593","spectrum_index":3138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 23.9196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017213596","spectrum_index":3139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoerucin (delta mass: 78.0821 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.445,"smiles":null,"spectrum_id":"CCMSLIB00017213597","spectrum_index":3140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 693.4796 Da; putative annotation: N/A; putative formula: C43H67NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":856.54,"smiles":null,"spectrum_id":"CCMSLIB00017213598","spectrum_index":3141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 38.0156 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.107,"smiles":null,"spectrum_id":"CCMSLIB00017213599","spectrum_index":3142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-ethenyl-1,4a,7-trimethyl-6-oxo-2,3,4,8,8a,9,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.233,"smiles":null,"spectrum_id":"CCMSLIB00017213601","spectrum_index":3143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 485.1746 Da; putative annotation: N/A; putative formula: C24H23N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.235,"smiles":null,"spectrum_id":"CCMSLIB00017213602","spectrum_index":3144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 68.0559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.34,"smiles":null,"spectrum_id":"CCMSLIB00017213604","spectrum_index":3145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-CARBOXYBENZALDEHYDE (delta mass: 160.0007 Da; putative annotation: N/A; putative formula: C5H4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.04,"smiles":null,"spectrum_id":"CCMSLIB00017213606","spectrum_index":3146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Amiflamine (delta mass: 117.0673 Da; putative annotation: N/A; putative formula: C7H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.237,"smiles":null,"spectrum_id":"CCMSLIB00017213607","spectrum_index":3147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,3-Dichlorobenzyl)piperazine (delta mass: 51.9945 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.055,"smiles":null,"spectrum_id":"CCMSLIB00017213608","spectrum_index":3148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylcyclohexanol (delta mass: 157.9226 Da; putative annotation: N/A; putative formula: C3H-2N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.05,"smiles":null,"spectrum_id":"CCMSLIB00017213610","spectrum_index":3149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; CorrDec (delta mass: 70.01 Da; putative annotation: N/A; putative formula: C2H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.07,"smiles":null,"spectrum_id":"CCMSLIB00017213612","spectrum_index":3150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 77.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.29,"smiles":null,"spectrum_id":"CCMSLIB00017213614","spectrum_index":3151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 735.4216 Da; putative annotation: N/A; putative formula: C41H61N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.482,"smiles":null,"spectrum_id":"CCMSLIB00017213615","spectrum_index":3152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMANNOSAMINE (delta mass: 858.187 Da; putative annotation: N/A; putative formula: C46H26N12O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1080.28,"smiles":null,"spectrum_id":"CCMSLIB00017213616","spectrum_index":3153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 48.0322 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.311,"smiles":null,"spectrum_id":"CCMSLIB00017213617","spectrum_index":3154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 232.9793 Da; putative annotation: N/A; putative formula: C11H7NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.071,"smiles":null,"spectrum_id":"CCMSLIB00017213619","spectrum_index":3155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 114.0331 Da; putative annotation: N/A; putative formula: C6H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.157,"smiles":null,"spectrum_id":"CCMSLIB00017213620","spectrum_index":3156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(6-Fluoro-1H-indol-1-yl)propanoic acid (delta mass: 42.0172 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.094,"smiles":null,"spectrum_id":"CCMSLIB00017213622","spectrum_index":3157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 98.0367 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.316,"smiles":null,"spectrum_id":"CCMSLIB00017213624","spectrum_index":3158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 91.9925 Da; putative annotation: N/A; putative formula: C4HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.074,"smiles":null,"spectrum_id":"CCMSLIB00017213625","spectrum_index":3159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-((E)-2-((1R,2S,3R,5S)-3,5-Dihydroxy-2-((Z)-oct-2-enyl)cyclopentyl)vinyl)tetrahydro-2H-pyran-2-one (delta mass: 52.0311 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.268,"smiles":null,"spectrum_id":"CCMSLIB00017213626","spectrum_index":3160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 13.9793 Da; putative annotation: N/A; putative formula: H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.086,"smiles":null,"spectrum_id":"CCMSLIB00017213627","spectrum_index":3161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-2-hydroxybenzoic acid (delta mass: 9.9467 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.981,"smiles":null,"spectrum_id":"CCMSLIB00017213629","spectrum_index":3162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 194.2023 Da; putative annotation: N/A; putative formula: C14H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.262,"smiles":null,"spectrum_id":"CCMSLIB00017213631","spectrum_index":3163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 39.0562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.138,"smiles":null,"spectrum_id":"CCMSLIB00017213632","spectrum_index":3164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12(13)-Epoxy-9Z-octadecenoic acid from NIST14 (delta mass: 256.2462 Da; putative annotation: N/A; putative formula: C11H28N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.489,"smiles":null,"spectrum_id":"CCMSLIB00017213633","spectrum_index":3165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2R,5S,8R,14R,15R,16S)-16-hydroxy-1,2,14,17,17-pentamethyl-8-(prop-1-en-2-yl)pentacyclo[11.7.0.0,?.0?,?.0?,?]icosane-5,15-dicarboxylic acid (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.404,"smiles":null,"spectrum_id":"CCMSLIB00017213634","spectrum_index":3166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 172.1613 Da; putative annotation: N/A; putative formula: C14H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.414,"smiles":null,"spectrum_id":"CCMSLIB00017213636","spectrum_index":3167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 251.16 Da; putative annotation: N/A; putative formula: C9H17N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.35,"smiles":null,"spectrum_id":"CCMSLIB00017213638","spectrum_index":3168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 14.0148 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.257,"smiles":null,"spectrum_id":"CCMSLIB00017213640","spectrum_index":3169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 22.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.074,"smiles":null,"spectrum_id":"CCMSLIB00017213641","spectrum_index":3170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 408.2243 Da; putative annotation: N/A; putative formula: C18H32N8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.3,"smiles":null,"spectrum_id":"CCMSLIB00017213645","spectrum_index":3171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine methyl ester (delta mass: 219.0563 Da; putative annotation: N/A; putative formula: C10H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.133,"smiles":null,"spectrum_id":"CCMSLIB00017213646","spectrum_index":3172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 124.0677 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.138,"smiles":null,"spectrum_id":"CCMSLIB00017213647","spectrum_index":3173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 668.2294 Da; putative annotation: N/A; putative formula: C35H40O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.311,"smiles":null,"spectrum_id":"CCMSLIB00017213648","spectrum_index":3174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.253,"smiles":null,"spectrum_id":"CCMSLIB00017213649","spectrum_index":3175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatrienoic acid (delta mass: 68.0476 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.342,"smiles":null,"spectrum_id":"CCMSLIB00017213651","spectrum_index":3176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 658.5135 Da; putative annotation: N/A; putative formula: C39H79O-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":935.73,"smiles":null,"spectrum_id":"CCMSLIB00017213653","spectrum_index":3177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 14.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.262,"smiles":null,"spectrum_id":"CCMSLIB00017213655","spectrum_index":3178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 312.1063 Da; putative annotation: N/A; putative formula: C12H24O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.333,"smiles":null,"spectrum_id":"CCMSLIB00017213656","spectrum_index":3179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 109.0501 Da; putative annotation: N/A; putative formula: C2H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.146,"smiles":null,"spectrum_id":"CCMSLIB00017213657","spectrum_index":3180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxybenzoic acid (delta mass: 148.0333 Da; putative annotation: N/A; putative formula: C3H9N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.109,"smiles":null,"spectrum_id":"CCMSLIB00017213659","spectrum_index":3181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 162.0531 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.229,"smiles":null,"spectrum_id":"CCMSLIB00017213660","spectrum_index":3182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 191.08 Da; putative annotation: N/A; putative formula: C8H17NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.219,"smiles":null,"spectrum_id":"CCMSLIB00017213662","spectrum_index":3183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 171.0537 Da; putative annotation: N/A; putative formula: C7H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.098,"smiles":null,"spectrum_id":"CCMSLIB00017213664","spectrum_index":3184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOATE - 30.0 eV (delta mass: 47.0137 Da; putative annotation: N/A; putative formula: C4HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.069,"smiles":null,"spectrum_id":"CCMSLIB00017213665","spectrum_index":3185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 105.0579 Da; putative annotation: N/A; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.155,"smiles":null,"spectrum_id":"CCMSLIB00017213667","spectrum_index":3186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-2-hydroxybenzoic acid (delta mass: 62.0153 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.049,"smiles":null,"spectrum_id":"CCMSLIB00017213668","spectrum_index":3187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 84.0515 Da; putative annotation: N/A; putative formula: C5H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.2,"smiles":null,"spectrum_id":"CCMSLIB00017213669","spectrum_index":3188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid (delta mass: 139.0844 Da; putative annotation: N/A; putative formula: C5H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.175,"smiles":null,"spectrum_id":"CCMSLIB00017213671","spectrum_index":3189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16.alpha.-Hydroxypregnenolone (delta mass: 17.9747 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.217,"smiles":null,"spectrum_id":"CCMSLIB00017213674","spectrum_index":3190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 100.0882 Da; putative annotation: N/A; putative formula: C6H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017213675","spectrum_index":3191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 693.3928 Da; putative annotation: N/A; putative formula: C46H51N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1020.52,"smiles":null,"spectrum_id":"CCMSLIB00017213676","spectrum_index":3192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 270.256 Da; putative annotation: N/A; putative formula: C17H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.293,"smiles":null,"spectrum_id":"CCMSLIB00017213677","spectrum_index":3193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 168.0421 Da; putative annotation: N/A; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.166,"smiles":null,"spectrum_id":"CCMSLIB00017213679","spectrum_index":3194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 380.2934 Da; putative annotation: N/A; putative formula: C24H44O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.395,"smiles":null,"spectrum_id":"CCMSLIB00017213680","spectrum_index":3195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 76.0196 Da; putative annotation: N/A; putative formula: CH5N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.1,"smiles":null,"spectrum_id":"CCMSLIB00017213682","spectrum_index":3196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 56.063 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.139,"smiles":null,"spectrum_id":"CCMSLIB00017213684","spectrum_index":3197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(4-Fluorophenyl)-1H-indole (delta mass: 18.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.104,"smiles":null,"spectrum_id":"CCMSLIB00017213685","spectrum_index":3198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hexadec-15-en-7-ynyl-4-hydroxy-5-methyloxolan-2-one (delta mass: 101.0845 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.343,"smiles":null,"spectrum_id":"CCMSLIB00017213686","spectrum_index":3199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxycapric acid (delta mass: 184.1478 Da; putative annotation: N/A; putative formula: C11H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.296,"smiles":null,"spectrum_id":"CCMSLIB00017213688","spectrum_index":3200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Panglimycin C (delta mass: 128.0473 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.186,"smiles":null,"spectrum_id":"CCMSLIB00017213689","spectrum_index":3201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 153.0788 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.165,"smiles":null,"spectrum_id":"CCMSLIB00017213692","spectrum_index":3202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 325.2111 Da; putative annotation: N/A; putative formula: C15H27N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.36,"smiles":null,"spectrum_id":"CCMSLIB00017213693","spectrum_index":3203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methenolone (delta mass: 97.0757 Da; putative annotation: N/A; putative formula: C3H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.308,"smiles":null,"spectrum_id":"CCMSLIB00017213695","spectrum_index":3204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 160.0909 Da; putative annotation: N/A; putative formula: C11H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.318,"smiles":null,"spectrum_id":"CCMSLIB00017213696","spectrum_index":3205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 130.0828 Da; putative annotation: N/A; putative formula: H6N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.32,"smiles":null,"spectrum_id":"CCMSLIB00017213697","spectrum_index":3206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 126.0755 Da; putative annotation: N/A; putative formula: C2H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.427,"smiles":null,"spectrum_id":"CCMSLIB00017213698","spectrum_index":3207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 128.0968 Da; putative annotation: N/A; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.36,"smiles":null,"spectrum_id":"CCMSLIB00017213701","spectrum_index":3208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 96.0573 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017213703","spectrum_index":3209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-1,3-Dihydroxydammara-12,24-dien-26-oic acid (delta mass: 164.0975 Da; putative annotation: N/A; putative formula: C14H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.46,"smiles":null,"spectrum_id":"CCMSLIB00017213704","spectrum_index":3210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 116.1052 Da; putative annotation: N/A; putative formula: C4H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.39,"smiles":null,"spectrum_id":"CCMSLIB00017213705","spectrum_index":3211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine; AIF; CE0; MS2Dec (delta mass: 126.1045 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.191,"smiles":null,"spectrum_id":"CCMSLIB00017213706","spectrum_index":3212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 394.3089 Da; putative annotation: N/A; putative formula: C25H46O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.346,"smiles":null,"spectrum_id":"CCMSLIB00017213707","spectrum_index":3213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.185,"smiles":null,"spectrum_id":"CCMSLIB00017213709","spectrum_index":3214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 50.0 eV (delta mass: 180.0891 Da; putative annotation: N/A; putative formula: C9H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.18,"smiles":null,"spectrum_id":"CCMSLIB00017213712","spectrum_index":3215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .gamma.-Linolenoyl ethanolamide (delta mass: 60.0202 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.294,"smiles":null,"spectrum_id":"CCMSLIB00017213713","spectrum_index":3216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 92.9789 Da; putative annotation: N/A; putative formula: C3H-1N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.164,"smiles":null,"spectrum_id":"CCMSLIB00017213714","spectrum_index":3217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.alpha.,9.Xi.)-3-Hydroxyolean-12-en-24-oic acid (delta mass: 112.068 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.436,"smiles":null,"spectrum_id":"CCMSLIB00017213715","spectrum_index":3218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 149.0685 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.322,"smiles":null,"spectrum_id":"CCMSLIB00017213716","spectrum_index":3219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DEOXYCHOLIC ACID CollisionEnergy:205060 (delta mass: 54.0476 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.348,"smiles":null,"spectrum_id":"CCMSLIB00017213717","spectrum_index":3220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 251.2265 Da; putative annotation: N/A; putative formula: C16H29NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.396,"smiles":null,"spectrum_id":"CCMSLIB00017213719","spectrum_index":3221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[2-(Diisopropylamino)ethyl]indole (delta mass: 35.0614 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.263,"smiles":null,"spectrum_id":"CCMSLIB00017213722","spectrum_index":3222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 163.0394 Da; putative annotation: N/A; putative formula: C5H10NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.08,"smiles":null,"spectrum_id":"CCMSLIB00017213723","spectrum_index":3223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 307.1514 Da; putative annotation: N/A; putative formula: C19H21N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.321,"smiles":null,"spectrum_id":"CCMSLIB00017213724","spectrum_index":3224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 175.0635 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.181,"smiles":null,"spectrum_id":"CCMSLIB00017213725","spectrum_index":3225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 843.6023 Da; putative annotation: N/A; putative formula: C47H93N3O-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1065.7,"smiles":null,"spectrum_id":"CCMSLIB00017213726","spectrum_index":3226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 941.4399 Da; putative annotation: N/A; putative formula: C54H63N5O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1104.5,"smiles":null,"spectrum_id":"CCMSLIB00017213727","spectrum_index":3227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 286.2295 Da; putative annotation: N/A; putative formula: C20H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.477,"smiles":null,"spectrum_id":"CCMSLIB00017213731","spectrum_index":3228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 270.181 Da; putative annotation: N/A; putative formula: C19H26O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.22,"smiles":null,"spectrum_id":"CCMSLIB00017213732","spectrum_index":3229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 50.0494 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.25,"smiles":null,"spectrum_id":"CCMSLIB00017213733","spectrum_index":3230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbanilide (delta mass: 86.0271 Da; putative annotation: N/A; putative formula: C6H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.129,"smiles":null,"spectrum_id":"CCMSLIB00017213734","spectrum_index":3231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.065,"smiles":null,"spectrum_id":"CCMSLIB00017213735","spectrum_index":3232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl hydrogen malonate (delta mass: 29.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.091,"smiles":null,"spectrum_id":"CCMSLIB00017213736","spectrum_index":3233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 87.9953 Da; putative annotation: N/A; putative formula: C6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.071,"smiles":null,"spectrum_id":"CCMSLIB00017213737","spectrum_index":3234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 116.0629 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.139,"smiles":null,"spectrum_id":"CCMSLIB00017213740","spectrum_index":3235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-carboxypropyl)-3,7-dimethylxanthine (delta mass: 36.0137 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.122,"smiles":null,"spectrum_id":"CCMSLIB00017213741","spectrum_index":3236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 186.0599 Da; putative annotation: N/A; putative formula: C12H11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.161,"smiles":null,"spectrum_id":"CCMSLIB00017213742","spectrum_index":3237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP007402 Glycohyocholic acid|AM022340|2-[4-(3,6,7-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid (delta mass: 216.1698 Da; putative annotation: N/A; putative formula: C8H20N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.486,"smiles":null,"spectrum_id":"CCMSLIB00017213744","spectrum_index":3238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycerol 1-myristate (delta mass: 162.0087 Da; putative annotation: N/A; putative formula: C6H11O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.262,"smiles":null,"spectrum_id":"CCMSLIB00017213745","spectrum_index":3239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxycodone (delta mass: 56.0671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.206,"smiles":null,"spectrum_id":"CCMSLIB00017213746","spectrum_index":3240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 149.9946 Da; putative annotation: N/A; putative formula: CH3N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.07,"smiles":null,"spectrum_id":"CCMSLIB00017213749","spectrum_index":3241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Lauroyl-D-erythro-sphinganine (delta mass: 54.0467 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.519,"smiles":null,"spectrum_id":"CCMSLIB00017213750","spectrum_index":3242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 70.9437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.035,"smiles":null,"spectrum_id":"CCMSLIB00017213752","spectrum_index":3243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 126.0794 Da; putative annotation: N/A; putative formula: C6H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.155,"smiles":null,"spectrum_id":"CCMSLIB00017213753","spectrum_index":3244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 127.1657 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.241,"smiles":null,"spectrum_id":"CCMSLIB00017213754","spectrum_index":3245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304057 p-Coumaraldehyde (delta mass: 162.0529 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.113,"smiles":null,"spectrum_id":"CCMSLIB00017213755","spectrum_index":3246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 46.0965 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.183,"smiles":null,"spectrum_id":"CCMSLIB00017213757","spectrum_index":3247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Acetyl-2-methoxyphenoxy)acetic acid (delta mass: 32.0256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.101,"smiles":null,"spectrum_id":"CCMSLIB00017213759","spectrum_index":3248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 150.0302 Da; putative annotation: N/A; putative formula: C2H7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.078,"smiles":null,"spectrum_id":"CCMSLIB00017213760","spectrum_index":3249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Imidazol-1-ylmethyl)benzoic acid (delta mass: 60.0465 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017213762","spectrum_index":3250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 74.0585 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.29,"smiles":null,"spectrum_id":"CCMSLIB00017213763","spectrum_index":3251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 483.2374 Da; putative annotation: N/A; putative formula: C27H37N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.35,"smiles":null,"spectrum_id":"CCMSLIB00017213764","spectrum_index":3252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 101.0555 Da; putative annotation: N/A; putative formula: C3H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.147,"smiles":null,"spectrum_id":"CCMSLIB00017213766","spectrum_index":3253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 144.0936 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.143,"smiles":null,"spectrum_id":"CCMSLIB00017213768","spectrum_index":3254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 456.2394 Da; putative annotation: N/A; putative formula: C20H40O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.357,"smiles":null,"spectrum_id":"CCMSLIB00017213769","spectrum_index":3255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1-Pyrrolidinylcarbonyl)piperidine (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.17,"smiles":null,"spectrum_id":"CCMSLIB00017213770","spectrum_index":3256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-5-Phenyl-2,4-pentadienoic acid (delta mass: 126.0698 Da; putative annotation: N/A; putative formula: C6H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.145,"smiles":null,"spectrum_id":"CCMSLIB00017213771","spectrum_index":3257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 58.0207 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.117,"smiles":null,"spectrum_id":"CCMSLIB00017213772","spectrum_index":3258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 17.0342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.11,"smiles":null,"spectrum_id":"CCMSLIB00017213773","spectrum_index":3259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 104.084 Da; putative annotation: N/A; putative formula: CH8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.149,"smiles":null,"spectrum_id":"CCMSLIB00017213775","spectrum_index":3260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 69.0102 Da; putative annotation: N/A; putative formula: H-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.071,"smiles":null,"spectrum_id":"CCMSLIB00017213778","spectrum_index":3261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 91.0456 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.257,"smiles":null,"spectrum_id":"CCMSLIB00017213779","spectrum_index":3262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 35.0375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.202,"smiles":null,"spectrum_id":"CCMSLIB00017213780","spectrum_index":3263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 84.0415 Da; putative annotation: N/A; putative formula: C5H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.117,"smiles":null,"spectrum_id":"CCMSLIB00017213781","spectrum_index":3264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-5-Phenyl-2,4-pentadienoic acid (delta mass: 23.9998 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.075,"smiles":null,"spectrum_id":"CCMSLIB00017213782","spectrum_index":3265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 468.2723 Da; putative annotation: N/A; putative formula: C25H40O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.483,"smiles":null,"spectrum_id":"CCMSLIB00017213783","spectrum_index":3266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 136.0899 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.348,"smiles":null,"spectrum_id":"CCMSLIB00017213786","spectrum_index":3267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 226.1031 Da; putative annotation: N/A; putative formula: C12H18O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.163,"smiles":null,"spectrum_id":"CCMSLIB00017213788","spectrum_index":3268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 62.0522 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.414,"smiles":null,"spectrum_id":"CCMSLIB00017213789","spectrum_index":3269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 314.1214 Da; putative annotation: N/A; putative formula: C16H20N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.234,"smiles":null,"spectrum_id":"CCMSLIB00017213790","spectrum_index":3270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR303016 Quercetin-3,4'-O-di-beta-glucoside (delta mass: 162.0539 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":789.209,"smiles":null,"spectrum_id":"CCMSLIB00017213791","spectrum_index":3271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 59.0629 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017213792","spectrum_index":3272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 54.0106 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017213793","spectrum_index":3273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cys-Thr (delta mass: 56.0617 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.136,"smiles":null,"spectrum_id":"CCMSLIB00017213794","spectrum_index":3274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 59.0368 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.175,"smiles":null,"spectrum_id":"CCMSLIB00017213797","spectrum_index":3275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dehydrodocosahexaenoic acid (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.243,"smiles":null,"spectrum_id":"CCMSLIB00017213799","spectrum_index":3276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monoelaidin from NIST14 (delta mass: 435.2758 Da; putative annotation: N/A; putative formula: C22H46NOPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.576,"smiles":null,"spectrum_id":"CCMSLIB00017213800","spectrum_index":3277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 74.0154 Da; putative annotation: N/A; putative formula: C6H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017213801","spectrum_index":3278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 36.0358 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.247,"smiles":null,"spectrum_id":"CCMSLIB00017213802","spectrum_index":3279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 123.0588 Da; putative annotation: N/A; putative formula: C7H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.14,"smiles":null,"spectrum_id":"CCMSLIB00017213803","spectrum_index":3280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 150.0679 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017213804","spectrum_index":3281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 214.1306 Da; putative annotation: N/A; putative formula: C12H23O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.264,"smiles":null,"spectrum_id":"CCMSLIB00017213808","spectrum_index":3282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 294.1096 Da; putative annotation: N/A; putative formula: C9H19N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.19,"smiles":null,"spectrum_id":"CCMSLIB00017213809","spectrum_index":3283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 117.042 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.118,"smiles":null,"spectrum_id":"CCMSLIB00017213810","spectrum_index":3284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.153,"smiles":null,"spectrum_id":"CCMSLIB00017213811","spectrum_index":3285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017213812","spectrum_index":3286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-methyl-2-pyrone (delta mass: 392.0953 Da; putative annotation: N/A; putative formula: C15H20O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.134,"smiles":null,"spectrum_id":"CCMSLIB00017213813","spectrum_index":3287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 386.1944 Da; putative annotation: N/A; putative formula: C22H31N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.29,"smiles":null,"spectrum_id":"CCMSLIB00017213815","spectrum_index":3288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 97.9772 Da; putative annotation: N/A; putative formula: CH-1N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.101,"smiles":null,"spectrum_id":"CCMSLIB00017213818","spectrum_index":3289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 248.0534 Da; putative annotation: N/A; putative formula: C4H9N8O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.129,"smiles":null,"spectrum_id":"CCMSLIB00017213819","spectrum_index":3290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 325.2976 Da; putative annotation: N/A; putative formula: C20H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.561,"smiles":null,"spectrum_id":"CCMSLIB00017213820","spectrum_index":3291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 325.2914 Da; putative annotation: N/A; putative formula: C19H39N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.539,"smiles":null,"spectrum_id":"CCMSLIB00017213821","spectrum_index":3292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-amino-1-piperidinecarboxylate (delta mass: 175.0474 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.176,"smiles":null,"spectrum_id":"CCMSLIB00017213822","spectrum_index":3293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 189.0634 Da; putative annotation: N/A; putative formula: C7H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.166,"smiles":null,"spectrum_id":"CCMSLIB00017213824","spectrum_index":3294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 288.2094 Da; putative annotation: N/A; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":955.438,"smiles":null,"spectrum_id":"CCMSLIB00017213827","spectrum_index":3295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 343.1105 Da; putative annotation: N/A; putative formula: C10H20N9O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.457,"smiles":null,"spectrum_id":"CCMSLIB00017213828","spectrum_index":3296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 510.2311 Da; putative annotation: N/A; putative formula: C20H26N14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.364,"smiles":null,"spectrum_id":"CCMSLIB00017213829","spectrum_index":3297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 764.4355 Da; putative annotation: N/A; putative formula: C42H68O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1107.56,"smiles":null,"spectrum_id":"CCMSLIB00017213830","spectrum_index":3298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 297.0678 Da; putative annotation: N/A; putative formula: C6H15N7O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.222,"smiles":null,"spectrum_id":"CCMSLIB00017213832","spectrum_index":3299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 324.1055 Da; putative annotation: N/A; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.374,"smiles":null,"spectrum_id":"CCMSLIB00017213835","spectrum_index":3300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Dihydrotestosterone (delta mass: 152.098 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.33,"smiles":null,"spectrum_id":"CCMSLIB00017213836","spectrum_index":3301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 28.0312 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.138,"smiles":null,"spectrum_id":"CCMSLIB00017213837","spectrum_index":3302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 106.0782 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.315,"smiles":null,"spectrum_id":"CCMSLIB00017213838","spectrum_index":3303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 345.185 Da; putative annotation: N/A; putative formula: C15H23N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.297,"smiles":null,"spectrum_id":"CCMSLIB00017213840","spectrum_index":3304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 305.1998 Da; putative annotation: N/A; putative formula: C19H23N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.317,"smiles":null,"spectrum_id":"CCMSLIB00017213842","spectrum_index":3305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 15.9958 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.217,"smiles":null,"spectrum_id":"CCMSLIB00017213844","spectrum_index":3306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 2,4-dihydroxy-6-methylbenzoate (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017213845","spectrum_index":3307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE0; CorrDec (delta mass: 47.987 Da; putative annotation: N/A; putative formula: O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.085,"smiles":null,"spectrum_id":"CCMSLIB00017213846","spectrum_index":3308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 106.0301 Da; putative annotation: N/A; putative formula: C2H7N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.095,"smiles":null,"spectrum_id":"CCMSLIB00017213848","spectrum_index":3309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dihydroxy-5Z,8Z,11Z-eicosatrienoic acid (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.315,"smiles":null,"spectrum_id":"CCMSLIB00017213849","spectrum_index":3310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 602.9584 Da; putative annotation: N/A; putative formula: C10H17N5O17P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.04,"smiles":null,"spectrum_id":"CCMSLIB00017213850","spectrum_index":3311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 1170.7757 Da; putative annotation: N/A; putative formula: C76H98N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1554.93,"smiles":null,"spectrum_id":"CCMSLIB00017213852","spectrum_index":3312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 158.0211 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.206,"smiles":null,"spectrum_id":"CCMSLIB00017213854","spectrum_index":3313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol oxide A (delta mass: 255.22 Da; putative annotation: N/A; putative formula: C15H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.421,"smiles":null,"spectrum_id":"CCMSLIB00017213856","spectrum_index":3314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310840 LPC 18:3 (delta mass: 97.9675 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.292,"smiles":null,"spectrum_id":"CCMSLIB00017213857","spectrum_index":3315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cuminyl alcohol (delta mass: 355.1117 Da; putative annotation: N/A; putative formula: C17H19N5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.223,"smiles":null,"spectrum_id":"CCMSLIB00017213858","spectrum_index":3316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 86.0515 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017213859","spectrum_index":3317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3r,5r,7r)-Adamantan-1-yl)piperidine (delta mass: 207.1989 Da; putative annotation: N/A; putative formula: C14H25N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.405,"smiles":null,"spectrum_id":"CCMSLIB00017213860","spectrum_index":3318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-dimethyl-proline-proline betaine (delta mass: 113.0553 Da; putative annotation: N/A; putative formula: H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.21,"smiles":null,"spectrum_id":"CCMSLIB00017213861","spectrum_index":3319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dierucoyl-sn-glycero-3-phosphoethanolamine (delta mass: 80.0642 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.743,"smiles":null,"spectrum_id":"CCMSLIB00017213865","spectrum_index":3320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,6,6-Tetramethyl-4-piperidinyl 2-methylacrylate (delta mass: 201.1006 Da; putative annotation: N/A; putative formula: C10H19NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.281,"smiles":null,"spectrum_id":"CCMSLIB00017213866","spectrum_index":3321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-oleoyl-sn-glycerol (delta mass: 122.8417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.371,"smiles":null,"spectrum_id":"CCMSLIB00017213867","spectrum_index":3322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoyl-rac-glycerol (delta mass: 122.9664 Da; putative annotation: N/A; putative formula: H4N3O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.48,"smiles":null,"spectrum_id":"CCMSLIB00017213868","spectrum_index":3323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 54.0511 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.19,"smiles":null,"spectrum_id":"CCMSLIB00017213869","spectrum_index":3324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (4R,4aS,10R,13aR)-14-hydroxy-4,13a-dimethyl-9,13-dioxo-2,3,4,4a,5,6,9,10,11,12,13,13a-dodecahydro-1H-7,10-methanobenzo[11]annulene-4-carboxylate (delta mass: 268.1984 Da; putative annotation: N/A; putative formula: C15H28N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.399,"smiles":null,"spectrum_id":"CCMSLIB00017213870","spectrum_index":3325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trehalose-6-phosphate (delta mass: 878.3946 Da; putative annotation: N/A; putative formula: C58H50N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1301.48,"smiles":null,"spectrum_id":"CCMSLIB00017213874","spectrum_index":3326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 294.103 Da; putative annotation: N/A; putative formula: C16H23O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.189,"smiles":null,"spectrum_id":"CCMSLIB00017213875","spectrum_index":3327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 187.085 Da; putative annotation: N/A; putative formula: C9H17NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.187,"smiles":null,"spectrum_id":"CCMSLIB00017213876","spectrum_index":3328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 265.1263 Da; putative annotation: N/A; putative formula: C11H24NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.161,"smiles":null,"spectrum_id":"CCMSLIB00017213877","spectrum_index":3329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 221.0483 Da; putative annotation: N/A; putative formula: C7H7N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.119,"smiles":null,"spectrum_id":"CCMSLIB00017213878","spectrum_index":3330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of galanthamine (delta mass: 17.0982 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.258,"smiles":null,"spectrum_id":"CCMSLIB00017213882","spectrum_index":3331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Isolongifolol (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.243,"smiles":null,"spectrum_id":"CCMSLIB00017213883","spectrum_index":3332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-C10:0 (delta mass: 38.0517 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.232,"smiles":null,"spectrum_id":"CCMSLIB00017213884","spectrum_index":3333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 290.0419 Da; putative annotation: N/A; putative formula: C6H14N2O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.191,"smiles":null,"spectrum_id":"CCMSLIB00017213888","spectrum_index":3334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 223.1048 Da; putative annotation: N/A; putative formula: C12H19NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.176,"smiles":null,"spectrum_id":"CCMSLIB00017213889","spectrum_index":3335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 281.0024 Da; putative annotation: N/A; putative formula: C10H8N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.062,"smiles":null,"spectrum_id":"CCMSLIB00017213890","spectrum_index":3336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 440.2199 Da; putative annotation: N/A; putative formula: C26H32O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.332,"smiles":null,"spectrum_id":"CCMSLIB00017213891","spectrum_index":3337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 182.064 Da; putative annotation: N/A; putative formula: C13H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.138,"smiles":null,"spectrum_id":"CCMSLIB00017213892","spectrum_index":3338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 341.8806 Da; putative annotation: N/A; putative formula: C6O13P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.955,"smiles":null,"spectrum_id":"CCMSLIB00017213893","spectrum_index":3339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 485.2984 Da; putative annotation: N/A; putative formula: C25H43NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.53,"smiles":null,"spectrum_id":"CCMSLIB00017213895","spectrum_index":3340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 59.0483 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.103,"smiles":null,"spectrum_id":"CCMSLIB00017213898","spectrum_index":3341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 185.1774 Da; putative annotation: N/A; putative formula: C11H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.28,"smiles":null,"spectrum_id":"CCMSLIB00017213899","spectrum_index":3342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N2-Methylguanosine; AIF; CE10; CorrDec (delta mass: 114.0354 Da; putative annotation: N/A; putative formula: C4H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.15,"smiles":null,"spectrum_id":"CCMSLIB00017213900","spectrum_index":3343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 43.0308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.122,"smiles":null,"spectrum_id":"CCMSLIB00017213901","spectrum_index":3344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 319.1997 Da; putative annotation: N/A; putative formula: C15H29NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.26,"smiles":null,"spectrum_id":"CCMSLIB00017213902","spectrum_index":3345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 987.5101 Da; putative annotation: N/A; putative formula: C68H61N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1150.57,"smiles":null,"spectrum_id":"CCMSLIB00017213903","spectrum_index":3346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 70.0331 Da; putative annotation: N/A; putative formula: C4H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.38,"smiles":null,"spectrum_id":"CCMSLIB00017213904","spectrum_index":3347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Glutamic acid, dimethyl ester (delta mass: 70.1143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.206,"smiles":null,"spectrum_id":"CCMSLIB00017213908","spectrum_index":3348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"adenosine 3',5'-bisphosphate CollisionEnergy:102040\"\" (delta mass: 192.0603 Da; putative annotation: N/A; putative formula: C11H12OS)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.097,"smiles":null,"spectrum_id":"CCMSLIB00017213909","spectrum_index":3349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 358.2907 Da; putative annotation: N/A; putative formula: C21H42O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.496,"smiles":null,"spectrum_id":"CCMSLIB00017213910","spectrum_index":3350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 198.0727 Da; putative annotation: N/A; putative formula: C10H16P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.175,"smiles":null,"spectrum_id":"CCMSLIB00017213911","spectrum_index":3351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 93.9812 Da; putative annotation: N/A; putative formula: CH3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.266,"smiles":null,"spectrum_id":"CCMSLIB00017213912","spectrum_index":3352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Colubrinic acid (delta mass: 112.0673 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.414,"smiles":null,"spectrum_id":"CCMSLIB00017213913","spectrum_index":3353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S)-2-[[(1S)-1-Carboxy-3-methylbutyl]carbamoylamino]glutaric acid (delta mass: 67.0787 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.213,"smiles":null,"spectrum_id":"CCMSLIB00017213916","spectrum_index":3354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Cholesterol from NIST14 (delta mass: 302.2244 Da; putative annotation: N/A; putative formula: C20H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.586,"smiles":null,"spectrum_id":"CCMSLIB00017213918","spectrum_index":3355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,3aS,6aR)-Hexahydrofuro[2,3-b]furan-3-ol (delta mass: 399.444 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.514,"smiles":null,"spectrum_id":"CCMSLIB00017213919","spectrum_index":3356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017213920","spectrum_index":3357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 248.0567 Da; putative annotation: N/A; putative formula: C10H20O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.226,"smiles":null,"spectrum_id":"CCMSLIB00017213922","spectrum_index":3358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 135.0396 Da; putative annotation: N/A; putative formula: CH5N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.084,"smiles":null,"spectrum_id":"CCMSLIB00017213925","spectrum_index":3359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 73.9459 Da; putative annotation: N/A; putative formula: CH-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.021,"smiles":null,"spectrum_id":"CCMSLIB00017213926","spectrum_index":3360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEPROPIONIC ACID (delta mass: 130.0571 Da; putative annotation: N/A; putative formula: C5H10N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.143,"smiles":null,"spectrum_id":"CCMSLIB00017213927","spectrum_index":3361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 94.1137 Da; putative annotation: N/A; putative formula: C8H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.258,"smiles":null,"spectrum_id":"CCMSLIB00017213929","spectrum_index":3362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 193.0574 Da; putative annotation: N/A; putative formula: C10H13NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.149,"smiles":null,"spectrum_id":"CCMSLIB00017213930","spectrum_index":3363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 483.3114 Da; putative annotation: N/A; putative formula: C26H46NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":836.58,"smiles":null,"spectrum_id":"CCMSLIB00017213933","spectrum_index":3364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 454.2427 Da; putative annotation: N/A; putative formula: C21H34N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.307,"smiles":null,"spectrum_id":"CCMSLIB00017213934","spectrum_index":3365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terminolic acid (delta mass: 112.0664 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.419,"smiles":null,"spectrum_id":"CCMSLIB00017213936","spectrum_index":3366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 731.4893 Da; putative annotation: N/A; putative formula: C42H70NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1084.76,"smiles":null,"spectrum_id":"CCMSLIB00017213937","spectrum_index":3367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maesopsin (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.081,"smiles":null,"spectrum_id":"CCMSLIB00017213938","spectrum_index":3368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Cannabichromene (delta mass: 97.9677 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.2,"smiles":null,"spectrum_id":"CCMSLIB00017213941","spectrum_index":3369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 74.0517 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017213943","spectrum_index":3370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 196.2554 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.315,"smiles":null,"spectrum_id":"CCMSLIB00017213944","spectrum_index":3371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 298.2515 Da; putative annotation: N/A; putative formula: C19H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.468,"smiles":null,"spectrum_id":"CCMSLIB00017213945","spectrum_index":3372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 211.1206 Da; putative annotation: N/A; putative formula: C11H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.275,"smiles":null,"spectrum_id":"CCMSLIB00017213946","spectrum_index":3373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-sn-glycero-3-phosphocholine (delta mass: 284.2042 Da; putative annotation: N/A; putative formula: C14H28N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.544,"smiles":null,"spectrum_id":"CCMSLIB00017213947","spectrum_index":3374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 129.0454 Da; putative annotation: N/A; putative formula: C4H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.111,"smiles":null,"spectrum_id":"CCMSLIB00017213949","spectrum_index":3375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 19.0135 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.261,"smiles":null,"spectrum_id":"CCMSLIB00017213951","spectrum_index":3376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 610.8169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.914,"smiles":null,"spectrum_id":"CCMSLIB00017213953","spectrum_index":3377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026901 5?-CHOLANIC ACID-3?-OL-6_7-DIONE (delta mass: 421.2831 Da; putative annotation: N/A; putative formula: C24H39NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":826.547,"smiles":null,"spectrum_id":"CCMSLIB00017213954","spectrum_index":3378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 924.4246 Da; putative annotation: N/A; putative formula: C53H60N6O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1087.48,"smiles":null,"spectrum_id":"CCMSLIB00017213956","spectrum_index":3379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-deoxyfructosylleucylisoleucine (delta mass: 649.2487 Da; putative annotation: N/A; putative formula: C25H36N11O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1056.49,"smiles":null,"spectrum_id":"CCMSLIB00017213957","spectrum_index":3380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 383.1331 Da; putative annotation: N/A; putative formula: C16H21N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.24,"smiles":null,"spectrum_id":"CCMSLIB00017213960","spectrum_index":3381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 192.0796 Da; putative annotation: N/A; putative formula: C12H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.192,"smiles":null,"spectrum_id":"CCMSLIB00017213961","spectrum_index":3382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 68.0494 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.219,"smiles":null,"spectrum_id":"CCMSLIB00017213963","spectrum_index":3383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 257.0935 Da; putative annotation: N/A; putative formula: C10H16N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.227,"smiles":null,"spectrum_id":"CCMSLIB00017213964","spectrum_index":3384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 231.1111 Da; putative annotation: N/A; putative formula: C10H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.244,"smiles":null,"spectrum_id":"CCMSLIB00017213965","spectrum_index":3385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 103.082 Da; putative annotation: N/A; putative formula: C8H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.21,"smiles":null,"spectrum_id":"CCMSLIB00017213967","spectrum_index":3386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 500.131 Da; putative annotation: N/A; putative formula: C23H28N6O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.286,"smiles":null,"spectrum_id":"CCMSLIB00017213969","spectrum_index":3387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 359.1848 Da; putative annotation: N/A; putative formula: C19H25N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.25,"smiles":null,"spectrum_id":"CCMSLIB00017213971","spectrum_index":3388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 64.0615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.142,"smiles":null,"spectrum_id":"CCMSLIB00017213972","spectrum_index":3389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 42.9911 Da; putative annotation: N/A; putative formula: CHNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.119,"smiles":null,"spectrum_id":"CCMSLIB00017213973","spectrum_index":3390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 74.0731 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.164,"smiles":null,"spectrum_id":"CCMSLIB00017213975","spectrum_index":3391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 221.1623 Da; putative annotation: N/A; putative formula: C11H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.394,"smiles":null,"spectrum_id":"CCMSLIB00017213976","spectrum_index":3392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 235.1784 Da; putative annotation: N/A; putative formula: C6H22N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.426,"smiles":null,"spectrum_id":"CCMSLIB00017213979","spectrum_index":3393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminobenzoic acid - 30.0 eV (delta mass: 71.0028 Da; putative annotation: N/A; putative formula: CH2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.058,"smiles":null,"spectrum_id":"CCMSLIB00017213980","spectrum_index":3394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 49.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.28,"smiles":null,"spectrum_id":"CCMSLIB00017213981","spectrum_index":3395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 137.0454 Da; putative annotation: N/A; putative formula: C3H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.08,"smiles":null,"spectrum_id":"CCMSLIB00017213983","spectrum_index":3396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 108.0887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.16,"smiles":null,"spectrum_id":"CCMSLIB00017213984","spectrum_index":3397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.268,"smiles":null,"spectrum_id":"CCMSLIB00017213986","spectrum_index":3398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 74.0002 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.211,"smiles":null,"spectrum_id":"CCMSLIB00017213988","spectrum_index":3399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (.+/-.)-8-Hydroxy-5Z,9E,11Z,14Z,17Z-eicosapentaenoic acid from NIST14 (delta mass: 18.0099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.237,"smiles":null,"spectrum_id":"CCMSLIB00017213989","spectrum_index":3400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 56.027 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.092,"smiles":null,"spectrum_id":"CCMSLIB00017213991","spectrum_index":3401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 183.0765 Da; putative annotation: N/A; putative formula: C6H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.152,"smiles":null,"spectrum_id":"CCMSLIB00017213992","spectrum_index":3402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 184.0768 Da; putative annotation: N/A; putative formula: C8H13N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.152,"smiles":null,"spectrum_id":"CCMSLIB00017213994","spectrum_index":3403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 132.0422 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.232,"smiles":null,"spectrum_id":"CCMSLIB00017213995","spectrum_index":3404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7,10-Tetraazacyclododecane (delta mass: 82.05 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.226,"smiles":null,"spectrum_id":"CCMSLIB00017213997","spectrum_index":3405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 52.051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.126,"smiles":null,"spectrum_id":"CCMSLIB00017213998","spectrum_index":3406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cannabinol (delta mass: 118.0636 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.264,"smiles":null,"spectrum_id":"CCMSLIB00017213999","spectrum_index":3407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 84.0949 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.317,"smiles":null,"spectrum_id":"CCMSLIB00017214001","spectrum_index":3408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 467.2947 Da; putative annotation: N/A; putative formula: C24H37N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.59,"smiles":null,"spectrum_id":"CCMSLIB00017214002","spectrum_index":3409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 49.0531 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017214004","spectrum_index":3410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sumaresinolic acid (delta mass: 170.1154 Da; putative annotation: N/A; putative formula: C3H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.478,"smiles":null,"spectrum_id":"CCMSLIB00017214006","spectrum_index":3411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.06,"smiles":null,"spectrum_id":"CCMSLIB00017214007","spectrum_index":3412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 101.9956 Da; putative annotation: N/A; putative formula: C3H2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.087,"smiles":null,"spectrum_id":"CCMSLIB00017214008","spectrum_index":3413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Genipin (delta mass: 485.335 Da; putative annotation: N/A; putative formula: C26H47NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.426,"smiles":null,"spectrum_id":"CCMSLIB00017214010","spectrum_index":3414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8(9)-Dehydrocholesterol (delta mass: 46.0068 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.353,"smiles":null,"spectrum_id":"CCMSLIB00017214011","spectrum_index":3415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017214012","spectrum_index":3416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 147.9059 Da; putative annotation: N/A; putative formula: C3HO-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.945,"smiles":null,"spectrum_id":"CCMSLIB00017214013","spectrum_index":3417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 26.0157 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.122,"smiles":null,"spectrum_id":"CCMSLIB00017214015","spectrum_index":3418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 43.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.207,"smiles":null,"spectrum_id":"CCMSLIB00017214016","spectrum_index":3419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 113.0837 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.15,"smiles":null,"spectrum_id":"CCMSLIB00017214018","spectrum_index":3420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 316.1522 Da; putative annotation: N/A; putative formula: C15H24O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.217,"smiles":null,"spectrum_id":"CCMSLIB00017214020","spectrum_index":3421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurane-17,18-dioic acid (delta mass: 60.0359 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.258,"smiles":null,"spectrum_id":"CCMSLIB00017214021","spectrum_index":3422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 49.0536 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.39,"smiles":null,"spectrum_id":"CCMSLIB00017214023","spectrum_index":3423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4,8,12-Trimethylcyclotetradeca-3,7,11-trien-1-yl)propan-2-ol (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.289,"smiles":null,"spectrum_id":"CCMSLIB00017214024","spectrum_index":3424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 74.0519 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.3,"smiles":null,"spectrum_id":"CCMSLIB00017214025","spectrum_index":3425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 130.0881 Da; putative annotation: N/A; putative formula: C9H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.19,"smiles":null,"spectrum_id":"CCMSLIB00017214027","spectrum_index":3426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 137.0691 Da; putative annotation: N/A; putative formula: C5H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.332,"smiles":null,"spectrum_id":"CCMSLIB00017214029","spectrum_index":3427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Keto-1-methyl-3H-imidazo[4,5-b]pyridin-6-yl)benzamide (delta mass: 20.3967 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.5,"smiles":null,"spectrum_id":"CCMSLIB00017214031","spectrum_index":3428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycoursodeoxycholic acid (delta mass: 178.1186 Da; putative annotation: N/A; putative formula: C12H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.44,"smiles":null,"spectrum_id":"CCMSLIB00017214032","spectrum_index":3429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 8.9881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.127,"smiles":null,"spectrum_id":"CCMSLIB00017214033","spectrum_index":3430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 76.0498 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.146,"smiles":null,"spectrum_id":"CCMSLIB00017214034","spectrum_index":3431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 60.0272 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.311,"smiles":null,"spectrum_id":"CCMSLIB00017214035","spectrum_index":3432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 347.2689 Da; putative annotation: N/A; putative formula: C19H33N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.485,"smiles":null,"spectrum_id":"CCMSLIB00017214038","spectrum_index":3433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)ethanol (delta mass: 56.0267 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.16,"smiles":null,"spectrum_id":"CCMSLIB00017214040","spectrum_index":3434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.3,"smiles":null,"spectrum_id":"CCMSLIB00017214041","spectrum_index":3435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1a,1b-Dihomoprostaglandin E1 (delta mass: 78.0828 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.362,"smiles":null,"spectrum_id":"CCMSLIB00017214042","spectrum_index":3436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 158.0579 Da; putative annotation: N/A; putative formula: C7H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.176,"smiles":null,"spectrum_id":"CCMSLIB00017214043","spectrum_index":3437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[(2,5,5,8a-Tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol (delta mass: 64.0679 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017214044","spectrum_index":3438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 126.1044 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017214045","spectrum_index":3439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 11.0161 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.066,"smiles":null,"spectrum_id":"CCMSLIB00017214049","spectrum_index":3440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 126.1039 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017214050","spectrum_index":3441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-nitro- (delta mass: 92.0633 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.223,"smiles":null,"spectrum_id":"CCMSLIB00017214051","spectrum_index":3442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxyamphetamine (delta mass: 54.1196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.263,"smiles":null,"spectrum_id":"CCMSLIB00017214052","spectrum_index":3443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 80.0627 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017214053","spectrum_index":3444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Acetyl-11-keto-.beta.-boswellic acid (delta mass: 40.0496 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.407,"smiles":null,"spectrum_id":"CCMSLIB00017214054","spectrum_index":3445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 475.149 Da; putative annotation: N/A; putative formula: C34H22NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.287,"smiles":null,"spectrum_id":"CCMSLIB00017214055","spectrum_index":3446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Dihydrotestosterone (delta mass: 264.0573 Da; putative annotation: N/A; putative formula: C20H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.289,"smiles":null,"spectrum_id":"CCMSLIB00017214059","spectrum_index":3447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084605 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 71.0368 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.091,"smiles":null,"spectrum_id":"CCMSLIB00017214060","spectrum_index":3448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Lignoceroyl-2-hydroxy-sn-glycero-3-phosphocholine from NIST14 (delta mass: 85.098 Da; putative annotation: N/A; putative formula: C4H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.563,"smiles":null,"spectrum_id":"CCMSLIB00017214061","spectrum_index":3449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 337.1165 Da; putative annotation: N/A; putative formula: C19H20N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.177,"smiles":null,"spectrum_id":"CCMSLIB00017214062","spectrum_index":3450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 38.0222 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.098,"smiles":null,"spectrum_id":"CCMSLIB00017214063","spectrum_index":3451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxy-3,5-dimethoxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 283.2865 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.394,"smiles":null,"spectrum_id":"CCMSLIB00017214064","spectrum_index":3452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 116.0614 Da; putative annotation: N/A; putative formula: C3H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017214066","spectrum_index":3453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 317.1403 Da; putative annotation: N/A; putative formula: C15H20N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.232,"smiles":null,"spectrum_id":"CCMSLIB00017214069","spectrum_index":3454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 254.2224 Da; putative annotation: N/A; putative formula: C12H26N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.34,"smiles":null,"spectrum_id":"CCMSLIB00017214070","spectrum_index":3455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 210.1321 Da; putative annotation: N/A; putative formula: C10H18N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.245,"smiles":null,"spectrum_id":"CCMSLIB00017214071","spectrum_index":3456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 68.0256 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.091,"smiles":null,"spectrum_id":"CCMSLIB00017214072","spectrum_index":3457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 56.0243 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.1,"smiles":null,"spectrum_id":"CCMSLIB00017214074","spectrum_index":3458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 159.1262 Da; putative annotation: N/A; putative formula: C8H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.28,"smiles":null,"spectrum_id":"CCMSLIB00017214075","spectrum_index":3459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 64.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.268,"smiles":null,"spectrum_id":"CCMSLIB00017214076","spectrum_index":3460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 66.0478 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.311,"smiles":null,"spectrum_id":"CCMSLIB00017214079","spectrum_index":3461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 227.1234 Da; putative annotation: Ile-Asn; putative formula: C10H17N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.221,"smiles":null,"spectrum_id":"CCMSLIB00017214080","spectrum_index":3462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-5Z,8Z,11Z,13E,17Z-eicosapentaenoic acid (delta mass: 332.2712 Da; putative annotation: 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate; putative formula: C22H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.498,"smiles":null,"spectrum_id":"CCMSLIB00017214082","spectrum_index":3463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 410.286 Da; putative annotation: Neoruscogenin; putative formula: C27H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1077.52,"smiles":null,"spectrum_id":"CCMSLIB00017214083","spectrum_index":3464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 292.2397 Da; putative annotation: 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.482,"smiles":null,"spectrum_id":"CCMSLIB00017214084","spectrum_index":3465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 600.5079 Da; putative annotation: 1-Oleoyl-2-linoleoyl-rac-glycerol; putative formula: C39H68O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.735,"smiles":null,"spectrum_id":"CCMSLIB00017214086","spectrum_index":3466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 264.2438 Da; putative annotation: cis-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.502,"smiles":null,"spectrum_id":"CCMSLIB00017214088","spectrum_index":3467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mannitol (delta mass: 260.2136 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.3,"smiles":null,"spectrum_id":"CCMSLIB00017214090","spectrum_index":3468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 244.1302 Da; putative annotation: 9-(2,3-Dihydroxypropoxy)-9-oxononanoic acid; putative formula: C12H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.352,"smiles":null,"spectrum_id":"CCMSLIB00017214091","spectrum_index":3469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzenemethanol (delta mass: 187.1214 Da; putative annotation: Massbank:LU085106 Panthenol; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.202,"smiles":null,"spectrum_id":"CCMSLIB00017214092","spectrum_index":3470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 302.1892 Da; putative annotation: 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE; putative formula: C19H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.4,"smiles":null,"spectrum_id":"CCMSLIB00017214093","spectrum_index":3471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 112.0527 Da; putative annotation: (4E)-3-Hydroxyhex-4-enoic acid; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017214095","spectrum_index":3472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 343.2533 Da; putative annotation: Arachidonoylglycine; putative formula: C22H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.496,"smiles":null,"spectrum_id":"CCMSLIB00017214097","spectrum_index":3473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxycholesterol (delta mass: 184.1093 Da; putative annotation: Methyl hydrogen azelate; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.466,"smiles":null,"spectrum_id":"CCMSLIB00017214099","spectrum_index":3474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 316.24 Da; putative annotation: 5.beta.-Pregnane-3.alpha.,17-diol-20-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.364,"smiles":null,"spectrum_id":"CCMSLIB00017214100","spectrum_index":3475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxybenzoic acid (delta mass: 218.0941 Da; putative annotation: 1-(3-Hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl)ethanone; putative formula: C13H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.159,"smiles":null,"spectrum_id":"CCMSLIB00017214101","spectrum_index":3476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentianose (delta mass: 412.2974 Da; putative annotation: ruscogenin; putative formula: C27H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":917.474,"smiles":null,"spectrum_id":"CCMSLIB00017214102","spectrum_index":3477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 100.0525 Da; putative annotation: 2-HYDROXY-2-METHYLBUTYRIC ACID; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.144,"smiles":null,"spectrum_id":"CCMSLIB00017214104","spectrum_index":3478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 177.1155 Da; putative annotation: 2,5-Dimethoxy-4-methylphenethylamine; putative formula: C11H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.191,"smiles":null,"spectrum_id":"CCMSLIB00017214106","spectrum_index":3479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 221.1416 Da; putative annotation: Albuterol; putative formula: C13H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.206,"smiles":null,"spectrum_id":"CCMSLIB00017214108","spectrum_index":3480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 144.0929 Da; putative annotation: 4-Penten-1-ol, 5-phenyl-, (4E)-; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.445,"smiles":null,"spectrum_id":"CCMSLIB00017214109","spectrum_index":3481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 267.2571 Da; putative annotation: Heptadecasphing-4-enine; putative formula: C17H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.771,"smiles":null,"spectrum_id":"CCMSLIB00017214110","spectrum_index":3482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 375.2763 Da; putative annotation: Ser-C20:3; putative formula: C23H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.508,"smiles":null,"spectrum_id":"CCMSLIB00017214111","spectrum_index":3483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 281.2704 Da; putative annotation: D-erythro-N-stearoylsphingosine; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.518,"smiles":null,"spectrum_id":"CCMSLIB00017214113","spectrum_index":3484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 421.3042 Da; putative annotation: N-Arachidonoyldopamine; putative formula: C28H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.52,"smiles":null,"spectrum_id":"CCMSLIB00017214114","spectrum_index":3485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 89.0265 Da; putative annotation: N/A; putative formula: C6H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017214116","spectrum_index":3486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 159.1255 Da; putative annotation: N/A; putative formula: C8H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.212,"smiles":null,"spectrum_id":"CCMSLIB00017214118","spectrum_index":3487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 67.0267 Da; putative annotation: N/A; putative formula: CHN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.394,"smiles":null,"spectrum_id":"CCMSLIB00017214119","spectrum_index":3488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 110.0366 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.102,"smiles":null,"spectrum_id":"CCMSLIB00017214121","spectrum_index":3489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Glu-Lys (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.198,"smiles":null,"spectrum_id":"CCMSLIB00017214122","spectrum_index":3490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8(9)-Dehydrocholesterol (delta mass: 256.24 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.586,"smiles":null,"spectrum_id":"CCMSLIB00017214124","spectrum_index":3491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 198.1622 Da; putative annotation: N/A; putative formula: C12H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.28,"smiles":null,"spectrum_id":"CCMSLIB00017214126","spectrum_index":3492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 162.0521 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.158,"smiles":null,"spectrum_id":"CCMSLIB00017214127","spectrum_index":3493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 45.0299 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.158,"smiles":null,"spectrum_id":"CCMSLIB00017214129","spectrum_index":3494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 832.1133 Da; putative annotation: N/A; putative formula: C26H31N10O16P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.185,"smiles":null,"spectrum_id":"CCMSLIB00017214130","spectrum_index":3495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 193.0739 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.171,"smiles":null,"spectrum_id":"CCMSLIB00017214131","spectrum_index":3496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4-dihydroxybenzoic acid CollisionEnergy:102040\"\" (delta mass: 5.0112 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.045,"smiles":null,"spectrum_id":"CCMSLIB00017214133","spectrum_index":3497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 157.1101 Da; putative annotation: N/A; putative formula: C8H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.202,"smiles":null,"spectrum_id":"CCMSLIB00017214134","spectrum_index":3498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 21.9768 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.099,"smiles":null,"spectrum_id":"CCMSLIB00017214137","spectrum_index":3499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 70.0422 Da; putative annotation: N/A; putative formula: C4H6O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.113,"smiles":null,"spectrum_id":"CCMSLIB00017214138","spectrum_index":3500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 102.0656 Da; putative annotation: N/A; putative formula: CH6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.251,"smiles":null,"spectrum_id":"CCMSLIB00017214139","spectrum_index":3501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 244.2194 Da; putative annotation: N/A; putative formula: C18H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.306,"smiles":null,"spectrum_id":"CCMSLIB00017214140","spectrum_index":3502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminobenzoic acid (delta mass: 16.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.086,"smiles":null,"spectrum_id":"CCMSLIB00017214141","spectrum_index":3503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 138.074 Da; putative annotation: N/A; putative formula: C3H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.201,"smiles":null,"spectrum_id":"CCMSLIB00017214143","spectrum_index":3504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 92.0646 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.438,"smiles":null,"spectrum_id":"CCMSLIB00017214146","spectrum_index":3505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 356.2929 Da; putative annotation: N/A; putative formula: C21H40O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.33,"smiles":null,"spectrum_id":"CCMSLIB00017214147","spectrum_index":3506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311056 Glutamylphenylalanine (isomer of 1503) (delta mass: 258.0853 Da; putative annotation: N/A; putative formula: C10H14N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.214,"smiles":null,"spectrum_id":"CCMSLIB00017214148","spectrum_index":3507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 124.0889 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.17,"smiles":null,"spectrum_id":"CCMSLIB00017214149","spectrum_index":3508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 205.0743 Da; putative annotation: N/A; putative formula: C11H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.145,"smiles":null,"spectrum_id":"CCMSLIB00017214150","spectrum_index":3509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 298.0669 Da; putative annotation: N/A; putative formula: C10H14N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.158,"smiles":null,"spectrum_id":"CCMSLIB00017214152","spectrum_index":3510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 442.6803 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.761,"smiles":null,"spectrum_id":"CCMSLIB00017214155","spectrum_index":3511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 476.4585 Da; putative annotation: N/A; putative formula: C32H60O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.54,"smiles":null,"spectrum_id":"CCMSLIB00017214156","spectrum_index":3512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-Ranitidine - 40.0 eV (delta mass: 231.0189 Da; putative annotation: N/A; putative formula: C2H10N5O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.167,"smiles":null,"spectrum_id":"CCMSLIB00017214157","spectrum_index":3513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 40.0677 Da; putative annotation: N/A; putative formula: C4H8O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017214159","spectrum_index":3514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 109.1097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.206,"smiles":null,"spectrum_id":"CCMSLIB00017214160","spectrum_index":3515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 330.2401 Da; putative annotation: N/A; putative formula: C18H34O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.456,"smiles":null,"spectrum_id":"CCMSLIB00017214162","spectrum_index":3516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cercic acid (delta mass: 45.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.407,"smiles":null,"spectrum_id":"CCMSLIB00017214164","spectrum_index":3517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 88.0165 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017214166","spectrum_index":3518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 84.9282 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.014,"smiles":null,"spectrum_id":"CCMSLIB00017214167","spectrum_index":3519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 210.1253 Da; putative annotation: N/A; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.19,"smiles":null,"spectrum_id":"CCMSLIB00017214168","spectrum_index":3520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 568.1781 Da; putative annotation: N/A; putative formula: C20H33N4O13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.217,"smiles":null,"spectrum_id":"CCMSLIB00017214169","spectrum_index":3521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380757-01_C22H28O13_3-[6-({6-O-[(2R,3R,4R)-3,4-Dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranosyl}oxy)-1-benzofuran-5-yl]propanoic acid (delta mass: 78.0152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.175,"smiles":null,"spectrum_id":"CCMSLIB00017214172","spectrum_index":3522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 194.0422 Da; putative annotation: N/A; putative formula: C6H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.123,"smiles":null,"spectrum_id":"CCMSLIB00017214174","spectrum_index":3523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Docosenamide, (Z)- from NIST14 (delta mass: 338.148 Da; putative annotation: N/A; putative formula: C16H22N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.49,"smiles":null,"spectrum_id":"CCMSLIB00017214175","spectrum_index":3524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.305,"smiles":null,"spectrum_id":"CCMSLIB00017214176","spectrum_index":3525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.185,"smiles":null,"spectrum_id":"CCMSLIB00017214177","spectrum_index":3526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 355.2689 Da; putative annotation: N/A; putative formula: C16H33N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.48,"smiles":null,"spectrum_id":"CCMSLIB00017214178","spectrum_index":3527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 188.1049 Da; putative annotation: N/A; putative formula: C9H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.222,"smiles":null,"spectrum_id":"CCMSLIB00017214180","spectrum_index":3528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 42.0616 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.174,"smiles":null,"spectrum_id":"CCMSLIB00017214183","spectrum_index":3529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10(S),17(S)-Dihydroxy-4Z,7Z,11E,13Z,15E,19Z-docosahexaenoic acid (delta mass: 63.0693 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.307,"smiles":null,"spectrum_id":"CCMSLIB00017214184","spectrum_index":3530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 22.9091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.0,"smiles":null,"spectrum_id":"CCMSLIB00017214185","spectrum_index":3531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 126.0686 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.295,"smiles":null,"spectrum_id":"CCMSLIB00017214186","spectrum_index":3532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 554.2826 Da; putative annotation: N/A; putative formula: C24H34N12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":849.509,"smiles":null,"spectrum_id":"CCMSLIB00017214187","spectrum_index":3533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 44.0265 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017214188","spectrum_index":3534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 454.2858 Da; putative annotation: N/A; putative formula: C26H39N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":950.626,"smiles":null,"spectrum_id":"CCMSLIB00017214191","spectrum_index":3535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 227.1273 Da; putative annotation: N/A; putative formula: C10H17N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.304,"smiles":null,"spectrum_id":"CCMSLIB00017214193","spectrum_index":3536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:102040 (delta mass: 182.0024 Da; putative annotation: N/A; putative formula: C10H3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.047,"smiles":null,"spectrum_id":"CCMSLIB00017214194","spectrum_index":3537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 224.2237 Da; putative annotation: N/A; putative formula: C14H28N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.305,"smiles":null,"spectrum_id":"CCMSLIB00017214195","spectrum_index":3538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z-octadecadienoic acid (delta mass: 633.6036 Da; putative annotation: N/A; putative formula: C37H75N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":928.83,"smiles":null,"spectrum_id":"CCMSLIB00017214196","spectrum_index":3539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dioleoyl-sn-glycerol (delta mass: 289.2594 Da; putative annotation: N/A; putative formula: C8H27N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.805,"smiles":null,"spectrum_id":"CCMSLIB00017214197","spectrum_index":3540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 58.0741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.154,"smiles":null,"spectrum_id":"CCMSLIB00017214199","spectrum_index":3541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 665.5229 Da; putative annotation: N/A; putative formula: C39H71NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.75,"smiles":null,"spectrum_id":"CCMSLIB00017214202","spectrum_index":3542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 87.057 Da; putative annotation: N/A; putative formula: CH5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.159,"smiles":null,"spectrum_id":"CCMSLIB00017214203","spectrum_index":3543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 40.0161 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.237,"smiles":null,"spectrum_id":"CCMSLIB00017214204","spectrum_index":3544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 278.6976 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":871.973,"smiles":null,"spectrum_id":"CCMSLIB00017214206","spectrum_index":3545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 23.0947 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.186,"smiles":null,"spectrum_id":"CCMSLIB00017214207","spectrum_index":3546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 269.0414 Da; putative annotation: N/A; putative formula: C6H12N3O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.17,"smiles":null,"spectrum_id":"CCMSLIB00017214209","spectrum_index":3547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 224.1052 Da; putative annotation: N/A; putative formula: C7H13N8O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.238,"smiles":null,"spectrum_id":"CCMSLIB00017214211","spectrum_index":3548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Uvaol from NIST14 (delta mass: 76.0716 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.46,"smiles":null,"spectrum_id":"CCMSLIB00017214212","spectrum_index":3549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Epiandrographolide (delta mass: 104.0934 Da; putative annotation: N/A; putative formula: H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.31,"smiles":null,"spectrum_id":"CCMSLIB00017214214","spectrum_index":3550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 63.0638 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.28,"smiles":null,"spectrum_id":"CCMSLIB00017214215","spectrum_index":3551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 24.036 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017214217","spectrum_index":3552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 184.1309 Da; putative annotation: N/A; putative formula: C4H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.498,"smiles":null,"spectrum_id":"CCMSLIB00017214219","spectrum_index":3553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 193.0446 Da; putative annotation: N/A; putative formula: C13H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.12,"smiles":null,"spectrum_id":"CCMSLIB00017214220","spectrum_index":3554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 91.0493 Da; putative annotation: N/A; putative formula: H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.12,"smiles":null,"spectrum_id":"CCMSLIB00017214222","spectrum_index":3555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 216.0424 Da; putative annotation: N/A; putative formula: C12H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.175,"smiles":null,"spectrum_id":"CCMSLIB00017214223","spectrum_index":3556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180458-02_C18H24O12_Cyclopenta[c]pyran-4-carboxylic acid, 7-[(acetyloxy)methyl]-1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxy-, (1S,4aS,5S,7aS)- (delta mass: 234.0527 Da; putative annotation: N/A; putative formula: C12H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.187,"smiles":null,"spectrum_id":"CCMSLIB00017214225","spectrum_index":3557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cortodoxone (delta mass: 321.1422 Da; putative annotation: N/A; putative formula: C13H23NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.364,"smiles":null,"spectrum_id":"CCMSLIB00017214227","spectrum_index":3558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 300.209 Da; putative annotation: N/A; putative formula: C20H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.338,"smiles":null,"spectrum_id":"CCMSLIB00017214229","spectrum_index":3559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 605.268 Da; putative annotation: N/A; putative formula: C40H35N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":811.349,"smiles":null,"spectrum_id":"CCMSLIB00017214230","spectrum_index":3560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 242.1512 Da; putative annotation: N/A; putative formula: C13H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.253,"smiles":null,"spectrum_id":"CCMSLIB00017214231","spectrum_index":3561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 276.0778 Da; putative annotation: N/A; putative formula: C10H16N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.148,"smiles":null,"spectrum_id":"CCMSLIB00017214233","spectrum_index":3562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 77.0846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.306,"smiles":null,"spectrum_id":"CCMSLIB00017214235","spectrum_index":3563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 47.074 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.296,"smiles":null,"spectrum_id":"CCMSLIB00017214237","spectrum_index":3564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopentan-2-ol (delta mass: 23.9496 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.057,"smiles":null,"spectrum_id":"CCMSLIB00017214238","spectrum_index":3565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lanosterol (delta mass: 209.1773 Da; putative annotation: N/A; putative formula: C13H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.571,"smiles":null,"spectrum_id":"CCMSLIB00017214239","spectrum_index":3566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 148.0514 Da; putative annotation: N/A; putative formula: C3H9N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.143,"smiles":null,"spectrum_id":"CCMSLIB00017214241","spectrum_index":3567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 76.0235 Da; putative annotation: N/A; putative formula: H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.126,"smiles":null,"spectrum_id":"CCMSLIB00017214242","spectrum_index":3568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 348.1164 Da; putative annotation: N/A; putative formula: C15H25O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.218,"smiles":null,"spectrum_id":"CCMSLIB00017214244","spectrum_index":3569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"7-hydroxy-3-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)(2H-3,4,5,6 -tetrahydropyran-2-yl)]chromen-4-one CollisionEnergy:102040\"\" (delta mass: 174.054 Da; putative annotation: N/A; putative formula: C8H6N4O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.172,"smiles":null,"spectrum_id":"CCMSLIB00017214245","spectrum_index":3570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 29.9924 Da; putative annotation: N/A; putative formula: CH2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.131,"smiles":null,"spectrum_id":"CCMSLIB00017214247","spectrum_index":3571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 45.014 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.179,"smiles":null,"spectrum_id":"CCMSLIB00017214249","spectrum_index":3572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 613.3456 Da; putative annotation: N/A; putative formula: C44H43N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":794.416,"smiles":null,"spectrum_id":"CCMSLIB00017214251","spectrum_index":3573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lavandulol (delta mass: 449.3877 Da; putative annotation: N/A; putative formula: C29H47N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.531,"smiles":null,"spectrum_id":"CCMSLIB00017214252","spectrum_index":3574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 125.9983 Da; putative annotation: N/A; putative formula: C4H3N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.152,"smiles":null,"spectrum_id":"CCMSLIB00017214253","spectrum_index":3575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 266.0906 Da; putative annotation: N/A; putative formula: C17H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.131,"smiles":null,"spectrum_id":"CCMSLIB00017214254","spectrum_index":3576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,5R,9S,13R,15S)-15-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 332.1066 Da; putative annotation: N/A; putative formula: C14H26N2O-1P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.333,"smiles":null,"spectrum_id":"CCMSLIB00017214255","spectrum_index":3577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 165.2298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.41,"smiles":null,"spectrum_id":"CCMSLIB00017214257","spectrum_index":3578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 370.247 Da; putative annotation: N/A; putative formula: C19H34N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.338,"smiles":null,"spectrum_id":"CCMSLIB00017214260","spectrum_index":3579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid (delta mass: 116.0089 Da; putative annotation: N/A; putative formula: C8H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.163,"smiles":null,"spectrum_id":"CCMSLIB00017214261","spectrum_index":3580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 155.9966 Da; putative annotation: N/A; putative formula: H6N4O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.099,"smiles":null,"spectrum_id":"CCMSLIB00017214262","spectrum_index":3581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-5-one (delta mass: 188.0382 Da; putative annotation: N/A; putative formula: C5H10N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.003,"smiles":null,"spectrum_id":"CCMSLIB00017214263","spectrum_index":3582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-His (delta mass: 98.0353 Da; putative annotation: N/A; putative formula: CH2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.165,"smiles":null,"spectrum_id":"CCMSLIB00017214265","spectrum_index":3583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 42.0465 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.097,"smiles":null,"spectrum_id":"CCMSLIB00017214266","spectrum_index":3584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 51.0094 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.081,"smiles":null,"spectrum_id":"CCMSLIB00017214268","spectrum_index":3585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 282.2501 Da; putative annotation: N/A; putative formula: C17H34N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.55,"smiles":null,"spectrum_id":"CCMSLIB00017214270","spectrum_index":3586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(5-Nitro-1H-indol-3-yl)ethan-1-one (delta mass: 90.0208 Da; putative annotation: N/A; putative formula: C5H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.082,"smiles":null,"spectrum_id":"CCMSLIB00017214271","spectrum_index":3587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Endothal (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.071,"smiles":null,"spectrum_id":"CCMSLIB00017214273","spectrum_index":3588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 232.1834 Da; putative annotation: N/A; putative formula: C16H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.28,"smiles":null,"spectrum_id":"CCMSLIB00017214275","spectrum_index":3589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 131.0397 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.194,"smiles":null,"spectrum_id":"CCMSLIB00017214276","spectrum_index":3590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 26.0534 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.108,"smiles":null,"spectrum_id":"CCMSLIB00017214277","spectrum_index":3591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dihydroxy-5Z,8Z,11Z,17Z-eicosatetraenoic acid (delta mass: 33.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017214278","spectrum_index":3592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026602 5?-CHOLANIC ACID-3?-OL-7_12-DIONE|3-Hydroxy-7,12-diketocholanoic acid|(4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydro-1H-cyclopenta[a (delta mass: 228.1374 Da; putative annotation: N/A; putative formula: C13H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.401,"smiles":null,"spectrum_id":"CCMSLIB00017214279","spectrum_index":3593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naratriptan N-oxide (delta mass: 262.2305 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.399,"smiles":null,"spectrum_id":"CCMSLIB00017214280","spectrum_index":3594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 415.2574 Da; putative annotation: N/A; putative formula: C21H37NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.318,"smiles":null,"spectrum_id":"CCMSLIB00017214282","spectrum_index":3595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.071,"smiles":null,"spectrum_id":"CCMSLIB00017214283","spectrum_index":3596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid (delta mass: 108.0573 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.096,"smiles":null,"spectrum_id":"CCMSLIB00017214286","spectrum_index":3597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 605.5181 Da; putative annotation: N/A; putative formula: C41H67NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.589,"smiles":null,"spectrum_id":"CCMSLIB00017214287","spectrum_index":3598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 238.2293 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.472,"smiles":null,"spectrum_id":"CCMSLIB00017214288","spectrum_index":3599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 114.091 Da; putative annotation: N/A; putative formula: C4H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.38,"smiles":null,"spectrum_id":"CCMSLIB00017214290","spectrum_index":3600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 162.0369 Da; putative annotation: N/A; putative formula: C7H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.113,"smiles":null,"spectrum_id":"CCMSLIB00017214291","spectrum_index":3601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(1H-Benzimidazol-2-yl)-4-fluorobenzamide (delta mass: 120.0519 Da; putative annotation: N/A; putative formula: C3H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.14,"smiles":null,"spectrum_id":"CCMSLIB00017214293","spectrum_index":3602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 72.0479 Da; putative annotation: N/A; putative formula: C4H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017214295","spectrum_index":3603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 53.0259 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.154,"smiles":null,"spectrum_id":"CCMSLIB00017214297","spectrum_index":3604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 131.0477 Da; putative annotation: N/A; putative formula: C7H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.108,"smiles":null,"spectrum_id":"CCMSLIB00017214298","spectrum_index":3605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12-Ketodeoxycholic acid from NIST14 (delta mass: 1075.4345 Da; putative annotation: N/A; putative formula: C68H61N5O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1466.72,"smiles":null,"spectrum_id":"CCMSLIB00017214299","spectrum_index":3606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brassicasterol (delta mass: 164.9756 Da; putative annotation: N/A; putative formula: C2H4N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.338,"smiles":null,"spectrum_id":"CCMSLIB00017214300","spectrum_index":3607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 135.1849 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.276,"smiles":null,"spectrum_id":"CCMSLIB00017214303","spectrum_index":3608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxocholesterol (delta mass: 274.1929 Da; putative annotation: N/A; putative formula: C18H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.534,"smiles":null,"spectrum_id":"CCMSLIB00017214305","spectrum_index":3609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 25.0311 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.122,"smiles":null,"spectrum_id":"CCMSLIB00017214306","spectrum_index":3610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetonitrile (delta mass: 1.887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.963,"smiles":null,"spectrum_id":"CCMSLIB00017214307","spectrum_index":3611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 10.8846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.976,"smiles":null,"spectrum_id":"CCMSLIB00017214308","spectrum_index":3612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C20:5 (delta mass: 90.0472 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.301,"smiles":null,"spectrum_id":"CCMSLIB00017214309","spectrum_index":3613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z-octadecadienoic acid (delta mass: 550.4967 Da; putative annotation: N/A; putative formula: C35H66O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":845.724,"smiles":null,"spectrum_id":"CCMSLIB00017214310","spectrum_index":3614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 510.2836 Da; putative annotation: N/A; putative formula: C20H42N6O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":787.5,"smiles":null,"spectrum_id":"CCMSLIB00017214313","spectrum_index":3615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Obeticholic_Acid_NCE45 (delta mass: 64.0684 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.4,"smiles":null,"spectrum_id":"CCMSLIB00017214315","spectrum_index":3616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 134.058 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.097,"smiles":null,"spectrum_id":"CCMSLIB00017214316","spectrum_index":3617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 58.0319 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.15,"smiles":null,"spectrum_id":"CCMSLIB00017214317","spectrum_index":3618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 35.9198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.985,"smiles":null,"spectrum_id":"CCMSLIB00017214318","spectrum_index":3619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 278.2982 Da; putative annotation: N/A; putative formula: C20H38)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.569,"smiles":null,"spectrum_id":"CCMSLIB00017214319","spectrum_index":3620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 328.2972 Da; putative annotation: N/A; putative formula: C20H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.56,"smiles":null,"spectrum_id":"CCMSLIB00017214320","spectrum_index":3621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 473.3736 Da; putative annotation: N/A; putative formula: C27H47N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.444,"smiles":null,"spectrum_id":"CCMSLIB00017214324","spectrum_index":3622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 257.1627 Da; putative annotation: N/A; putative formula: C13H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.254,"smiles":null,"spectrum_id":"CCMSLIB00017214325","spectrum_index":3623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 359.1422 Da; putative annotation: N/A; putative formula: C25H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.374,"smiles":null,"spectrum_id":"CCMSLIB00017214326","spectrum_index":3624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ADENOSINE (delta mass: 156.1153 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.219,"smiles":null,"spectrum_id":"CCMSLIB00017214327","spectrum_index":3625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitoleoyl ethanolamide (delta mass: 235.2541 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.528,"smiles":null,"spectrum_id":"CCMSLIB00017214328","spectrum_index":3626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxypimara-8(14),15-dien-18-oic acid (delta mass: 78.084 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.311,"smiles":null,"spectrum_id":"CCMSLIB00017214329","spectrum_index":3627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methylquinoline-2-carboxylic acid CollisionEnergy:205060 (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.081,"smiles":null,"spectrum_id":"CCMSLIB00017214332","spectrum_index":3628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Syringic acid from NIST14 (delta mass: 45.094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.154,"smiles":null,"spectrum_id":"CCMSLIB00017214334","spectrum_index":3629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 46.0046 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.21,"smiles":null,"spectrum_id":"CCMSLIB00017214335","spectrum_index":3630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,6,6-Tetramethyl-4-piperidinyl 2-methylacrylate (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.186,"smiles":null,"spectrum_id":"CCMSLIB00017214336","spectrum_index":3631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 26,27-Dinorcholest-5-en-24-yne-3,20-diol, (3.beta.)- (delta mass: 178.1146 Da; putative annotation: N/A; putative formula: C15H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.409,"smiles":null,"spectrum_id":"CCMSLIB00017214337","spectrum_index":3632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,9(11),12,24-tetraen-26-oic acid (delta mass: 126.0793 Da; putative annotation: N/A; putative formula: C6H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.4,"smiles":null,"spectrum_id":"CCMSLIB00017214339","spectrum_index":3633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 443.1628 Da; putative annotation: N/A; putative formula: C21H25N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.286,"smiles":null,"spectrum_id":"CCMSLIB00017214340","spectrum_index":3634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 12-hydroxystearate (delta mass: 537.5092 Da; putative annotation: N/A; putative formula: C30H63N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":852.799,"smiles":null,"spectrum_id":"CCMSLIB00017214343","spectrum_index":3635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000480 Dopamine|4-(2-aminoethyl)benzene-1,2-diol (delta mass: 192.0779 Da; putative annotation: N/A; putative formula: C5H13N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.164,"smiles":null,"spectrum_id":"CCMSLIB00017214344","spectrum_index":3636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Pro from NIST14 (delta mass: 97.0474 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.15,"smiles":null,"spectrum_id":"CCMSLIB00017214345","spectrum_index":3637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-trans-Pinocarveol (delta mass: 64.0026 Da; putative annotation: N/A; putative formula: C3N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.13,"smiles":null,"spectrum_id":"CCMSLIB00017214346","spectrum_index":3638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 631.5175 Da; putative annotation: N/A; putative formula: C39H69NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":908.734,"smiles":null,"spectrum_id":"CCMSLIB00017214348","spectrum_index":3639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.154,"smiles":null,"spectrum_id":"CCMSLIB00017214350","spectrum_index":3640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004503 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 16.9965 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.093,"smiles":null,"spectrum_id":"CCMSLIB00017214352","spectrum_index":3641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 314.1516 Da; putative annotation: N/A; putative formula: C19H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.248,"smiles":null,"spectrum_id":"CCMSLIB00017214353","spectrum_index":3642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chorismic acid (delta mass: 81.0581 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.113,"smiles":null,"spectrum_id":"CCMSLIB00017214355","spectrum_index":3643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 114.083 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.31,"smiles":null,"spectrum_id":"CCMSLIB00017214356","spectrum_index":3644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carboxylic acid, ethyl ester (delta mass: 45.0209 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.107,"smiles":null,"spectrum_id":"CCMSLIB00017214358","spectrum_index":3645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 114.032 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.118,"smiles":null,"spectrum_id":"CCMSLIB00017214360","spectrum_index":3646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 150.0683 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.118,"smiles":null,"spectrum_id":"CCMSLIB00017214362","spectrum_index":3647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 272.2047 Da; putative annotation: N/A; putative formula: C19H29O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.344,"smiles":null,"spectrum_id":"CCMSLIB00017214363","spectrum_index":3648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 178.0642 Da; putative annotation: N/A; putative formula: C11H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.151,"smiles":null,"spectrum_id":"CCMSLIB00017214364","spectrum_index":3649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-4,10-Dimethylidene-7-propan-2-ylcyclodec-5-en-1-ol (delta mass: 63.9977 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.188,"smiles":null,"spectrum_id":"CCMSLIB00017214365","spectrum_index":3650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 25.9739 Da; putative annotation: N/A; putative formula: C14H19N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.144,"smiles":null,"spectrum_id":"CCMSLIB00017214367","spectrum_index":3651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Chloroacetyl)-3-piperidinecarboxamide (delta mass: 16.9934 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.067,"smiles":null,"spectrum_id":"CCMSLIB00017214370","spectrum_index":3652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100300 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole (delta mass: 169.0905 Da; putative annotation: N/A; putative formula: C12H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.138,"smiles":null,"spectrum_id":"CCMSLIB00017214371","spectrum_index":3653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxybenzoic acid;Veratric acid (delta mass: 39.0308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.096,"smiles":null,"spectrum_id":"CCMSLIB00017214372","spectrum_index":3654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 781.3432 Da; putative annotation: N/A; putative formula: C41H55N3O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1040.45,"smiles":null,"spectrum_id":"CCMSLIB00017214373","spectrum_index":3655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 44.0264 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017214375","spectrum_index":3656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Trp (delta mass: 281.1388 Da; putative annotation: N/A; putative formula: C14H15N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.289,"smiles":null,"spectrum_id":"CCMSLIB00017214378","spectrum_index":3657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 85.0626 Da; putative annotation: N/A; putative formula: C3H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.15,"smiles":null,"spectrum_id":"CCMSLIB00017214379","spectrum_index":3658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 47.0086 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.086,"smiles":null,"spectrum_id":"CCMSLIB00017214380","spectrum_index":3659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 556.3278 Da; putative annotation: N/A; putative formula: C28H49N2O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.445,"smiles":null,"spectrum_id":"CCMSLIB00017214381","spectrum_index":3660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 458.2551 Da; putative annotation: N/A; putative formula: C22H39N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.373,"smiles":null,"spectrum_id":"CCMSLIB00017214383","spectrum_index":3661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"9-acetyl-17-hydroxy-10,14-dimethyl-20-oxahexacyclo[11.9.0.0<2,10>.0<4,9>.0<14, 19>.0<19,21>]docosane CollisionEnergy:205060\"\" (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.299,"smiles":null,"spectrum_id":"CCMSLIB00017214385","spectrum_index":3662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Gly-Lys (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.177,"smiles":null,"spectrum_id":"CCMSLIB00017214387","spectrum_index":3663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 523.2568 Da; putative annotation: N/A; putative formula: C25H42N5OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.333,"smiles":null,"spectrum_id":"CCMSLIB00017214388","spectrum_index":3664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 42.9384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.025,"smiles":null,"spectrum_id":"CCMSLIB00017214389","spectrum_index":3665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 95.0558 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.147,"smiles":null,"spectrum_id":"CCMSLIB00017214390","spectrum_index":3666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 50.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.118,"smiles":null,"spectrum_id":"CCMSLIB00017214392","spectrum_index":3667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 106.0631 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.133,"smiles":null,"spectrum_id":"CCMSLIB00017214394","spectrum_index":3668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-(2,3-Dihydroxypropoxy)-9-oxononanoic acid (delta mass: 134.0724 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.221,"smiles":null,"spectrum_id":"CCMSLIB00017214396","spectrum_index":3669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 162.0522 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.196,"smiles":null,"spectrum_id":"CCMSLIB00017214397","spectrum_index":3670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 559.4217 Da; putative annotation: N/A; putative formula: C38H57NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.492,"smiles":null,"spectrum_id":"CCMSLIB00017214398","spectrum_index":3671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 59.0375 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.405,"smiles":null,"spectrum_id":"CCMSLIB00017214399","spectrum_index":3672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 259.0959 Da; putative annotation: N/A; putative formula: C13H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.182,"smiles":null,"spectrum_id":"CCMSLIB00017214402","spectrum_index":3673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 678.373 Da; putative annotation: N/A; putative formula: C35H54N2O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":905.477,"smiles":null,"spectrum_id":"CCMSLIB00017214403","spectrum_index":3674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 735.395 Da; putative annotation: N/A; putative formula: C38H61N3O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":962.499,"smiles":null,"spectrum_id":"CCMSLIB00017214404","spectrum_index":3675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 17.0348 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.077,"smiles":null,"spectrum_id":"CCMSLIB00017214405","spectrum_index":3676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole_3_butyric_acid (delta mass: 99.0324 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017214406","spectrum_index":3677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-(-)-Nopol CollisionEnergy:102040 (delta mass: 249.1574 Da; putative annotation: N/A; putative formula: C11H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.3,"smiles":null,"spectrum_id":"CCMSLIB00017214407","spectrum_index":3678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.07,"smiles":null,"spectrum_id":"CCMSLIB00017214408","spectrum_index":3679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 93.0509 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.152,"smiles":null,"spectrum_id":"CCMSLIB00017214412","spectrum_index":3680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 58.0411 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.101,"smiles":null,"spectrum_id":"CCMSLIB00017214413","spectrum_index":3681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR)-6-Hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 193.0594 Da; putative annotation: N/A; putative formula: C7H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.286,"smiles":null,"spectrum_id":"CCMSLIB00017214414","spectrum_index":3682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 307.1279 Da; putative annotation: N/A; putative formula: C13H17N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.251,"smiles":null,"spectrum_id":"CCMSLIB00017214415","spectrum_index":3683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 265.1303 Da; putative annotation: N/A; putative formula: C14H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.307,"smiles":null,"spectrum_id":"CCMSLIB00017214416","spectrum_index":3684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 76.0667 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.309,"smiles":null,"spectrum_id":"CCMSLIB00017214417","spectrum_index":3685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2,3-dimethyl-1H-indole (delta mass: 162.0568 Da; putative annotation: N/A; putative formula: C4H10N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.114,"smiles":null,"spectrum_id":"CCMSLIB00017214419","spectrum_index":3686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Thienyl)-1H-imidazole (delta mass: 14.0223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.055,"smiles":null,"spectrum_id":"CCMSLIB00017214422","spectrum_index":3687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cumanin (delta mass: 13.9806 Da; putative annotation: N/A; putative formula: H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.14,"smiles":null,"spectrum_id":"CCMSLIB00017214423","spectrum_index":3688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caulophyllogenin (delta mass: 76.0684 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.426,"smiles":null,"spectrum_id":"CCMSLIB00017214424","spectrum_index":3689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.113,"smiles":null,"spectrum_id":"CCMSLIB00017214425","spectrum_index":3690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 19.0136 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.073,"smiles":null,"spectrum_id":"CCMSLIB00017214426","spectrum_index":3691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 40.0314 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.268,"smiles":null,"spectrum_id":"CCMSLIB00017214427","spectrum_index":3692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 150.0329 Da; putative annotation: N/A; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.087,"smiles":null,"spectrum_id":"CCMSLIB00017214430","spectrum_index":3693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01040 Hexahydrocurcumin (delta mass: 193.0592 Da; putative annotation: N/A; putative formula: C7H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.239,"smiles":null,"spectrum_id":"CCMSLIB00017214432","spectrum_index":3694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyclohexylmethyl)proline (delta mass: 32.0627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.227,"smiles":null,"spectrum_id":"CCMSLIB00017214433","spectrum_index":3695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(2-methoxybenzyl)ethanamine (delta mass: 99.0527 Da; putative annotation: N/A; putative formula: C2H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.197,"smiles":null,"spectrum_id":"CCMSLIB00017214434","spectrum_index":3696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 167.0945 Da; putative annotation: N/A; putative formula: C9H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.191,"smiles":null,"spectrum_id":"CCMSLIB00017214435","spectrum_index":3697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 307.2155 Da; putative annotation: N/A; putative formula: C19H25N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.307,"smiles":null,"spectrum_id":"CCMSLIB00017214436","spectrum_index":3698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 439.2433 Da; putative annotation: N/A; putative formula: C20H33N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.33,"smiles":null,"spectrum_id":"CCMSLIB00017214439","spectrum_index":3699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 86.0347 Da; putative annotation: N/A; putative formula: H2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.079,"smiles":null,"spectrum_id":"CCMSLIB00017214440","spectrum_index":3700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 531.4139 Da; putative annotation: N/A; putative formula: C29H57NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.485,"smiles":null,"spectrum_id":"CCMSLIB00017214442","spectrum_index":3701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 229.0831 Da; putative annotation: N/A; putative formula: C8H7N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.17,"smiles":null,"spectrum_id":"CCMSLIB00017214443","spectrum_index":3702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 211.9776 Da; putative annotation: N/A; putative formula: C8H4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.137,"smiles":null,"spectrum_id":"CCMSLIB00017214444","spectrum_index":3703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 167.0587 Da; putative annotation: N/A; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.187,"smiles":null,"spectrum_id":"CCMSLIB00017214447","spectrum_index":3704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 298.2508 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.483,"smiles":null,"spectrum_id":"CCMSLIB00017214448","spectrum_index":3705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-alpha-D-glucosamine - 40.0 eV (delta mass: 395.0362 Da; putative annotation: N/A; putative formula: C22H9N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.133,"smiles":null,"spectrum_id":"CCMSLIB00017214450","spectrum_index":3706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cysmethynil (delta mass: 44.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.317,"smiles":null,"spectrum_id":"CCMSLIB00017214451","spectrum_index":3707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 98.037 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.321,"smiles":null,"spectrum_id":"CCMSLIB00017214452","spectrum_index":3708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 63.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.112,"smiles":null,"spectrum_id":"CCMSLIB00017214454","spectrum_index":3709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 305.3024 Da; putative annotation: N/A; putative formula: C21H39N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.378,"smiles":null,"spectrum_id":"CCMSLIB00017214457","spectrum_index":3710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 597.4086 Da; putative annotation: N/A; putative formula: C29H59NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.448,"smiles":null,"spectrum_id":"CCMSLIB00017214458","spectrum_index":3711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 518.3451 Da; putative annotation: N/A; putative formula: C25H38N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.405,"smiles":null,"spectrum_id":"CCMSLIB00017214459","spectrum_index":3712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 81.0786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.305,"smiles":null,"spectrum_id":"CCMSLIB00017214460","spectrum_index":3713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthro[3,2-b]furan-9(1H)-one, 2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro-6,10a-dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl- (delta mass: 62.0522 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.269,"smiles":null,"spectrum_id":"CCMSLIB00017214462","spectrum_index":3714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017214464","spectrum_index":3715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 98.0728 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.159,"smiles":null,"spectrum_id":"CCMSLIB00017214466","spectrum_index":3716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 226.1325 Da; putative annotation: N/A; putative formula: C12H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.234,"smiles":null,"spectrum_id":"CCMSLIB00017214467","spectrum_index":3717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid (delta mass: 70.0779 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.325,"smiles":null,"spectrum_id":"CCMSLIB00017214468","spectrum_index":3718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 69.0294 Da; putative annotation: N/A; putative formula: C2H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.107,"smiles":null,"spectrum_id":"CCMSLIB00017214469","spectrum_index":3719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 17.9987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017214472","spectrum_index":3720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Dropropizine (delta mass: 53.0282 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.188,"smiles":null,"spectrum_id":"CCMSLIB00017214474","spectrum_index":3721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 39.9903 Da; putative annotation: N/A; putative formula: C2HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.05,"smiles":null,"spectrum_id":"CCMSLIB00017214475","spectrum_index":3722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 44.8137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.9,"smiles":null,"spectrum_id":"CCMSLIB00017214476","spectrum_index":3723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 99.0681 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017214477","spectrum_index":3724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ginsenoside F1 (delta mass: 116.0619 Da; putative annotation: N/A; putative formula: C3H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.509,"smiles":null,"spectrum_id":"CCMSLIB00017214479","spectrum_index":3725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 128.0112 Da; putative annotation: N/A; putative formula: C5H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.129,"smiles":null,"spectrum_id":"CCMSLIB00017214480","spectrum_index":3726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 74.0365 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.206,"smiles":null,"spectrum_id":"CCMSLIB00017214483","spectrum_index":3727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine - 40.0 eV (delta mass: 62.0181 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.12,"smiles":null,"spectrum_id":"CCMSLIB00017214484","spectrum_index":3728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 425.1413 Da; putative annotation: N/A; putative formula: C30H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.37,"smiles":null,"spectrum_id":"CCMSLIB00017214485","spectrum_index":3729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 110.0577 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.347,"smiles":null,"spectrum_id":"CCMSLIB00017214486","spectrum_index":3730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 51.9948 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.081,"smiles":null,"spectrum_id":"CCMSLIB00017214488","spectrum_index":3731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 263.4028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.5,"smiles":null,"spectrum_id":"CCMSLIB00017214490","spectrum_index":3732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 162.0532 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.254,"smiles":null,"spectrum_id":"CCMSLIB00017214492","spectrum_index":3733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 209.1045 Da; putative annotation: N/A; putative formula: C11H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.175,"smiles":null,"spectrum_id":"CCMSLIB00017214493","spectrum_index":3734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 508.3242 Da; putative annotation: N/A; putative formula: C38H40N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.363,"smiles":null,"spectrum_id":"CCMSLIB00017214495","spectrum_index":3735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 31.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.289,"smiles":null,"spectrum_id":"CCMSLIB00017214496","spectrum_index":3736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 467.1312 Da; putative annotation: N/A; putative formula: C20H21N9OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.179,"smiles":null,"spectrum_id":"CCMSLIB00017214497","spectrum_index":3737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 80.0625 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017214500","spectrum_index":3738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 80.0666 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.21,"smiles":null,"spectrum_id":"CCMSLIB00017214501","spectrum_index":3739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 100.0886 Da; putative annotation: N/A; putative formula: C6H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017214503","spectrum_index":3740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C5:0 (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.17,"smiles":null,"spectrum_id":"CCMSLIB00017214504","spectrum_index":3741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Dimethylamino-6-hydroxypurine (delta mass: 134.0024 Da; putative annotation: N/A; putative formula: H4N6O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.09,"smiles":null,"spectrum_id":"CCMSLIB00017214505","spectrum_index":3742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 94.0406 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.142,"smiles":null,"spectrum_id":"CCMSLIB00017214508","spectrum_index":3743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurenoic acid (delta mass: 104.0603 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.292,"smiles":null,"spectrum_id":"CCMSLIB00017214510","spectrum_index":3744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 325.014 Da; putative annotation: N/A; putative formula: C16H8NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.138,"smiles":null,"spectrum_id":"CCMSLIB00017214511","spectrum_index":3745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 621.4906 Da; putative annotation: N/A; putative formula: C44H63NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":807.562,"smiles":null,"spectrum_id":"CCMSLIB00017214512","spectrum_index":3746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ser (delta mass: 168.0535 Da; putative annotation: N/A; putative formula: C7H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.156,"smiles":null,"spectrum_id":"CCMSLIB00017214513","spectrum_index":3747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 285.1213 Da; putative annotation: N/A; putative formula: C13H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.192,"smiles":null,"spectrum_id":"CCMSLIB00017214515","spectrum_index":3748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.248,"smiles":null,"spectrum_id":"CCMSLIB00017214518","spectrum_index":3749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-methoxybenzoic acid (delta mass: 162.0681 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.118,"smiles":null,"spectrum_id":"CCMSLIB00017214519","spectrum_index":3750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Leu (delta mass: 230.0594 Da; putative annotation: N/A; putative formula: C14H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.23,"smiles":null,"spectrum_id":"CCMSLIB00017214520","spectrum_index":3751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Traumatic Acid - 40.0 eV (delta mass: 23.9998 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017214521","spectrum_index":3752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 70.0782 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017214522","spectrum_index":3753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxy-8Z,11Z,14Z-eicosatrienoic acid, 1,5-lactone (delta mass: 54.0319 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.274,"smiles":null,"spectrum_id":"CCMSLIB00017214524","spectrum_index":3754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 300.1507 Da; putative annotation: N/A; putative formula: C14H24N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.513,"smiles":null,"spectrum_id":"CCMSLIB00017214526","spectrum_index":3755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 159.5874 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.706,"smiles":null,"spectrum_id":"CCMSLIB00017214528","spectrum_index":3756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.165,"smiles":null,"spectrum_id":"CCMSLIB00017214529","spectrum_index":3757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline (delta mass: 73.0167 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.077,"smiles":null,"spectrum_id":"CCMSLIB00017214530","spectrum_index":3758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 28.9922 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.04,"smiles":null,"spectrum_id":"CCMSLIB00017214532","spectrum_index":3759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 126.1044 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.233,"smiles":null,"spectrum_id":"CCMSLIB00017214533","spectrum_index":3760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 145.0739 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.139,"smiles":null,"spectrum_id":"CCMSLIB00017214536","spectrum_index":3761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 187.1568 Da; putative annotation: N/A; putative formula: C10H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.415,"smiles":null,"spectrum_id":"CCMSLIB00017214537","spectrum_index":3762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 479.186 Da; putative annotation: N/A; putative formula: C30H21N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.402,"smiles":null,"spectrum_id":"CCMSLIB00017214538","spectrum_index":3763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 108.1043 Da; putative annotation: N/A; putative formula: C7H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.191,"smiles":null,"spectrum_id":"CCMSLIB00017214540","spectrum_index":3764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 594.1381 Da; putative annotation: N/A; putative formula: C23H26N6O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.198,"smiles":null,"spectrum_id":"CCMSLIB00017214541","spectrum_index":3765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 635.9199 Da; putative annotation: N/A; putative formula: C27H8N8S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1020.07,"smiles":null,"spectrum_id":"CCMSLIB00017214542","spectrum_index":3766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol (delta mass: 80.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.202,"smiles":null,"spectrum_id":"CCMSLIB00017214545","spectrum_index":3767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 241.0947 Da; putative annotation: N/A; putative formula: C11H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.165,"smiles":null,"spectrum_id":"CCMSLIB00017214547","spectrum_index":3768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 34.0058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.217,"smiles":null,"spectrum_id":"CCMSLIB00017214548","spectrum_index":3769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 387.2502 Da; putative annotation: N/A; putative formula: C18H29N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.352,"smiles":null,"spectrum_id":"CCMSLIB00017214549","spectrum_index":3770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 66.0466 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017214550","spectrum_index":3771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 279.2065 Da; putative annotation: N/A; putative formula: C14H25N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.392,"smiles":null,"spectrum_id":"CCMSLIB00017214551","spectrum_index":3772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 981.9154 Da; putative annotation: N/A; putative formula: C63H119N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1204.01,"smiles":null,"spectrum_id":"CCMSLIB00017214552","spectrum_index":3773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 128.0254 Da; putative annotation: N/A; putative formula: C3H5N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.122,"smiles":null,"spectrum_id":"CCMSLIB00017214556","spectrum_index":3774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl tyramine (delta mass: 300.2315 Da; putative annotation: N/A; putative formula: C18H28N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.333,"smiles":null,"spectrum_id":"CCMSLIB00017214557","spectrum_index":3775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 134.073 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.342,"smiles":null,"spectrum_id":"CCMSLIB00017214558","spectrum_index":3776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 127.912 Da; putative annotation: N/A; putative formula: HO2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.139,"smiles":null,"spectrum_id":"CCMSLIB00017214559","spectrum_index":3777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 414.2165 Da; putative annotation: N/A; putative formula: C24H34N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":743.485,"smiles":null,"spectrum_id":"CCMSLIB00017214560","spectrum_index":3778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine, 2-(diphenylmethyl)-, (2S)- (delta mass: 132.1007 Da; putative annotation: N/A; putative formula: C4H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.26,"smiles":null,"spectrum_id":"CCMSLIB00017214562","spectrum_index":3779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nandrolone (delta mass: 446.2133 Da; putative annotation: N/A; putative formula: C18H34N6O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.414,"smiles":null,"spectrum_id":"CCMSLIB00017214564","spectrum_index":3780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 100.067 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.414,"smiles":null,"spectrum_id":"CCMSLIB00017214565","spectrum_index":3781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)- (delta mass: 342.1102 Da; putative annotation: N/A; putative formula: C19H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.18,"smiles":null,"spectrum_id":"CCMSLIB00017214566","spectrum_index":3782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 191.188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.253,"smiles":null,"spectrum_id":"CCMSLIB00017214567","spectrum_index":3783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 343.2379 Da; putative annotation: N/A; putative formula: C19H29N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.512,"smiles":null,"spectrum_id":"CCMSLIB00017214569","spectrum_index":3784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperazine-2-carbonitrile (delta mass: 46.03 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.117,"smiles":null,"spectrum_id":"CCMSLIB00017214571","spectrum_index":3785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,14-Eicosatrienoic acid isobutylamide (delta mass: 361.3341 Da; putative annotation: N/A; putative formula: C24H43NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.676,"smiles":null,"spectrum_id":"CCMSLIB00017214573","spectrum_index":3786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 640.5903 Da; putative annotation: N/A; putative formula: C42H76N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.682,"smiles":null,"spectrum_id":"CCMSLIB00017214574","spectrum_index":3787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.253,"smiles":null,"spectrum_id":"CCMSLIB00017214575","spectrum_index":3788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 591.2249 Da; putative annotation: N/A; putative formula: C28H37N3O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.311,"smiles":null,"spectrum_id":"CCMSLIB00017214576","spectrum_index":3789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 176.0682 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.134,"smiles":null,"spectrum_id":"CCMSLIB00017214577","spectrum_index":3790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 349.2822 Da; putative annotation: N/A; putative formula: C15H31N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.509,"smiles":null,"spectrum_id":"CCMSLIB00017214580","spectrum_index":3791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 55.0061 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.103,"smiles":null,"spectrum_id":"CCMSLIB00017214582","spectrum_index":3792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 83.0367 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.123,"smiles":null,"spectrum_id":"CCMSLIB00017214583","spectrum_index":3793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C4:0 (delta mass: 176.0324 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.161,"smiles":null,"spectrum_id":"CCMSLIB00017214584","spectrum_index":3794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 324.3046 Da; putative annotation: N/A; putative formula: C20H41N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.381,"smiles":null,"spectrum_id":"CCMSLIB00017214585","spectrum_index":3795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 172.085 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.235,"smiles":null,"spectrum_id":"CCMSLIB00017214586","spectrum_index":3796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 133.1101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.228,"smiles":null,"spectrum_id":"CCMSLIB00017214588","spectrum_index":3797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 238.2604 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.79,"smiles":null,"spectrum_id":"CCMSLIB00017214591","spectrum_index":3798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 212.1653 Da; putative annotation: N/A; putative formula: C10H20N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.265,"smiles":null,"spectrum_id":"CCMSLIB00017214592","spectrum_index":3799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 124.0889 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.352,"smiles":null,"spectrum_id":"CCMSLIB00017214593","spectrum_index":3800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 140.0416 Da; putative annotation: N/A; putative formula: C6H8N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.124,"smiles":null,"spectrum_id":"CCMSLIB00017214594","spectrum_index":3801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 86.0505 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.475,"smiles":null,"spectrum_id":"CCMSLIB00017214595","spectrum_index":3802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 415.2927 Da; putative annotation: N/A; putative formula: C26H43NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.577,"smiles":null,"spectrum_id":"CCMSLIB00017214597","spectrum_index":3803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 347.2656 Da; putative annotation: N/A; putative formula: C15H29N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.487,"smiles":null,"spectrum_id":"CCMSLIB00017214599","spectrum_index":3804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curvularin (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.149,"smiles":null,"spectrum_id":"CCMSLIB00017214601","spectrum_index":3805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Bis(2-hydroxyethyl)dodecanamide (delta mass: 74.0362 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.289,"smiles":null,"spectrum_id":"CCMSLIB00017214602","spectrum_index":3806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 147.62 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.685,"smiles":null,"spectrum_id":"CCMSLIB00017214603","spectrum_index":3807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Debrisoquin (delta mass: 59.9656 Da; putative annotation: N/A; putative formula: COS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.084,"smiles":null,"spectrum_id":"CCMSLIB00017214605","spectrum_index":3808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-(3,4-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 143.137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.26,"smiles":null,"spectrum_id":"CCMSLIB00017214606","spectrum_index":3809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:102040 (delta mass: 298.0342 Da; putative annotation: N/A; putative formula: C14H18O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.078,"smiles":null,"spectrum_id":"CCMSLIB00017214608","spectrum_index":3810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 177.0784 Da; putative annotation: N/A; putative formula: C10H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.248,"smiles":null,"spectrum_id":"CCMSLIB00017214609","spectrum_index":3811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,16.alpha.,17.alpha.,21-Tetrahydroxypregna-1,4-diene-3,20-dione (delta mass: 52.0315 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.227,"smiles":null,"spectrum_id":"CCMSLIB00017214610","spectrum_index":3812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 136.0263 Da; putative annotation: N/A; putative formula: C6H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.098,"smiles":null,"spectrum_id":"CCMSLIB00017214612","spectrum_index":3813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 370.6232 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.694,"smiles":null,"spectrum_id":"CCMSLIB00017214613","spectrum_index":3814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoroindoline (delta mass: 43.019 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.081,"smiles":null,"spectrum_id":"CCMSLIB00017214614","spectrum_index":3815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl tyramine (delta mass: 286.2146 Da; putative annotation: N/A; putative formula: C16H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.316,"smiles":null,"spectrum_id":"CCMSLIB00017214615","spectrum_index":3816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 264.2451 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.326,"smiles":null,"spectrum_id":"CCMSLIB00017214619","spectrum_index":3817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 58.0716 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.158,"smiles":null,"spectrum_id":"CCMSLIB00017214620","spectrum_index":3818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydroxy-2,6-farnesadien-1-oic acid (delta mass: 161.0693 Da; putative annotation: N/A; putative formula: C7H15NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.26,"smiles":null,"spectrum_id":"CCMSLIB00017214621","spectrum_index":3819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 320.2356 Da; putative annotation: N/A; putative formula: C20H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.337,"smiles":null,"spectrum_id":"CCMSLIB00017214622","spectrum_index":3820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 69.0323 Da; putative annotation: N/A; putative formula: C2H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.103,"smiles":null,"spectrum_id":"CCMSLIB00017214623","spectrum_index":3821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 779.4831 Da; putative annotation: N/A; putative formula: C43H65N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.554,"smiles":null,"spectrum_id":"CCMSLIB00017214625","spectrum_index":3822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 114.0756 Da; putative annotation: N/A; putative formula: CH6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.297,"smiles":null,"spectrum_id":"CCMSLIB00017214627","spectrum_index":3823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 207.0753 Da; putative annotation: N/A; putative formula: C8H17NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.151,"smiles":null,"spectrum_id":"CCMSLIB00017214628","spectrum_index":3824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 12.0349 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.121,"smiles":null,"spectrum_id":"CCMSLIB00017214629","spectrum_index":3825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 82.0422 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.28,"smiles":null,"spectrum_id":"CCMSLIB00017214630","spectrum_index":3826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 227.0306 Da; putative annotation: N/A; putative formula: C7HN9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.153,"smiles":null,"spectrum_id":"CCMSLIB00017214631","spectrum_index":3827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 78.05 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.154,"smiles":null,"spectrum_id":"CCMSLIB00017214633","spectrum_index":3828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 156.0941 Da; putative annotation: N/A; putative formula: C12H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.462,"smiles":null,"spectrum_id":"CCMSLIB00017214635","spectrum_index":3829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 12.9938 Da; putative annotation: N/A; putative formula: C22H32N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017214637","spectrum_index":3830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 425.3151 Da; putative annotation: N/A; putative formula: C25H47NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.589,"smiles":null,"spectrum_id":"CCMSLIB00017214638","spectrum_index":3831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 152.0985 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.19,"smiles":null,"spectrum_id":"CCMSLIB00017214639","spectrum_index":3832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 130.063 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.248,"smiles":null,"spectrum_id":"CCMSLIB00017214640","spectrum_index":3833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 18.0352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017214642","spectrum_index":3834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 420.3974 Da; putative annotation: N/A; putative formula: C28H52O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.479,"smiles":null,"spectrum_id":"CCMSLIB00017214644","spectrum_index":3835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 179.0792 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017214646","spectrum_index":3836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(hydroxymethyl)-4,9a-dimethyl-2,7,8,9-tetrahydro-1H-benzo[7]annulen-3-one (delta mass: 38.0158 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017214647","spectrum_index":3837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 68.0469 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.258,"smiles":null,"spectrum_id":"CCMSLIB00017214648","spectrum_index":3838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 105.0478 Da; putative annotation: N/A; putative formula: CH7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.108,"smiles":null,"spectrum_id":"CCMSLIB00017214649","spectrum_index":3839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 109.074 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017214651","spectrum_index":3840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.alpha.)-3-Hydroxy-11-oxoolean-12-en-30-oic acid (delta mass: 142.114 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.461,"smiles":null,"spectrum_id":"CCMSLIB00017214652","spectrum_index":3841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 38.0161 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.17,"smiles":null,"spectrum_id":"CCMSLIB00017214654","spectrum_index":3842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 164.084 Da; putative annotation: N/A; putative formula: C10H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.144,"smiles":null,"spectrum_id":"CCMSLIB00017214656","spectrum_index":3843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Turmeronol B (delta mass: 46.0202 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.174,"smiles":null,"spectrum_id":"CCMSLIB00017214657","spectrum_index":3844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-(3-methyl-2-butenyl)benzaldehyde (delta mass: 311.1217 Da; putative annotation: N/A; putative formula: C11H21NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.228,"smiles":null,"spectrum_id":"CCMSLIB00017214659","spectrum_index":3845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(8-Hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)prop-2-enoic acid (delta mass: 265.0807 Da; putative annotation: N/A; putative formula: C10H19NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.26,"smiles":null,"spectrum_id":"CCMSLIB00017214660","spectrum_index":3846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 26.9993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017214661","spectrum_index":3847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 58.0519 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.107,"smiles":null,"spectrum_id":"CCMSLIB00017214662","spectrum_index":3848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 106.1 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.327,"smiles":null,"spectrum_id":"CCMSLIB00017214664","spectrum_index":3849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.159,"smiles":null,"spectrum_id":"CCMSLIB00017214665","spectrum_index":3850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 248.1787 Da; putative annotation: N/A; putative formula: C16H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.243,"smiles":null,"spectrum_id":"CCMSLIB00017214667","spectrum_index":3851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 73.7711 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.987,"smiles":null,"spectrum_id":"CCMSLIB00017214670","spectrum_index":3852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 143.0584 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.182,"smiles":null,"spectrum_id":"CCMSLIB00017214671","spectrum_index":3853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 26.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.139,"smiles":null,"spectrum_id":"CCMSLIB00017214673","spectrum_index":3854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 45.0555 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.287,"smiles":null,"spectrum_id":"CCMSLIB00017214674","spectrum_index":3855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 147.0689 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.203,"smiles":null,"spectrum_id":"CCMSLIB00017214675","spectrum_index":3856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 145.0693 Da; putative annotation: N/A; putative formula: C2H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.176,"smiles":null,"spectrum_id":"CCMSLIB00017214676","spectrum_index":3857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 194.094 Da; putative annotation: Massbank:FIO00852 Dehydro-piliformic-acid; putative formula: C11H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.196,"smiles":null,"spectrum_id":"CCMSLIB00017214678","spectrum_index":3858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Norepinephrine from NIST14 (delta mass: 105.0577 Da; putative annotation: 2-Amino-m-cresol; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017214680","spectrum_index":3859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 120.0574 Da; putative annotation: 2-(3-Hydroxyphenyl)ethanol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017214681","spectrum_index":3860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 150.1411 Da; putative annotation: (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol; putative formula: C11H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.41,"smiles":null,"spectrum_id":"CCMSLIB00017214683","spectrum_index":3861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 316.2404 Da; putative annotation: 5.alpha.-Pregnane-3.alpha.,21-diol-20-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.478,"smiles":null,"spectrum_id":"CCMSLIB00017214684","spectrum_index":3862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 316.2022 Da; putative annotation: 4'-Ethenyl-2'-hydroxy-1,4',4a-trimethyl-5-oxospiro[2,3,4,7,8,8a-hexahydronaphthalene-6,1'-cyclopentane]-1-carboxylic acid; putative formula: C20H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.46,"smiles":null,"spectrum_id":"CCMSLIB00017214685","spectrum_index":3863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 276.2071 Da; putative annotation: Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14; putative formula: C18H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.455,"smiles":null,"spectrum_id":"CCMSLIB00017214687","spectrum_index":3864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Pyridinyl)ethanol (delta mass: 143.0367 Da; putative annotation: 3-Aminocoumarin; putative formula: C9H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.112,"smiles":null,"spectrum_id":"CCMSLIB00017214688","spectrum_index":3865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 94.0792 Da; putative annotation: 1,2,3,6-Tetrahydrobenzylalcohol; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.29,"smiles":null,"spectrum_id":"CCMSLIB00017214689","spectrum_index":3866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,19,22,25,28,31-Tetratriacontahexaenoic acid, (all-Z)- (delta mass: 122.1083 Da; putative annotation: trans,cis-3,6-Nonadien-1-ol; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.544,"smiles":null,"spectrum_id":"CCMSLIB00017214690","spectrum_index":3867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of 6-Hydroxy-8-methoxy-3-methyl-3,4-dihydroisochromen-1-one (delta mass: 172.0525 Da; putative annotation: \"\"7-hydroxy-4,8-dimethylchromen-2-one CollisionEnergy:205060\"\"; putative formula: C11H8O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.133,"smiles":null,"spectrum_id":"CCMSLIB00017214692","spectrum_index":3868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 168.0413 Da; putative annotation: Endothal; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.138,"smiles":null,"spectrum_id":"CCMSLIB00017214693","spectrum_index":3869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E,8E)-9-[3a-hydroxy-6,7-dimethyl-1-(2-methylpropyl)-3-oxo-2,4,7,7a-tetrahydro-1H-isoindol-4-yl]-4,5-dihydroxy-8-methylnona-2,8-dienoate (delta mass: 90.0467 Da; putative annotation: 3-Methylphenol; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.332,"smiles":null,"spectrum_id":"CCMSLIB00017214694","spectrum_index":3870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 306.2172 Da; putative annotation: allo-Protolichesterinic acid; putative formula: C19H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.449,"smiles":null,"spectrum_id":"CCMSLIB00017214696","spectrum_index":3871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 146.0572 Da; putative annotation: 2-DEOXY-D-GLUCOSE - 20.0 eV; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.181,"smiles":null,"spectrum_id":"CCMSLIB00017214697","spectrum_index":3872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 153.096 Da; putative annotation: N-Ethyl-1-naphthylamine; putative formula: C12H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.156,"smiles":null,"spectrum_id":"CCMSLIB00017214699","spectrum_index":3873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Cycloisolongifol-5-ol (delta mass: 195.0886 Da; putative annotation: (-)-.alpha.-Kainic acid; putative formula: C10H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.279,"smiles":null,"spectrum_id":"CCMSLIB00017214701","spectrum_index":3874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 317.0792 Da; putative annotation: Fenamiphos sulfone; putative formula: C13H20NO4PS)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.144,"smiles":null,"spectrum_id":"CCMSLIB00017214702","spectrum_index":3875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Euscaphic acid (delta mass: 51.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.389,"smiles":null,"spectrum_id":"CCMSLIB00017214703","spectrum_index":3876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-amino-1-piperidinecarboxylate (delta mass: 17.0152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.144,"smiles":null,"spectrum_id":"CCMSLIB00017214705","spectrum_index":3877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 56.0386 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.088,"smiles":null,"spectrum_id":"CCMSLIB00017214706","spectrum_index":3878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 108.0931 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.367,"smiles":null,"spectrum_id":"CCMSLIB00017214708","spectrum_index":3879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 117.9953 Da; putative annotation: N/A; putative formula: C9H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.211,"smiles":null,"spectrum_id":"CCMSLIB00017214710","spectrum_index":3880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desoxypipradrol (delta mass: 218.1373 Da; putative annotation: N/A; putative formula: C10H23N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.312,"smiles":null,"spectrum_id":"CCMSLIB00017214711","spectrum_index":3881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 61.0462 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.3,"smiles":null,"spectrum_id":"CCMSLIB00017214712","spectrum_index":3882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 62.0 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.055,"smiles":null,"spectrum_id":"CCMSLIB00017214714","spectrum_index":3883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 59.011 Da; putative annotation: N/A; putative formula: HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.092,"smiles":null,"spectrum_id":"CCMSLIB00017214715","spectrum_index":3884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 81.9229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.108,"smiles":null,"spectrum_id":"CCMSLIB00017214717","spectrum_index":3885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 364.1963 Da; putative annotation: N/A; putative formula: C14H28N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":831.404,"smiles":null,"spectrum_id":"CCMSLIB00017214719","spectrum_index":3886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 129.08 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.364,"smiles":null,"spectrum_id":"CCMSLIB00017214720","spectrum_index":3887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 102.047 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.123,"smiles":null,"spectrum_id":"CCMSLIB00017214721","spectrum_index":3888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 96.0939 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.294,"smiles":null,"spectrum_id":"CCMSLIB00017214723","spectrum_index":3889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannose 6-phosphate (delta mass: 221.1459 Da; putative annotation: N/A; putative formula: C12H20N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.183,"smiles":null,"spectrum_id":"CCMSLIB00017214724","spectrum_index":3890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 262.2505 Da; putative annotation: N/A; putative formula: C16H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.316,"smiles":null,"spectrum_id":"CCMSLIB00017214726","spectrum_index":3891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleanolic acid - 40.0 eV (delta mass: 42.0098 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.377,"smiles":null,"spectrum_id":"CCMSLIB00017214728","spectrum_index":3892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 38.0237 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.11,"smiles":null,"spectrum_id":"CCMSLIB00017214729","spectrum_index":3893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 36.0358 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.268,"smiles":null,"spectrum_id":"CCMSLIB00017214730","spectrum_index":3894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 107.1174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.199,"smiles":null,"spectrum_id":"CCMSLIB00017214731","spectrum_index":3895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 275.1367 Da; putative annotation: N/A; putative formula: C12H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.343,"smiles":null,"spectrum_id":"CCMSLIB00017214732","spectrum_index":3896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 80.268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.305,"smiles":null,"spectrum_id":"CCMSLIB00017214733","spectrum_index":3897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Resibufogenin (delta mass: 116.0662 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.303,"smiles":null,"spectrum_id":"CCMSLIB00017214735","spectrum_index":3898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 73.0779 Da; putative annotation: N/A; putative formula: CH7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.148,"smiles":null,"spectrum_id":"CCMSLIB00017214738","spectrum_index":3899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Acetyloxy)lanosta-8,24-dien-21-oic acid (delta mass: 154.0782 Da; putative annotation: N/A; putative formula: C12H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.456,"smiles":null,"spectrum_id":"CCMSLIB00017214739","spectrum_index":3900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100009 (R)-(-)-Phenylephrine|Neo-Synephrine|Metasympatol|Visadron|Mesaton|Mezaton|Metaoxedrine|m-Sympatol|m-Oxedrine|(R)-(?)-1-(3-Hydroxyphenyl)-2-methylaminoethanol|L-(3-Hydroxyphenyl)-N-methylethanolamine (delta mass: 121.078 Da; putative annotation: N/A; putative formula: C5H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017214740","spectrum_index":3901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 236.4206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.492,"smiles":null,"spectrum_id":"CCMSLIB00017214741","spectrum_index":3902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 258.1107 Da; putative annotation: N/A; putative formula: C12H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.165,"smiles":null,"spectrum_id":"CCMSLIB00017214742","spectrum_index":3903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 277.152 Da; putative annotation: N/A; putative formula: C12H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.212,"smiles":null,"spectrum_id":"CCMSLIB00017214743","spectrum_index":3904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 160.0162 Da; putative annotation: N/A; putative formula: C9H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.087,"smiles":null,"spectrum_id":"CCMSLIB00017214746","spectrum_index":3905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 86.05 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.282,"smiles":null,"spectrum_id":"CCMSLIB00017214748","spectrum_index":3906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-4,5-dimethoxybenzoic acid (delta mass: 45.0116 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.038,"smiles":null,"spectrum_id":"CCMSLIB00017214749","spectrum_index":3907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 38.0518 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.211,"smiles":null,"spectrum_id":"CCMSLIB00017214750","spectrum_index":3908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 865.3521 Da; putative annotation: N/A; putative formula: C45H55NO16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1058.42,"smiles":null,"spectrum_id":"CCMSLIB00017214751","spectrum_index":3909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 132.0904 Da; putative annotation: N/A; putative formula: C5H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.229,"smiles":null,"spectrum_id":"CCMSLIB00017214752","spectrum_index":3910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 118.0605 Da; putative annotation: N/A; putative formula: CH6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.131,"smiles":null,"spectrum_id":"CCMSLIB00017214753","spectrum_index":3911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 239.0981 Da; putative annotation: N/A; putative formula: C12H17NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.194,"smiles":null,"spectrum_id":"CCMSLIB00017214757","spectrum_index":3912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Hydroxymethylbicyclo[2.2.1]hept-2-yl)methanol (delta mass: 78.0458 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.168,"smiles":null,"spectrum_id":"CCMSLIB00017214758","spectrum_index":3913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxypimara-8(14),15-dien-18-oic acid (delta mass: 50.0529 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.28,"smiles":null,"spectrum_id":"CCMSLIB00017214759","spectrum_index":3914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 112.0557 Da; putative annotation: N/A; putative formula: C5H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.236,"smiles":null,"spectrum_id":"CCMSLIB00017214760","spectrum_index":3915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Destruxin_B (delta mass: 610.3996 Da; putative annotation: N/A; putative formula: C37H50N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1204.79,"smiles":null,"spectrum_id":"CCMSLIB00017214761","spectrum_index":3916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 120.094 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017214762","spectrum_index":3917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 290.35 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.5,"smiles":null,"spectrum_id":"CCMSLIB00017214763","spectrum_index":3918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 157.0527 Da; putative annotation: N/A; putative formula: C10H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.092,"smiles":null,"spectrum_id":"CCMSLIB00017214767","spectrum_index":3919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 125.0698 Da; putative annotation: N/A; putative formula: C4H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.286,"smiles":null,"spectrum_id":"CCMSLIB00017214768","spectrum_index":3920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 130.0897 Da; putative annotation: N/A; putative formula: C9H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.144,"smiles":null,"spectrum_id":"CCMSLIB00017214769","spectrum_index":3921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 131.0946 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.243,"smiles":null,"spectrum_id":"CCMSLIB00017214770","spectrum_index":3922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 40.0484 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.119,"smiles":null,"spectrum_id":"CCMSLIB00017214771","spectrum_index":3923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 84.0157 Da; putative annotation: N/A; putative formula: C3H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.3,"smiles":null,"spectrum_id":"CCMSLIB00017214773","spectrum_index":3924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1050.6511 Da; putative annotation: N/A; putative formula: C58H90N4O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1213.71,"smiles":null,"spectrum_id":"CCMSLIB00017214775","spectrum_index":3925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 139.0997 Da; putative annotation: N/A; putative formula: C8H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.155,"smiles":null,"spectrum_id":"CCMSLIB00017214776","spectrum_index":3926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 114.0836 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.357,"smiles":null,"spectrum_id":"CCMSLIB00017214777","spectrum_index":3927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 176.0337 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.12,"smiles":null,"spectrum_id":"CCMSLIB00017214778","spectrum_index":3928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. alcohol methyl ether (delta mass: 80.026 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.31,"smiles":null,"spectrum_id":"CCMSLIB00017214779","spectrum_index":3929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 83.0009 Da; putative annotation: N/A; putative formula: C3HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.077,"smiles":null,"spectrum_id":"CCMSLIB00017214780","spectrum_index":3930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 140.0685 Da; putative annotation: N/A; putative formula: C5H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017214783","spectrum_index":3931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 118.0777 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.341,"smiles":null,"spectrum_id":"CCMSLIB00017214785","spectrum_index":3932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-1,3-Dihydroxydammara-12,24-dien-26-oic acid (delta mass: 154.1204 Da; putative annotation: N/A; putative formula: C7H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.483,"smiles":null,"spectrum_id":"CCMSLIB00017214786","spectrum_index":3933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)cyclohexanol (delta mass: 170.0939 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.274,"smiles":null,"spectrum_id":"CCMSLIB00017214787","spectrum_index":3934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 256.2394 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.284,"smiles":null,"spectrum_id":"CCMSLIB00017214788","spectrum_index":3935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-8-Methyl-6-nonenoic acid (delta mass: 170.1781 Da; putative annotation: N/A; putative formula: C10H22N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.316,"smiles":null,"spectrum_id":"CCMSLIB00017214789","spectrum_index":3936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169650-03!5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-6-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one (delta mass: 162.0536 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.209,"smiles":null,"spectrum_id":"CCMSLIB00017214791","spectrum_index":3937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12-Ketodeoxycholic acid from NIST14 (delta mass: 521.2668 Da; putative annotation: N/A; putative formula: C27H36N7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.551,"smiles":null,"spectrum_id":"CCMSLIB00017214794","spectrum_index":3938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 20.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.071,"smiles":null,"spectrum_id":"CCMSLIB00017214795","spectrum_index":3939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 45.062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.127,"smiles":null,"spectrum_id":"CCMSLIB00017214796","spectrum_index":3940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 89.0476 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.171,"smiles":null,"spectrum_id":"CCMSLIB00017214797","spectrum_index":3941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 557.9028 Da; putative annotation: N/A; putative formula: C16H10N6O5S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.0,"smiles":null,"spectrum_id":"CCMSLIB00017214799","spectrum_index":3942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 42.0329 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.13,"smiles":null,"spectrum_id":"CCMSLIB00017214800","spectrum_index":3943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 96.9529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.185,"smiles":null,"spectrum_id":"CCMSLIB00017214803","spectrum_index":3944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 397.358 Da; putative annotation: N/A; putative formula: C23H48N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.548,"smiles":null,"spectrum_id":"CCMSLIB00017214804","spectrum_index":3945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 334.1686 Da; putative annotation: N/A; putative formula: C13H28N4O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.26,"smiles":null,"spectrum_id":"CCMSLIB00017214805","spectrum_index":3946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Longicaulenone (delta mass: 41.0257 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.154,"smiles":null,"spectrum_id":"CCMSLIB00017214806","spectrum_index":3947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 227.1308 Da; putative annotation: N/A; putative formula: C15H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.202,"smiles":null,"spectrum_id":"CCMSLIB00017214808","spectrum_index":3948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 310.1167 Da; putative annotation: N/A; putative formula: C14H18N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.177,"smiles":null,"spectrum_id":"CCMSLIB00017214810","spectrum_index":3949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 316.2638 Da; putative annotation: N/A; putative formula: C17H37N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.48,"smiles":null,"spectrum_id":"CCMSLIB00017214811","spectrum_index":3950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 396.323 Da; putative annotation: N/A; putative formula: C24H44O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.36,"smiles":null,"spectrum_id":"CCMSLIB00017214812","spectrum_index":3951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 175.0476 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.134,"smiles":null,"spectrum_id":"CCMSLIB00017214813","spectrum_index":3952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 24.0028 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.057,"smiles":null,"spectrum_id":"CCMSLIB00017214814","spectrum_index":3953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 635.4391 Da; putative annotation: N/A; putative formula: C41H57N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.499,"smiles":null,"spectrum_id":"CCMSLIB00017214816","spectrum_index":3954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 114.036 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.159,"smiles":null,"spectrum_id":"CCMSLIB00017214819","spectrum_index":3955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 31.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.295,"smiles":null,"spectrum_id":"CCMSLIB00017214820","spectrum_index":3956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 22.9907 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.088,"smiles":null,"spectrum_id":"CCMSLIB00017214821","spectrum_index":3957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 223.1929 Da; putative annotation: N/A; putative formula: C14H25NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.477,"smiles":null,"spectrum_id":"CCMSLIB00017214822","spectrum_index":3958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 69.0423 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.389,"smiles":null,"spectrum_id":"CCMSLIB00017214823","spectrum_index":3959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Ala-Phe (delta mass: 130.0626 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.186,"smiles":null,"spectrum_id":"CCMSLIB00017214825","spectrum_index":3960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Formyl-2-hydroxybenzoic acid (delta mass: 39.9949 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.029,"smiles":null,"spectrum_id":"CCMSLIB00017214828","spectrum_index":3961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 30.0107 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017214829","spectrum_index":3962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 370.2688 Da; putative annotation: N/A; putative formula: C17H34N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.501,"smiles":null,"spectrum_id":"CCMSLIB00017214830","spectrum_index":3963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminobenzoic acid - 30.0 eV (delta mass: 75.0469 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.102,"smiles":null,"spectrum_id":"CCMSLIB00017214831","spectrum_index":3964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 62.0615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.154,"smiles":null,"spectrum_id":"CCMSLIB00017214833","spectrum_index":3965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 185.2163 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.295,"smiles":null,"spectrum_id":"CCMSLIB00017214834","spectrum_index":3966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl indole-4-carboxylate (delta mass: 300.3021 Da; putative annotation: N/A; putative formula: C15H36N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.373,"smiles":null,"spectrum_id":"CCMSLIB00017214836","spectrum_index":3967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoerucin (delta mass: 66.0806 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.443,"smiles":null,"spectrum_id":"CCMSLIB00017214838","spectrum_index":3968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 19.0124 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.38,"smiles":null,"spectrum_id":"CCMSLIB00017214840","spectrum_index":3969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 254.1156 Da; putative annotation: N/A; putative formula: C13H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.212,"smiles":null,"spectrum_id":"CCMSLIB00017214841","spectrum_index":3970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 46.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.102,"smiles":null,"spectrum_id":"CCMSLIB00017214842","spectrum_index":3971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 196.1054 Da; putative annotation: N/A; putative formula: C3H8N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.144,"smiles":null,"spectrum_id":"CCMSLIB00017214843","spectrum_index":3972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroaspyrone (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017214846","spectrum_index":3973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 35.073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.169,"smiles":null,"spectrum_id":"CCMSLIB00017214848","spectrum_index":3974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 238.0896 Da; putative annotation: N/A; putative formula: C18H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.186,"smiles":null,"spectrum_id":"CCMSLIB00017214849","spectrum_index":3975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 74.0426 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.217,"smiles":null,"spectrum_id":"CCMSLIB00017214850","spectrum_index":3976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 42.0111 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.144,"smiles":null,"spectrum_id":"CCMSLIB00017214851","spectrum_index":3977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381056-01_C22H33NO6_Valine, N-acetyl-, 1,3,5,5a,6,7,8,9,9a,9b-decahydro-9b-hydroxy-6,6,9a-trimethyl-3-oxonaphtho[1,2-c]furan-9-yl ester (delta mass: 78.0096 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.248,"smiles":null,"spectrum_id":"CCMSLIB00017214852","spectrum_index":3978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 144.0418 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.17,"smiles":null,"spectrum_id":"CCMSLIB00017214854","spectrum_index":3979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 195.8067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.846,"smiles":null,"spectrum_id":"CCMSLIB00017214857","spectrum_index":3980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-proline (delta mass: 147.0524 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.139,"smiles":null,"spectrum_id":"CCMSLIB00017214858","spectrum_index":3981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jasmonic acid (delta mass: 211.0678 Da; putative annotation: N/A; putative formula: C3H5N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.201,"smiles":null,"spectrum_id":"CCMSLIB00017214859","spectrum_index":3982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 61.9998 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.075,"smiles":null,"spectrum_id":"CCMSLIB00017214860","spectrum_index":3983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-7-carboxylic acid (delta mass: 60.011 Da; putative annotation: N/A; putative formula: C4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.074,"smiles":null,"spectrum_id":"CCMSLIB00017214861","spectrum_index":3984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 506.2575 Da; putative annotation: N/A; putative formula: C26H34N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.5,"smiles":null,"spectrum_id":"CCMSLIB00017214862","spectrum_index":3985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 154.9903 Da; putative annotation: N/A; putative formula: C3HN5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.093,"smiles":null,"spectrum_id":"CCMSLIB00017214865","spectrum_index":3986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 481.2882 Da; putative annotation: N/A; putative formula: C35H35N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.348,"smiles":null,"spectrum_id":"CCMSLIB00017214867","spectrum_index":3987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.,27-Dihydroxycholesterol (delta mass: 79.9653 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.317,"smiles":null,"spectrum_id":"CCMSLIB00017214868","spectrum_index":3988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 53.0468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.279,"smiles":null,"spectrum_id":"CCMSLIB00017214869","spectrum_index":3989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-3,4-(methylenedioxy)benzylamine (delta mass: 28.0238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.11,"smiles":null,"spectrum_id":"CCMSLIB00017214870","spectrum_index":3990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 55.0851 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.27,"smiles":null,"spectrum_id":"CCMSLIB00017214871","spectrum_index":3991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 43.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.18,"smiles":null,"spectrum_id":"CCMSLIB00017214874","spectrum_index":3992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheptanol (delta mass: 167.1667 Da; putative annotation: N/A; putative formula: C11H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.278,"smiles":null,"spectrum_id":"CCMSLIB00017214876","spectrum_index":3993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methylphenyl)-2,3,4,9-tetrahydro-1H-.beta.-carboline (delta mass: 35.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.201,"smiles":null,"spectrum_id":"CCMSLIB00017214877","spectrum_index":3994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00017 Biotin (delta mass: 204.0865 Da; putative annotation: N/A; putative formula: C7H16N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.182,"smiles":null,"spectrum_id":"CCMSLIB00017214878","spectrum_index":3995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid from NIST14 (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.243,"smiles":null,"spectrum_id":"CCMSLIB00017214879","spectrum_index":3996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 159.0893 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.213,"smiles":null,"spectrum_id":"CCMSLIB00017214882","spectrum_index":3997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Cyclopentylpropyl)methylamine (delta mass: 592.591 Da; putative annotation: N/A; putative formula: C38H76N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":734.75,"smiles":null,"spectrum_id":"CCMSLIB00017214883","spectrum_index":3998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 152.1043 Da; putative annotation: N/A; putative formula: C7H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.472,"smiles":null,"spectrum_id":"CCMSLIB00017214884","spectrum_index":3999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Castanospermine (delta mass: 28.0304 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.138,"smiles":null,"spectrum_id":"CCMSLIB00017214886","spectrum_index":4000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 359.1426 Da; putative annotation: N/A; putative formula: C12H25NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.625,"smiles":null,"spectrum_id":"CCMSLIB00017214887","spectrum_index":4001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 28.1067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.198,"smiles":null,"spectrum_id":"CCMSLIB00017214890","spectrum_index":4002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 73.0413 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.106,"smiles":null,"spectrum_id":"CCMSLIB00017214891","spectrum_index":4003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 159.0739 Da; putative annotation: N/A; putative formula: C7H15NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.29,"smiles":null,"spectrum_id":"CCMSLIB00017214893","spectrum_index":4004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 560.4776 Da; putative annotation: N/A; putative formula: C32H60N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.741,"smiles":null,"spectrum_id":"CCMSLIB00017214894","spectrum_index":4005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)acetamide (delta mass: 46.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.16,"smiles":null,"spectrum_id":"CCMSLIB00017214895","spectrum_index":4006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 120.0941 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.29,"smiles":null,"spectrum_id":"CCMSLIB00017214898","spectrum_index":4007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 210.0581 Da; putative annotation: N/A; putative formula: C16H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.14,"smiles":null,"spectrum_id":"CCMSLIB00017214900","spectrum_index":4008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Dihydrotestosterone (delta mass: 108.0946 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.327,"smiles":null,"spectrum_id":"CCMSLIB00017214901","spectrum_index":4009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 811.2633 Da; putative annotation: N/A; putative formula: C40H41N7O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1478.49,"smiles":null,"spectrum_id":"CCMSLIB00017214902","spectrum_index":4010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihexanoyl-sn-glycerol (delta mass: 80.0622 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.263,"smiles":null,"spectrum_id":"CCMSLIB00017214903","spectrum_index":4011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 490.3151 Da; putative annotation: N/A; putative formula: C26H50O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.521,"smiles":null,"spectrum_id":"CCMSLIB00017214905","spectrum_index":4012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentapropylene glycol (delta mass: 16.8297 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.057,"smiles":null,"spectrum_id":"CCMSLIB00017214907","spectrum_index":4013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 56.0673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.55,"smiles":null,"spectrum_id":"CCMSLIB00017214909","spectrum_index":4014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 35.0404 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.129,"smiles":null,"spectrum_id":"CCMSLIB00017214910","spectrum_index":4015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 92.0208 Da; putative annotation: N/A; putative formula: CH4N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.079,"smiles":null,"spectrum_id":"CCMSLIB00017214911","spectrum_index":4016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxythiophene-2-carboxylic acid (delta mass: 23.0914 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.102,"smiles":null,"spectrum_id":"CCMSLIB00017214912","spectrum_index":4017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 604.3266 Da; putative annotation: N/A; putative formula: C35H56S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":963.642,"smiles":null,"spectrum_id":"CCMSLIB00017214913","spectrum_index":4018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 254.2256 Da; putative annotation: N/A; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.505,"smiles":null,"spectrum_id":"CCMSLIB00017214916","spectrum_index":4019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 734.2203 Da; putative annotation: N/A; putative formula: C30H42N2O17S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.28,"smiles":null,"spectrum_id":"CCMSLIB00017214918","spectrum_index":4020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 291.1632 Da; putative annotation: N/A; putative formula: C13H21N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.276,"smiles":null,"spectrum_id":"CCMSLIB00017214919","spectrum_index":4021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 179.0558 Da; putative annotation: N/A; putative formula: C5H5N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.101,"smiles":null,"spectrum_id":"CCMSLIB00017214920","spectrum_index":4022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 66.0412 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.31,"smiles":null,"spectrum_id":"CCMSLIB00017214921","spectrum_index":4023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 359.1436 Da; putative annotation: N/A; putative formula: C23H22NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.36,"smiles":null,"spectrum_id":"CCMSLIB00017214922","spectrum_index":4024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 146.0082 Da; putative annotation: N/A; putative formula: C3H6N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.068,"smiles":null,"spectrum_id":"CCMSLIB00017214924","spectrum_index":4025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 318.2555 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.508,"smiles":null,"spectrum_id":"CCMSLIB00017214927","spectrum_index":4026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 9.9957 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.098,"smiles":null,"spectrum_id":"CCMSLIB00017214928","spectrum_index":4027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 170.0576 Da; putative annotation: N/A; putative formula: C8H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.118,"smiles":null,"spectrum_id":"CCMSLIB00017214929","spectrum_index":4028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 40.0045 Da; putative annotation: N/A; putative formula: CN2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.086,"smiles":null,"spectrum_id":"CCMSLIB00017214930","spectrum_index":4029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 111.9954 Da; putative annotation: N/A; putative formula: CN6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.077,"smiles":null,"spectrum_id":"CCMSLIB00017214931","spectrum_index":4030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epilupeol (delta mass: 79.9684 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.362,"smiles":null,"spectrum_id":"CCMSLIB00017214933","spectrum_index":4031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 27.8661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.989,"smiles":null,"spectrum_id":"CCMSLIB00017214936","spectrum_index":4032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130087 (delta mass: 59.0327 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.203,"smiles":null,"spectrum_id":"CCMSLIB00017214937","spectrum_index":4033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.258,"smiles":null,"spectrum_id":"CCMSLIB00017214938","spectrum_index":4034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hexadecyl lysophosphatidic acid (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.308,"smiles":null,"spectrum_id":"CCMSLIB00017214939","spectrum_index":4035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HYDROQUINONE (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.055,"smiles":null,"spectrum_id":"CCMSLIB00017214941","spectrum_index":4036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 92.0667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.257,"smiles":null,"spectrum_id":"CCMSLIB00017214943","spectrum_index":4037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN - 30.0 eV (delta mass: 74.0338 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017214944","spectrum_index":4038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,8,11,14-Pentaoxahexadecan-16-ol (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.191,"smiles":null,"spectrum_id":"CCMSLIB00017214946","spectrum_index":4039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 107.0946 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.348,"smiles":null,"spectrum_id":"CCMSLIB00017214947","spectrum_index":4040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 104.0618 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.31,"smiles":null,"spectrum_id":"CCMSLIB00017214948","spectrum_index":4041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 132.057 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.305,"smiles":null,"spectrum_id":"CCMSLIB00017214951","spectrum_index":4042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU277306 Creatinine|2-amino-3-methyl-4H-imidazol-5-one (delta mass: 58.0457 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.112,"smiles":null,"spectrum_id":"CCMSLIB00017214952","spectrum_index":4043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-1,4-diazepane (delta mass: 59.0215 Da; putative annotation: N/A; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.139,"smiles":null,"spectrum_id":"CCMSLIB00017214954","spectrum_index":4044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinamine (delta mass: 52.0381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.156,"smiles":null,"spectrum_id":"CCMSLIB00017214955","spectrum_index":4045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 188.1125 Da; putative annotation: N/A; putative formula: C13H17O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.147,"smiles":null,"spectrum_id":"CCMSLIB00017214956","spectrum_index":4046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 99.0442 Da; putative annotation: N/A; putative formula: C3H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.12,"smiles":null,"spectrum_id":"CCMSLIB00017214958","spectrum_index":4047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 48.0229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.073,"smiles":null,"spectrum_id":"CCMSLIB00017214961","spectrum_index":4048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 125.0929 Da; putative annotation: N/A; putative formula: C6H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.19,"smiles":null,"spectrum_id":"CCMSLIB00017214962","spectrum_index":4049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU288304 Norharmane|9H-pyrido[3,4-b]indole (delta mass: 15.0544 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.13,"smiles":null,"spectrum_id":"CCMSLIB00017214963","spectrum_index":4050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 70.0781 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.284,"smiles":null,"spectrum_id":"CCMSLIB00017214964","spectrum_index":4051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 193.0593 Da; putative annotation: N/A; putative formula: C7H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.208,"smiles":null,"spectrum_id":"CCMSLIB00017214967","spectrum_index":4052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 112.0562 Da; putative annotation: N/A; putative formula: C5H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.341,"smiles":null,"spectrum_id":"CCMSLIB00017214969","spectrum_index":4053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 59.035 Da; putative annotation: N/A; putative formula: C2H5NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.1,"smiles":null,"spectrum_id":"CCMSLIB00017214970","spectrum_index":4054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 517.3135 Da; putative annotation: N/A; putative formula: C40H39NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.389,"smiles":null,"spectrum_id":"CCMSLIB00017214971","spectrum_index":4055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinamine (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.17,"smiles":null,"spectrum_id":"CCMSLIB00017214973","spectrum_index":4056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 109.0292 Da; putative annotation: N/A; putative formula: C4H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.116,"smiles":null,"spectrum_id":"CCMSLIB00017214975","spectrum_index":4057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 63.0673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.132,"smiles":null,"spectrum_id":"CCMSLIB00017214977","spectrum_index":4058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 132.078 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017214978","spectrum_index":4059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 315.2358 Da; putative annotation: N/A; putative formula: C16H35N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.337,"smiles":null,"spectrum_id":"CCMSLIB00017214979","spectrum_index":4060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 117.1071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.183,"smiles":null,"spectrum_id":"CCMSLIB00017214980","spectrum_index":4061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 90.0832 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017214981","spectrum_index":4062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 17.9087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.979,"smiles":null,"spectrum_id":"CCMSLIB00017214983","spectrum_index":4063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 28.0506 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.298,"smiles":null,"spectrum_id":"CCMSLIB00017214986","spectrum_index":4064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 175.0637 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017214987","spectrum_index":4065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 31.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.289,"smiles":null,"spectrum_id":"CCMSLIB00017214988","spectrum_index":4066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 144.0693 Da; putative annotation: N/A; putative formula: C9H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.14,"smiles":null,"spectrum_id":"CCMSLIB00017214989","spectrum_index":4067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 109.0091 Da; putative annotation: N/A; putative formula: C4H3N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.05,"smiles":null,"spectrum_id":"CCMSLIB00017214991","spectrum_index":4068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 48.0362 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017214992","spectrum_index":4069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-cis-Retinol (delta mass: 42.0099 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.247,"smiles":null,"spectrum_id":"CCMSLIB00017214995","spectrum_index":4070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 659.5321 Da; putative annotation: N/A; putative formula: C34H65N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.748,"smiles":null,"spectrum_id":"CCMSLIB00017214996","spectrum_index":4071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 336.2686 Da; putative annotation: N/A; putative formula: C20H37N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.381,"smiles":null,"spectrum_id":"CCMSLIB00017214997","spectrum_index":4072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 76.0436 Da; putative annotation: N/A; putative formula: C5H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.104,"smiles":null,"spectrum_id":"CCMSLIB00017214998","spectrum_index":4073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Acetoxygrindelic acid (delta mass: 92.0604 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.308,"smiles":null,"spectrum_id":"CCMSLIB00017215000","spectrum_index":4074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 163.132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.171,"smiles":null,"spectrum_id":"CCMSLIB00017215003","spectrum_index":4075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,19-Cyclolanost-25-ene-3,24-diol (delta mass: 14.0141 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.402,"smiles":null,"spectrum_id":"CCMSLIB00017215004","spectrum_index":4076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androstane-3.beta.,17.beta.-diol (delta mass: 216.1863 Da; putative annotation: N/A; putative formula: C10H25N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.434,"smiles":null,"spectrum_id":"CCMSLIB00017215005","spectrum_index":4077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 176.0509 Da; putative annotation: N/A; putative formula: C7H12O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.116,"smiles":null,"spectrum_id":"CCMSLIB00017215007","spectrum_index":4078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 122.1455 Da; putative annotation: N/A; putative formula: C10H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.299,"smiles":null,"spectrum_id":"CCMSLIB00017215008","spectrum_index":4079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 130.1132 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.34,"smiles":null,"spectrum_id":"CCMSLIB00017215009","spectrum_index":4080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 88.0676 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.31,"smiles":null,"spectrum_id":"CCMSLIB00017215012","spectrum_index":4081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Benzimidazol-2-one, 1-ethyl-1,3-dihydro- (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.097,"smiles":null,"spectrum_id":"CCMSLIB00017215014","spectrum_index":4082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 71.0666 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.169,"smiles":null,"spectrum_id":"CCMSLIB00017215015","spectrum_index":4083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 645.4818 Da; putative annotation: N/A; putative formula: C35H67NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.698,"smiles":null,"spectrum_id":"CCMSLIB00017215016","spectrum_index":4084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 157.0622 Da; putative annotation: N/A; putative formula: C9H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.122,"smiles":null,"spectrum_id":"CCMSLIB00017215017","spectrum_index":4085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 27.9896 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.071,"smiles":null,"spectrum_id":"CCMSLIB00017215018","spectrum_index":4086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 164.0474 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.149,"smiles":null,"spectrum_id":"CCMSLIB00017215021","spectrum_index":4087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 104.0627 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.128,"smiles":null,"spectrum_id":"CCMSLIB00017215023","spectrum_index":4088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Fructosyl isoleucine (delta mass: 354.1535 Da; putative annotation: N/A; putative formula: C15H30O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.308,"smiles":null,"spectrum_id":"CCMSLIB00017215024","spectrum_index":4089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 210.1166 Da; putative annotation: N/A; putative formula: C12H19OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.16,"smiles":null,"spectrum_id":"CCMSLIB00017215025","spectrum_index":4090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 198.1411 Da; putative annotation: N/A; putative formula: C15H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.265,"smiles":null,"spectrum_id":"CCMSLIB00017215026","spectrum_index":4091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-nitro-1H-indole-2-carboxylate (delta mass: 27.9975 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.053,"smiles":null,"spectrum_id":"CCMSLIB00017215027","spectrum_index":4092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000066 Salsolinol (delta mass: 74.0001 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017215030","spectrum_index":4093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 428.1164 Da; putative annotation: N/A; putative formula: C21H24N4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.468,"smiles":null,"spectrum_id":"CCMSLIB00017215032","spectrum_index":4094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 635.2057 Da; putative annotation: N/A; putative formula: C39H29N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.266,"smiles":null,"spectrum_id":"CCMSLIB00017215033","spectrum_index":4095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-5,8,11,14-Eicosatetraenoic acid from NIST14 (delta mass: 50.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.284,"smiles":null,"spectrum_id":"CCMSLIB00017215034","spectrum_index":4096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10Z,14E)-6,14-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017215035","spectrum_index":4097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 484.2462 Da; putative annotation: N/A; putative formula: C28H36O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.359,"smiles":null,"spectrum_id":"CCMSLIB00017215036","spectrum_index":4098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylphenidate (delta mass: 15.4828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.632,"smiles":null,"spectrum_id":"CCMSLIB00017215040","spectrum_index":4099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 133.0741 Da; putative annotation: N/A; putative formula: C5H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.165,"smiles":null,"spectrum_id":"CCMSLIB00017215041","spectrum_index":4100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 322.1831 Da; putative annotation: N/A; putative formula: C24H22N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.27,"smiles":null,"spectrum_id":"CCMSLIB00017215042","spectrum_index":4101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperazinyl)nicotinonitrile (delta mass: 243.0448 Da; putative annotation: N/A; putative formula: C13H10NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.158,"smiles":null,"spectrum_id":"CCMSLIB00017215043","spectrum_index":4102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 255.0408 Da; putative annotation: N/A; putative formula: C9H10N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.174,"smiles":null,"spectrum_id":"CCMSLIB00017215044","spectrum_index":4103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 140.0099 Da; putative annotation: N/A; putative formula: C6H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.263,"smiles":null,"spectrum_id":"CCMSLIB00017215046","spectrum_index":4104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 351.6929 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.784,"smiles":null,"spectrum_id":"CCMSLIB00017215048","spectrum_index":4105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 569.2679 Da; putative annotation: N/A; putative formula: C37H35N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.307,"smiles":null,"spectrum_id":"CCMSLIB00017215050","spectrum_index":4106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 625.3305 Da; putative annotation: N/A; putative formula: C41H43N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.37,"smiles":null,"spectrum_id":"CCMSLIB00017215051","spectrum_index":4107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannose 6-phosphate (delta mass: 212.02 Da; putative annotation: N/A; putative formula: C4H9N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.057,"smiles":null,"spectrum_id":"CCMSLIB00017215052","spectrum_index":4108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 94.0776 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017215054","spectrum_index":4109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 575.2292 Da; putative annotation: N/A; putative formula: C33H25N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.27,"smiles":null,"spectrum_id":"CCMSLIB00017215055","spectrum_index":4110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 98.0345 Da; putative annotation: N/A; putative formula: CH2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.1,"smiles":null,"spectrum_id":"CCMSLIB00017215058","spectrum_index":4111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 84.0616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.157,"smiles":null,"spectrum_id":"CCMSLIB00017215059","spectrum_index":4112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 73.9403 Da; putative annotation: N/A; putative formula: H-2N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.156,"smiles":null,"spectrum_id":"CCMSLIB00017215060","spectrum_index":4113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 681.4289 Da; putative annotation: N/A; putative formula: C38H59N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.468,"smiles":null,"spectrum_id":"CCMSLIB00017215062","spectrum_index":4114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 498.3708 Da; putative annotation: N/A; putative formula: C32H50O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.431,"smiles":null,"spectrum_id":"CCMSLIB00017215063","spectrum_index":4115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 17.1359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.217,"smiles":null,"spectrum_id":"CCMSLIB00017215065","spectrum_index":4116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 280.1687 Da; putative annotation: N/A; putative formula: C17H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.234,"smiles":null,"spectrum_id":"CCMSLIB00017215066","spectrum_index":4117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 110.0363 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.07,"smiles":null,"spectrum_id":"CCMSLIB00017215067","spectrum_index":4118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-His (delta mass: 99.0613 Da; putative annotation: N/A; putative formula: C5H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.175,"smiles":null,"spectrum_id":"CCMSLIB00017215068","spectrum_index":4119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 570.9061 Da; putative annotation: N/A; putative formula: C13H9N5O13S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.987,"smiles":null,"spectrum_id":"CCMSLIB00017215070","spectrum_index":4120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 75.0748 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.123,"smiles":null,"spectrum_id":"CCMSLIB00017215071","spectrum_index":4121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.18,"smiles":null,"spectrum_id":"CCMSLIB00017215072","spectrum_index":4122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholesterol (delta mass: 298.1134 Da; putative annotation: N/A; putative formula: C9H22N4O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.476,"smiles":null,"spectrum_id":"CCMSLIB00017215075","spectrum_index":4123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 127.0629 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017215076","spectrum_index":4124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 87.0392 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.271,"smiles":null,"spectrum_id":"CCMSLIB00017215077","spectrum_index":4125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 75.0472 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.097,"smiles":null,"spectrum_id":"CCMSLIB00017215078","spectrum_index":4126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.128,"smiles":null,"spectrum_id":"CCMSLIB00017215079","spectrum_index":4127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 246.2196 Da; putative annotation: N/A; putative formula: C15H26N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.3,"smiles":null,"spectrum_id":"CCMSLIB00017215080","spectrum_index":4128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 115.0416 Da; putative annotation: N/A; putative formula: C2H6N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.112,"smiles":null,"spectrum_id":"CCMSLIB00017215082","spectrum_index":4129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 115.9941 Da; putative annotation: N/A; putative formula: C4H6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.06,"smiles":null,"spectrum_id":"CCMSLIB00017215085","spectrum_index":4130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S-Hydroxy-9E,11Z,14Z-eicosatrienoic acid (delta mass: 38.015 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.273,"smiles":null,"spectrum_id":"CCMSLIB00017215086","spectrum_index":4131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 761.2529 Da; putative annotation: N/A; putative formula: C36H43NO17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1266.43,"smiles":null,"spectrum_id":"CCMSLIB00017215087","spectrum_index":4132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxydecanoic acid (delta mass: 207.1108 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.259,"smiles":null,"spectrum_id":"CCMSLIB00017215088","spectrum_index":4133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR302327 Sinapoyl aldehyde (delta mass: 197.0905 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.171,"smiles":null,"spectrum_id":"CCMSLIB00017215091","spectrum_index":4134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxy-2-decenoic acid (delta mass: 121.0191 Da; putative annotation: N/A; putative formula: C5H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.152,"smiles":null,"spectrum_id":"CCMSLIB00017215093","spectrum_index":4135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Hydroxymetoprolol (delta mass: 176.0316 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.217,"smiles":null,"spectrum_id":"CCMSLIB00017215094","spectrum_index":4136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Dodecanedioic acid from NIST14 (delta mass: 56.0249 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.184,"smiles":null,"spectrum_id":"CCMSLIB00017215095","spectrum_index":4137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Chloro-2-hydroxy-4-phenyl-3-quinolinyl)acetic acid (delta mass: 42.0009 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.059,"smiles":null,"spectrum_id":"CCMSLIB00017215096","spectrum_index":4138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PETROSELINIC ACID (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.326,"smiles":null,"spectrum_id":"CCMSLIB00017215097","spectrum_index":4139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 113.0775 Da; putative annotation: N/A; putative formula: C6H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.179,"smiles":null,"spectrum_id":"CCMSLIB00017215100","spectrum_index":4140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 222.068 Da; putative annotation: N/A; putative formula: C15H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.128,"smiles":null,"spectrum_id":"CCMSLIB00017215102","spectrum_index":4141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 77.067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.123,"smiles":null,"spectrum_id":"CCMSLIB00017215103","spectrum_index":4142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-cysteine (delta mass: 55.1323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.17,"smiles":null,"spectrum_id":"CCMSLIB00017215104","spectrum_index":4143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 166.0635 Da; putative annotation: N/A; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.139,"smiles":null,"spectrum_id":"CCMSLIB00017215105","spectrum_index":4144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 21.0643 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.087,"smiles":null,"spectrum_id":"CCMSLIB00017215106","spectrum_index":4145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyclopropyl-1H-imidazol-2-amine (delta mass: 83.037 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.124,"smiles":null,"spectrum_id":"CCMSLIB00017215109","spectrum_index":4146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 250.1769 Da; putative annotation: N/A; putative formula: C9H18N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.279,"smiles":null,"spectrum_id":"CCMSLIB00017215111","spectrum_index":4147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 159.0896 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.218,"smiles":null,"spectrum_id":"CCMSLIB00017215112","spectrum_index":4148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 37.0279 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.109,"smiles":null,"spectrum_id":"CCMSLIB00017215113","spectrum_index":4149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid propyl ester (delta mass: 33.9843 Da; putative annotation: N/A; putative formula: C3H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.07,"smiles":null,"spectrum_id":"CCMSLIB00017215114","spectrum_index":4150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.6]undecane-2,4-dione (delta mass: 297.1437 Da; putative annotation: N/A; putative formula: C12H19N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.257,"smiles":null,"spectrum_id":"CCMSLIB00017215115","spectrum_index":4151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 674.6017 Da; putative annotation: N/A; putative formula: C47H78O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.865,"smiles":null,"spectrum_id":"CCMSLIB00017215117","spectrum_index":4152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; CorrDec (delta mass: 60.0326 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.093,"smiles":null,"spectrum_id":"CCMSLIB00017215120","spectrum_index":4153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 151.0997 Da; putative annotation: N/A; putative formula: C9H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.191,"smiles":null,"spectrum_id":"CCMSLIB00017215121","spectrum_index":4154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D2 (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017215122","spectrum_index":4155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,3aS,6aR)-Hexahydrofuro[2,3-b]furan-3-ol (delta mass: 385.4279 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.498,"smiles":null,"spectrum_id":"CCMSLIB00017215123","spectrum_index":4156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 175.0631 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.149,"smiles":null,"spectrum_id":"CCMSLIB00017215125","spectrum_index":4157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 104.0588 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.151,"smiles":null,"spectrum_id":"CCMSLIB00017215127","spectrum_index":4158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 629.3749 Da; putative annotation: N/A; putative formula: C28H51N7O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":982.643,"smiles":null,"spectrum_id":"CCMSLIB00017215129","spectrum_index":4159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 106.0028 Da; putative annotation: N/A; putative formula: C2H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.219,"smiles":null,"spectrum_id":"CCMSLIB00017215130","spectrum_index":4160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 49.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017215131","spectrum_index":4161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 138.0508 Da; putative annotation: N/A; putative formula: C8H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.131,"smiles":null,"spectrum_id":"CCMSLIB00017215133","spectrum_index":4162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 737.7483 Da; putative annotation: N/A; putative formula: C30H10O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1047.86,"smiles":null,"spectrum_id":"CCMSLIB00017215134","spectrum_index":4163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 868.4547 Da; putative annotation: N/A; putative formula: C53H52N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.57,"smiles":null,"spectrum_id":"CCMSLIB00017215137","spectrum_index":4164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331604 Linoleic acid|(9Z,12Z)-octadeca-9,12-dienoic acid (delta mass: 112.0886 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.336,"smiles":null,"spectrum_id":"CCMSLIB00017215138","spectrum_index":4165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 64.0677 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.346,"smiles":null,"spectrum_id":"CCMSLIB00017215139","spectrum_index":4166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 271.106 Da; putative annotation: N/A; putative formula: C12H17NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.166,"smiles":null,"spectrum_id":"CCMSLIB00017215141","spectrum_index":4167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Piperidin-3-yl)methanesulfonamide (delta mass: 54.0435 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017215142","spectrum_index":4168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 78.0881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.169,"smiles":null,"spectrum_id":"CCMSLIB00017215143","spectrum_index":4169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 213.1354 Da; putative annotation: N/A; putative formula: C11H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.232,"smiles":null,"spectrum_id":"CCMSLIB00017215146","spectrum_index":4170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 339.1122 Da; putative annotation: N/A; putative formula: C20H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.236,"smiles":null,"spectrum_id":"CCMSLIB00017215148","spectrum_index":4171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 44.0065 Da; putative annotation: N/A; putative formula: C5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.108,"smiles":null,"spectrum_id":"CCMSLIB00017215149","spectrum_index":4172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxycamptothecin (delta mass: 282.2132 Da; putative annotation: N/A; putative formula: C16H30N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.326,"smiles":null,"spectrum_id":"CCMSLIB00017215150","spectrum_index":4173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 58.9881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.09,"smiles":null,"spectrum_id":"CCMSLIB00017215151","spectrum_index":4174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 73.0887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.347,"smiles":null,"spectrum_id":"CCMSLIB00017215152","spectrum_index":4175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 870.3969 Da; putative annotation: N/A; putative formula: C47H59N4O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.49,"smiles":null,"spectrum_id":"CCMSLIB00017215156","spectrum_index":4176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Ketodeoxycholic acid (delta mass: 548.1361 Da; putative annotation: N/A; putative formula: C27H32O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":939.42,"smiles":null,"spectrum_id":"CCMSLIB00017215157","spectrum_index":4177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 83.0626 Da; putative annotation: N/A; putative formula: C2H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.165,"smiles":null,"spectrum_id":"CCMSLIB00017215158","spectrum_index":4178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 92.0635 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.275,"smiles":null,"spectrum_id":"CCMSLIB00017215159","spectrum_index":4179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 24.0367 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017215160","spectrum_index":4180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017215161","spectrum_index":4181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-N-methyl-N-isopropyltryptamine (delta mass: 117.0425 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.207,"smiles":null,"spectrum_id":"CCMSLIB00017215163","spectrum_index":4182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 232.1811 Da; putative annotation: N/A; putative formula: C10H25N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.434,"smiles":null,"spectrum_id":"CCMSLIB00017215166","spectrum_index":4183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 428.204 Da; putative annotation: N/A; putative formula: C26H28N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.415,"smiles":null,"spectrum_id":"CCMSLIB00017215167","spectrum_index":4184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 312.2669 Da; putative annotation: N/A; putative formula: C19H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.308,"smiles":null,"spectrum_id":"CCMSLIB00017215168","spectrum_index":4185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017215169","spectrum_index":4186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 144.0785 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.196,"smiles":null,"spectrum_id":"CCMSLIB00017215170","spectrum_index":4187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 74.0523 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.295,"smiles":null,"spectrum_id":"CCMSLIB00017215172","spectrum_index":4188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 295.1619 Da; putative annotation: N/A; putative formula: C12H25NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.384,"smiles":null,"spectrum_id":"CCMSLIB00017215175","spectrum_index":4189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 183.5687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.64,"smiles":null,"spectrum_id":"CCMSLIB00017215176","spectrum_index":4190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 123.0666 Da; putative annotation: N/A; putative formula: C3H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.163,"smiles":null,"spectrum_id":"CCMSLIB00017215177","spectrum_index":4191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-Binaphthyl-8,8'-dicarboxylic acid (delta mass: 38.2006 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.297,"smiles":null,"spectrum_id":"CCMSLIB00017215178","spectrum_index":4192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 7.9939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.071,"smiles":null,"spectrum_id":"CCMSLIB00017215180","spectrum_index":4193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 422.1288 Da; putative annotation: N/A; putative formula: C9H19N12O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.21,"smiles":null,"spectrum_id":"CCMSLIB00017215181","spectrum_index":4194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxy-12E,14Z-eicosadienoic acid (delta mass: 80.9902 Da; putative annotation: N/A; putative formula: C2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.264,"smiles":null,"spectrum_id":"CCMSLIB00017215184","spectrum_index":4195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 136.0122 Da; putative annotation: N/A; putative formula: C2H4N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.145,"smiles":null,"spectrum_id":"CCMSLIB00017215185","spectrum_index":4196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin Pr-LL (delta mass: 286.189 Da; putative annotation: N/A; putative formula: C14H26N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.507,"smiles":null,"spectrum_id":"CCMSLIB00017215186","spectrum_index":4197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asperilin (delta mass: 54.0465 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.195,"smiles":null,"spectrum_id":"CCMSLIB00017215187","spectrum_index":4198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Pro (delta mass: 193.0838 Da; putative annotation: N/A; putative formula: C5H7N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.197,"smiles":null,"spectrum_id":"CCMSLIB00017215189","spectrum_index":4199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetinic acid (delta mass: 93.0427 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.39,"smiles":null,"spectrum_id":"CCMSLIB00017215191","spectrum_index":4200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 82.0781 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.326,"smiles":null,"spectrum_id":"CCMSLIB00017215192","spectrum_index":4201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 130.0337 Da; putative annotation: N/A; putative formula: C9H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.12,"smiles":null,"spectrum_id":"CCMSLIB00017215193","spectrum_index":4202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactose 1-phosphate - 30.0 eV (delta mass: 522.1786 Da; putative annotation: N/A; putative formula: C23H30N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.216,"smiles":null,"spectrum_id":"CCMSLIB00017215195","spectrum_index":4203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 149.1053 Da; putative annotation: N/A; putative formula: C7H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.353,"smiles":null,"spectrum_id":"CCMSLIB00017215197","spectrum_index":4204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 147.1623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.259,"smiles":null,"spectrum_id":"CCMSLIB00017215198","spectrum_index":4205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 26.0515 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.106,"smiles":null,"spectrum_id":"CCMSLIB00017215199","spectrum_index":4206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 56.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.108,"smiles":null,"spectrum_id":"CCMSLIB00017215200","spectrum_index":4207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 116.1032 Da; putative annotation: N/A; putative formula: C4H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.33,"smiles":null,"spectrum_id":"CCMSLIB00017215202","spectrum_index":4208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 147.0478 Da; putative annotation: N/A; putative formula: C4H11N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.15,"smiles":null,"spectrum_id":"CCMSLIB00017215203","spectrum_index":4209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 46.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.29,"smiles":null,"spectrum_id":"CCMSLIB00017215206","spectrum_index":4210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamyltyrosine (delta mass: 182.1667 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.29,"smiles":null,"spectrum_id":"CCMSLIB00017215207","spectrum_index":4211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dihydroxy-5Z,8Z,14Z-eicosatrienoic acid (delta mass: 104.0623 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.315,"smiles":null,"spectrum_id":"CCMSLIB00017215208","spectrum_index":4212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 112.0507 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.132,"smiles":null,"spectrum_id":"CCMSLIB00017215210","spectrum_index":4213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 92.0472 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.169,"smiles":null,"spectrum_id":"CCMSLIB00017215211","spectrum_index":4214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 305.2442 Da; putative annotation: N/A; putative formula: C14H27N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.52,"smiles":null,"spectrum_id":"CCMSLIB00017215212","spectrum_index":4215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 63.9983 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.168,"smiles":null,"spectrum_id":"CCMSLIB00017215215","spectrum_index":4216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 33.0589 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.129,"smiles":null,"spectrum_id":"CCMSLIB00017215216","spectrum_index":4217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lanosterol (delta mass: 255.2547 Da; putative annotation: N/A; putative formula: C12H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.648,"smiles":null,"spectrum_id":"CCMSLIB00017215218","spectrum_index":4218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 129.1405 Da; putative annotation: N/A; putative formula: C5H15N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017215219","spectrum_index":4219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 74.0732 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.143,"smiles":null,"spectrum_id":"CCMSLIB00017215220","spectrum_index":4220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 488.3354 Da; putative annotation: N/A; putative formula: C27H52O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.372,"smiles":null,"spectrum_id":"CCMSLIB00017215221","spectrum_index":4221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 101.1569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.196,"smiles":null,"spectrum_id":"CCMSLIB00017215224","spectrum_index":4222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Formyl-3-hydroxyphenoxy)methyl]benzoic acid (delta mass: 30.0108 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.086,"smiles":null,"spectrum_id":"CCMSLIB00017215226","spectrum_index":4223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 25.9832 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.168,"smiles":null,"spectrum_id":"CCMSLIB00017215227","spectrum_index":4224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-C17:1 (delta mass: 256.2399 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.53,"smiles":null,"spectrum_id":"CCMSLIB00017215228","spectrum_index":4225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 86.0264 Da; putative annotation: N/A; putative formula: C6H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.112,"smiles":null,"spectrum_id":"CCMSLIB00017215229","spectrum_index":4226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 68.0621 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.341,"smiles":null,"spectrum_id":"CCMSLIB00017215230","spectrum_index":4227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 24.0362 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.159,"smiles":null,"spectrum_id":"CCMSLIB00017215232","spectrum_index":4228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoorientin (delta mass: 54.0474 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.155,"smiles":null,"spectrum_id":"CCMSLIB00017215235","spectrum_index":4229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 233.1248 Da; putative annotation: N/A; putative formula: C7H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.341,"smiles":null,"spectrum_id":"CCMSLIB00017215236","spectrum_index":4230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C5:0 (delta mass: 210.1973 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.341,"smiles":null,"spectrum_id":"CCMSLIB00017215237","spectrum_index":4231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12-Ketodeoxycholic acid from NIST14 (delta mass: 113.9807 Da; putative annotation: N/A; putative formula: C3H3N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.265,"smiles":null,"spectrum_id":"CCMSLIB00017215238","spectrum_index":4232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 363.335 Da; putative annotation: N/A; putative formula: C21H41N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.598,"smiles":null,"spectrum_id":"CCMSLIB00017215239","spectrum_index":4233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 17.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.253,"smiles":null,"spectrum_id":"CCMSLIB00017215241","spectrum_index":4234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyltetrahydro-2(1H)-pyrimidinethione (delta mass: 24.9963 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.06,"smiles":null,"spectrum_id":"CCMSLIB00017215243","spectrum_index":4235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 296.1488 Da; putative annotation: N/A; putative formula: C13H20N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.282,"smiles":null,"spectrum_id":"CCMSLIB00017215244","spectrum_index":4236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 160.0526 Da; putative annotation: 4-Methoxycinnamic acid; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.181,"smiles":null,"spectrum_id":"CCMSLIB00017215245","spectrum_index":4237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid (delta mass: 97.0512 Da; putative annotation: PROLINE; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.19,"smiles":null,"spectrum_id":"CCMSLIB00017215246","spectrum_index":4238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 154.0029 Da; putative annotation: GLYCEROL 3-PHOSPHATE; putative formula: C3H7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.04,"smiles":null,"spectrum_id":"CCMSLIB00017215248","spectrum_index":4239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pergolide sulfoxide (delta mass: 330.1869 Da; putative annotation: 2-(Furan-3-yl)-7,8-dihydroxy-6a,7,10b-trimethyl-2,4a,5,6,8,9,10,10a-octahydro-1H-benzo[f]isochromen-4-one; putative formula: C20H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.371,"smiles":null,"spectrum_id":"CCMSLIB00017215250","spectrum_index":4240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 144.0415 Da; putative annotation: Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.218,"smiles":null,"spectrum_id":"CCMSLIB00017215252","spectrum_index":4241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 286.2294 Da; putative annotation: (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde; putative formula: C20H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.358,"smiles":null,"spectrum_id":"CCMSLIB00017215253","spectrum_index":4242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 278.0902 Da; putative annotation: Methyl 2-[(3-formamido-2-hydroxybenzoyl)amino]-3-hydroxybutanoate; putative formula: C13H14N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.192,"smiles":null,"spectrum_id":"CCMSLIB00017215254","spectrum_index":4243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 114.0312 Da; putative annotation: Ethyl hydrogen malonate; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.091,"smiles":null,"spectrum_id":"CCMSLIB00017215255","spectrum_index":4244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-6E,8Z,11Z,14Z,17Z-eicosapentaenoic acid (delta mass: 282.198 Da; putative annotation: Grandiflorenic acid; putative formula: C20H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.425,"smiles":null,"spectrum_id":"CCMSLIB00017215258","spectrum_index":4245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 368.2786 Da; putative annotation: Luffariellolide; putative formula: C25H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.51,"smiles":null,"spectrum_id":"CCMSLIB00017215260","spectrum_index":4246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 333.2304 Da; putative annotation: N-3-Oxohexadec-11Z-enoyl-L-homoserine lactone; putative formula: C20H31NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.468,"smiles":null,"spectrum_id":"CCMSLIB00017215261","spectrum_index":4247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cedrol (delta mass: 398.2687 Da; putative annotation: Agaric acid; putative formula: C22H38O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.474,"smiles":null,"spectrum_id":"CCMSLIB00017215262","spectrum_index":4248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 368.2571 Da; putative annotation: 3-Methoxyprostaglandin F1.alpha.; putative formula: C21H36O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.473,"smiles":null,"spectrum_id":"CCMSLIB00017215263","spectrum_index":4249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 113.0841 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017215264","spectrum_index":4250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2 ethanolamide (delta mass: 148.0889 Da; putative annotation: 5-Hydroxyadamantan-2-one; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.363,"smiles":null,"spectrum_id":"CCMSLIB00017215267","spectrum_index":4251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 488.351 Da; putative annotation: NCGC00380960-01_C30H50O6_13,17,24,25-Tetrahydroxy-16,23-epoxydammaran-3-one; putative formula: C30H48O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":959.698,"smiles":null,"spectrum_id":"CCMSLIB00017215269","spectrum_index":4252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 363.2813 Da; putative annotation: Prostaglandin F2.alpha. ethylamide; putative formula: C22H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.513,"smiles":null,"spectrum_id":"CCMSLIB00017215270","spectrum_index":4253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 124.0887 Da; putative annotation: 3-Methyl-1-cyclohexanecarboxylic acid; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017215271","spectrum_index":4254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-6-Octadecenoic acid (delta mass: 254.2236 Da; putative annotation: DL-.beta.-Hydroxypalmitic acid; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.487,"smiles":null,"spectrum_id":"CCMSLIB00017215272","spectrum_index":4255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 180.0785 Da; putative annotation: 5-(4-methyl-5-oxo-2H-furan-3-yl)pentanoic acid; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.31,"smiles":null,"spectrum_id":"CCMSLIB00017215273","spectrum_index":4256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 203.0957 Da; putative annotation: 3,4-Ethylenedioxymethcathinone; putative formula: C12H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.193,"smiles":null,"spectrum_id":"CCMSLIB00017215275","spectrum_index":4257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 391.3431 Da; putative annotation: Gly-C23:1; putative formula: C25H45NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.596,"smiles":null,"spectrum_id":"CCMSLIB00017215277","spectrum_index":4258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 74.0365 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.086,"smiles":null,"spectrum_id":"CCMSLIB00017215279","spectrum_index":4259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 35.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.274,"smiles":null,"spectrum_id":"CCMSLIB00017215280","spectrum_index":4260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 70.0531 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.133,"smiles":null,"spectrum_id":"CCMSLIB00017215281","spectrum_index":4261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 204.0783 Da; putative annotation: N/A; putative formula: C12H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.19,"smiles":null,"spectrum_id":"CCMSLIB00017215282","spectrum_index":4262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.beta.-Hydroxydehydroepiandrosterone (delta mass: 156.0763 Da; putative annotation: N/A; putative formula: C4H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.287,"smiles":null,"spectrum_id":"CCMSLIB00017215284","spectrum_index":4263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 222.1109 Da; putative annotation: N/A; putative formula: C9H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.244,"smiles":null,"spectrum_id":"CCMSLIB00017215286","spectrum_index":4264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2-1-glyceryl ester (delta mass: 86.0514 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.32,"smiles":null,"spectrum_id":"CCMSLIB00017215288","spectrum_index":4265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 233.0538 Da; putative annotation: N/A; putative formula: C8H11NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.103,"smiles":null,"spectrum_id":"CCMSLIB00017215289","spectrum_index":4266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311112 Caffeoyl putrescin (isomer of 1059) (delta mass: 162.0318 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.171,"smiles":null,"spectrum_id":"CCMSLIB00017215290","spectrum_index":4267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 50.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.175,"smiles":null,"spectrum_id":"CCMSLIB00017215292","spectrum_index":4268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dimethyl-1H-benzimidazole-2-thiol (delta mass: 209.0954 Da; putative annotation: N/A; putative formula: C13H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.159,"smiles":null,"spectrum_id":"CCMSLIB00017215293","spectrum_index":4269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentanedioic acid, 3-(1E)-1-propen-1-yl- (delta mass: 84.0575 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.138,"smiles":null,"spectrum_id":"CCMSLIB00017215295","spectrum_index":4270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 265.8172 Da; putative annotation: N/A; putative formula: C2H4O-1P2S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.888,"smiles":null,"spectrum_id":"CCMSLIB00017215297","spectrum_index":4271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 133.0452 Da; putative annotation: N/A; putative formula: C8H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.086,"smiles":null,"spectrum_id":"CCMSLIB00017215298","spectrum_index":4272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tapentadol (delta mass: 17.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.211,"smiles":null,"spectrum_id":"CCMSLIB00017215300","spectrum_index":4273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihexadecanoyl-sn-glycerol (delta mass: 279.2562 Da; putative annotation: N/A; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.77,"smiles":null,"spectrum_id":"CCMSLIB00017215301","spectrum_index":4274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholestan-3-ol, (3.alpha.,5.beta.)- (delta mass: 258.1316 Da; putative annotation: N/A; putative formula: C12H23N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.509,"smiles":null,"spectrum_id":"CCMSLIB00017215302","spectrum_index":4275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 52.0672 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.268,"smiles":null,"spectrum_id":"CCMSLIB00017215304","spectrum_index":4276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycodeoxycholic acid (delta mass: 190.1143 Da; putative annotation: N/A; putative formula: C8H18N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.436,"smiles":null,"spectrum_id":"CCMSLIB00017215306","spectrum_index":4277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 145.1474 Da; putative annotation: N/A; putative formula: C4H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.271,"smiles":null,"spectrum_id":"CCMSLIB00017215308","spectrum_index":4278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 80.063 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.29,"smiles":null,"spectrum_id":"CCMSLIB00017215309","spectrum_index":4279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 90.0851 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.312,"smiles":null,"spectrum_id":"CCMSLIB00017215310","spectrum_index":4280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 390.7839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.881,"smiles":null,"spectrum_id":"CCMSLIB00017215311","spectrum_index":4281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 102.0799 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.219,"smiles":null,"spectrum_id":"CCMSLIB00017215314","spectrum_index":4282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 89.0078 Da; putative annotation: N/A; putative formula: CH3N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.107,"smiles":null,"spectrum_id":"CCMSLIB00017215316","spectrum_index":4283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 178.9978 Da; putative annotation: N/A; putative formula: C7H5N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.058,"smiles":null,"spectrum_id":"CCMSLIB00017215317","spectrum_index":4284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384624-01_C55H84O25_4-O-Acetyl-6-deoxy-2-O-(6-deoxy-alpha-L-mannopyranosyl)-3-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-1-O-[(2beta,3beta,5xi,9xi)-3-(beta-D-glucopyranuronosyloxy)-2,23-dihydroxy-23,28-dioxoolean-12-en-28-yl]-beta-D-galactopyranose (delta mass: 78.0042 Da; putative annotation: N/A; putative formula: C5H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1223.54,"smiles":null,"spectrum_id":"CCMSLIB00017215318","spectrum_index":4285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 147.0894 Da; putative annotation: N/A; putative formula: C6H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.337,"smiles":null,"spectrum_id":"CCMSLIB00017215319","spectrum_index":4286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 215.1529 Da; putative annotation: N/A; putative formula: C12H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.244,"smiles":null,"spectrum_id":"CCMSLIB00017215320","spectrum_index":4287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 110.0754 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.354,"smiles":null,"spectrum_id":"CCMSLIB00017215322","spectrum_index":4288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 407.3061 Da; putative annotation: N/A; putative formula: C23H42N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.445,"smiles":null,"spectrum_id":"CCMSLIB00017215324","spectrum_index":4289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 378.1527 Da; putative annotation: N/A; putative formula: C21H24N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.228,"smiles":null,"spectrum_id":"CCMSLIB00017215326","spectrum_index":4290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 9.0001 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.081,"smiles":null,"spectrum_id":"CCMSLIB00017215327","spectrum_index":4291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 128.0587 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.108,"smiles":null,"spectrum_id":"CCMSLIB00017215328","spectrum_index":4292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026502 5?-CHOLANIC ACID-3?_ 12?-DIOL-7-ONE|7-Ketodeoxycholic acid|(4R)-4-[(3R,5S,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]ph (delta mass: 35.0379 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.317,"smiles":null,"spectrum_id":"CCMSLIB00017215329","spectrum_index":4293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 168.1879 Da; putative annotation: N/A; putative formula: C12H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.232,"smiles":null,"spectrum_id":"CCMSLIB00017215331","spectrum_index":4294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 245.216 Da; putative annotation: N/A; putative formula: C17H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.443,"smiles":null,"spectrum_id":"CCMSLIB00017215334","spectrum_index":4295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arachidic acid (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.373,"smiles":null,"spectrum_id":"CCMSLIB00017215335","spectrum_index":4296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 62.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017215336","spectrum_index":4297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 135.0684 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.149,"smiles":null,"spectrum_id":"CCMSLIB00017215337","spectrum_index":4298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 146.0363 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.148,"smiles":null,"spectrum_id":"CCMSLIB00017215338","spectrum_index":4299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 142.0626 Da; putative annotation: N/A; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.143,"smiles":null,"spectrum_id":"CCMSLIB00017215340","spectrum_index":4300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 31.9888 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.236,"smiles":null,"spectrum_id":"CCMSLIB00017215343","spectrum_index":4301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 142.0778 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.445,"smiles":null,"spectrum_id":"CCMSLIB00017215344","spectrum_index":4302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 90.0827 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.33,"smiles":null,"spectrum_id":"CCMSLIB00017215345","spectrum_index":4303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 43.9829 Da; putative annotation: N/A; putative formula: N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.059,"smiles":null,"spectrum_id":"CCMSLIB00017215346","spectrum_index":4304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 36.0441 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.136,"smiles":null,"spectrum_id":"CCMSLIB00017215347","spectrum_index":4305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 18.0027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.116,"smiles":null,"spectrum_id":"CCMSLIB00017215349","spectrum_index":4306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 565.5066 Da; putative annotation: N/A; putative formula: C35H67NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.733,"smiles":null,"spectrum_id":"CCMSLIB00017215352","spectrum_index":4307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 160.8446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.931,"smiles":null,"spectrum_id":"CCMSLIB00017215353","spectrum_index":4308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 109.0937 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.16,"smiles":null,"spectrum_id":"CCMSLIB00017215354","spectrum_index":4309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 73.0521 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.165,"smiles":null,"spectrum_id":"CCMSLIB00017215355","spectrum_index":4310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 84.0575 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.186,"smiles":null,"spectrum_id":"CCMSLIB00017215357","spectrum_index":4311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 163.0323 Da; putative annotation: N/A; putative formula: C6H5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.103,"smiles":null,"spectrum_id":"CCMSLIB00017215360","spectrum_index":4312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid (delta mass: 465.189 Da; putative annotation: N/A; putative formula: C19H28N7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.28,"smiles":null,"spectrum_id":"CCMSLIB00017215361","spectrum_index":4313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 575.3902 Da; putative annotation: N/A; putative formula: C28H57N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.674,"smiles":null,"spectrum_id":"CCMSLIB00017215362","spectrum_index":4314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .DELTA.2-Androstene-1.alpha.,17.beta.-diol acetate (delta mass: 216.1151 Da; putative annotation: N/A; putative formula: C14H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.357,"smiles":null,"spectrum_id":"CCMSLIB00017215363","spectrum_index":4315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidine (delta mass: 63.8969 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.077,"smiles":null,"spectrum_id":"CCMSLIB00017215365","spectrum_index":4316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA000903 PHIP|1-methyl-6-phenylimidazo[4,5-b]pyridin-2-amine (delta mass: 33.0738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.187,"smiles":null,"spectrum_id":"CCMSLIB00017215366","spectrum_index":4317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 71.014 Da; putative annotation: N/A; putative formula: C6HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.241,"smiles":null,"spectrum_id":"CCMSLIB00017215369","spectrum_index":4318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 16.0961 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.146,"smiles":null,"spectrum_id":"CCMSLIB00017215370","spectrum_index":4319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 54.017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.06,"smiles":null,"spectrum_id":"CCMSLIB00017215372","spectrum_index":4320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 609.5702 Da; putative annotation: N/A; putative formula: C38H75NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.786,"smiles":null,"spectrum_id":"CCMSLIB00017215373","spectrum_index":4321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 139.0599 Da; putative annotation: N/A; putative formula: C3H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.14,"smiles":null,"spectrum_id":"CCMSLIB00017215374","spectrum_index":4322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 53.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017215377","spectrum_index":4323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epilupeol (delta mass: 148.0938 Da; putative annotation: N/A; putative formula: C4H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.487,"smiles":null,"spectrum_id":"CCMSLIB00017215378","spectrum_index":4324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 100.0163 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.098,"smiles":null,"spectrum_id":"CCMSLIB00017215380","spectrum_index":4325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 132.0926 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.173,"smiles":null,"spectrum_id":"CCMSLIB00017215381","spectrum_index":4326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl indole-4-carboxylate (delta mass: 272.271 Da; putative annotation: N/A; putative formula: C13H32N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.342,"smiles":null,"spectrum_id":"CCMSLIB00017215382","spectrum_index":4327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 910.7631 Da; putative annotation: N/A; putative formula: C29H25N3O-1S16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1073.82,"smiles":null,"spectrum_id":"CCMSLIB00017215383","spectrum_index":4328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Phe (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.223,"smiles":null,"spectrum_id":"CCMSLIB00017215386","spectrum_index":4329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 71.0736 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.243,"smiles":null,"spectrum_id":"CCMSLIB00017215388","spectrum_index":4330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mellein (delta mass: 144.0784 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.149,"smiles":null,"spectrum_id":"CCMSLIB00017215389","spectrum_index":4331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381059-01!5-[5-(3,5-dihydroxydecanoyloxy)-3-hydroxydecanoyl]oxy-3-hydroxydecanoic acid (delta mass: 372.2405 Da; putative annotation: N/A; putative formula: C24H37O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":949.635,"smiles":null,"spectrum_id":"CCMSLIB00017215390","spectrum_index":4332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380585-01!(E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid (delta mass: 14.0144 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.169,"smiles":null,"spectrum_id":"CCMSLIB00017215391","spectrum_index":4333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 420.3381 Da; putative annotation: N/A; putative formula: C24H45N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":925.514,"smiles":null,"spectrum_id":"CCMSLIB00017215393","spectrum_index":4334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Tetrahydro-3-furanyl-4-piperidinamine (delta mass: 39.9836 Da; putative annotation: N/A; putative formula: C2HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017215396","spectrum_index":4335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 75.9813 Da; putative annotation: N/A; putative formula: C2H4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.062,"smiles":null,"spectrum_id":"CCMSLIB00017215397","spectrum_index":4336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 287.2456 Da; putative annotation: N/A; putative formula: C16H33NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.306,"smiles":null,"spectrum_id":"CCMSLIB00017215398","spectrum_index":4337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 280.2381 Da; putative annotation: N/A; putative formula: C14H28N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.345,"smiles":null,"spectrum_id":"CCMSLIB00017215399","spectrum_index":4338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 94.0686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.17,"smiles":null,"spectrum_id":"CCMSLIB00017215401","spectrum_index":4339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 67.0686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.171,"smiles":null,"spectrum_id":"CCMSLIB00017215402","spectrum_index":4340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxy-4Z,7Z,9E,13Z,16Z,19Z-docosahexaenoic acid (delta mass: 15.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.29,"smiles":null,"spectrum_id":"CCMSLIB00017215405","spectrum_index":4341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 195.035 Da; putative annotation: N/A; putative formula: C11H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.077,"smiles":null,"spectrum_id":"CCMSLIB00017215406","spectrum_index":4342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 71.9849 Da; putative annotation: N/A; putative formula: C2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.05,"smiles":null,"spectrum_id":"CCMSLIB00017215407","spectrum_index":4343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1047.6548 Da; putative annotation: N/A; putative formula: C63H89N3O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1210.71,"smiles":null,"spectrum_id":"CCMSLIB00017215409","spectrum_index":4344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of QuinicAcid (delta mass: 118.0774 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.148,"smiles":null,"spectrum_id":"CCMSLIB00017215410","spectrum_index":4345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 567.3429 Da; putative annotation: N/A; putative formula: C32H41N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.445,"smiles":null,"spectrum_id":"CCMSLIB00017215413","spectrum_index":4346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2Z)-((4R,5S,6S)-6-(.beta.-D-Glucopyranosyloxy)-4,5-dihydroxycyclohex-2-en-1-ylidene)acetonitrile (delta mass: 150.0319 Da; putative annotation: N/A; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.15,"smiles":null,"spectrum_id":"CCMSLIB00017215414","spectrum_index":4347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 118.0868 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.35,"smiles":null,"spectrum_id":"CCMSLIB00017215415","spectrum_index":4348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 357.2003 Da; putative annotation: N/A; putative formula: C17H32N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.265,"smiles":null,"spectrum_id":"CCMSLIB00017215417","spectrum_index":4349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 39.9834 Da; putative annotation: N/A; putative formula: C2HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.055,"smiles":null,"spectrum_id":"CCMSLIB00017215418","spectrum_index":4350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 26.9413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.976,"smiles":null,"spectrum_id":"CCMSLIB00017215420","spectrum_index":4351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Wilforine (delta mass: 45.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.359,"smiles":null,"spectrum_id":"CCMSLIB00017215422","spectrum_index":4352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 28.9686 Da; putative annotation: N/A; putative formula: C13H18N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.096,"smiles":null,"spectrum_id":"CCMSLIB00017215424","spectrum_index":4353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stigmaydene Y (delta mass: 132.0951 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.317,"smiles":null,"spectrum_id":"CCMSLIB00017215425","spectrum_index":4354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 611.4893 Da; putative annotation: N/A; putative formula: C43H65NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.721,"smiles":null,"spectrum_id":"CCMSLIB00017215426","spectrum_index":4355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 31.9904 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.093,"smiles":null,"spectrum_id":"CCMSLIB00017215428","spectrum_index":4356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 280.1502 Da; putative annotation: N/A; putative formula: C10H27N4O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.309,"smiles":null,"spectrum_id":"CCMSLIB00017215429","spectrum_index":4357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 109.0497 Da; putative annotation: N/A; putative formula: C2H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.145,"smiles":null,"spectrum_id":"CCMSLIB00017215432","spectrum_index":4358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 153.1037 Da; putative annotation: N/A; putative formula: C6H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.221,"smiles":null,"spectrum_id":"CCMSLIB00017215433","spectrum_index":4359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 83.0734 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.17,"smiles":null,"spectrum_id":"CCMSLIB00017215435","spectrum_index":4360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(9H-Carbazol-9-yl)propanoic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.112,"smiles":null,"spectrum_id":"CCMSLIB00017215436","spectrum_index":4361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 743.2326 Da; putative annotation: N/A; putative formula: C38H37N3O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":909.319,"smiles":null,"spectrum_id":"CCMSLIB00017215437","spectrum_index":4362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxypropionic acid (delta mass: 92.0253 Da; putative annotation: N/A; putative formula: H5N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.096,"smiles":null,"spectrum_id":"CCMSLIB00017215440","spectrum_index":4363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12-Ketodeoxycholic acid from NIST14 (delta mass: 488.2515 Da; putative annotation: N/A; putative formula: C28H41O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.536,"smiles":null,"spectrum_id":"CCMSLIB00017215442","spectrum_index":4364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 40.031 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.128,"smiles":null,"spectrum_id":"CCMSLIB00017215443","spectrum_index":4365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLADENINE - 60.0 eV (delta mass: 68.0454 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.123,"smiles":null,"spectrum_id":"CCMSLIB00017215444","spectrum_index":4366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 131.0647 Da; putative annotation: N/A; putative formula: C3H9N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.115,"smiles":null,"spectrum_id":"CCMSLIB00017215445","spectrum_index":4367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 86.0766 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.168,"smiles":null,"spectrum_id":"CCMSLIB00017215446","spectrum_index":4368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 245.1711 Da; putative annotation: N/A; putative formula: C16H24NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.32,"smiles":null,"spectrum_id":"CCMSLIB00017215449","spectrum_index":4369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,19-Dihydroxy-3-oxo-12-ursen-28-oic acid (delta mass: 70.0426 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.384,"smiles":null,"spectrum_id":"CCMSLIB00017215451","spectrum_index":4370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 663.2288 Da; putative annotation: N/A; putative formula: C31H33N7O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.31,"smiles":null,"spectrum_id":"CCMSLIB00017215452","spectrum_index":4371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 32.015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.154,"smiles":null,"spectrum_id":"CCMSLIB00017215453","spectrum_index":4372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 318.1824 Da; putative annotation: N/A; putative formula: C19H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.253,"smiles":null,"spectrum_id":"CCMSLIB00017215454","spectrum_index":4373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 330.1583 Da; putative annotation: N/A; putative formula: C18H22N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.224,"smiles":null,"spectrum_id":"CCMSLIB00017215455","spectrum_index":4374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatrienoic acid (delta mass: 137.1052 Da; putative annotation: N/A; putative formula: C6H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.4,"smiles":null,"spectrum_id":"CCMSLIB00017215457","spectrum_index":4375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 131.0372 Da; putative annotation: N/A; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017215460","spectrum_index":4376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 455.2705 Da; putative annotation: N/A; putative formula: C24H41NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.409,"smiles":null,"spectrum_id":"CCMSLIB00017215461","spectrum_index":4377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 86.0522 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017215462","spectrum_index":4378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 72.0237 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.104,"smiles":null,"spectrum_id":"CCMSLIB00017215463","spectrum_index":4379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 294.2877 Da; putative annotation: N/A; putative formula: C16H34N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":887.563,"smiles":null,"spectrum_id":"CCMSLIB00017215465","spectrum_index":4380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 98.0727 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.289,"smiles":null,"spectrum_id":"CCMSLIB00017215467","spectrum_index":4381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxycinnamic acid (delta mass: 303.1948 Da; putative annotation: N/A; putative formula: C17H25N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.26,"smiles":null,"spectrum_id":"CCMSLIB00017215469","spectrum_index":4382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 616.4456 Da; putative annotation: N/A; putative formula: C36H60N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.677,"smiles":null,"spectrum_id":"CCMSLIB00017215470","spectrum_index":4383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.128,"smiles":null,"spectrum_id":"CCMSLIB00017215471","spectrum_index":4384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.113,"smiles":null,"spectrum_id":"CCMSLIB00017215473","spectrum_index":4385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 303.2778 Da; putative annotation: N/A; putative formula: C18H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.562,"smiles":null,"spectrum_id":"CCMSLIB00017215474","spectrum_index":4386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of benzoic_acid (delta mass: 39.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.112,"smiles":null,"spectrum_id":"CCMSLIB00017215477","spectrum_index":4387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dimyristin (delta mass: 76.067 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.518,"smiles":null,"spectrum_id":"CCMSLIB00017215478","spectrum_index":4388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl trans-cinnamic acid (delta mass: 352.1423 Da; putative annotation: N/A; putative formula: C20H20N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.218,"smiles":null,"spectrum_id":"CCMSLIB00017215480","spectrum_index":4389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 38.0158 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.149,"smiles":null,"spectrum_id":"CCMSLIB00017215481","spectrum_index":4390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 158.0582 Da; putative annotation: N/A; putative formula: C7H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.108,"smiles":null,"spectrum_id":"CCMSLIB00017215482","spectrum_index":4391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-4,10-Dimethylidene-7-propan-2-ylcyclodec-5-en-1-ol (delta mass: 104.0949 Da; putative annotation: N/A; putative formula: H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.285,"smiles":null,"spectrum_id":"CCMSLIB00017215484","spectrum_index":4392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 125.0694 Da; putative annotation: N/A; putative formula: C4H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017215487","spectrum_index":4393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhistamine (delta mass: 71.0369 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.139,"smiles":null,"spectrum_id":"CCMSLIB00017215488","spectrum_index":4394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017215489","spectrum_index":4395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 220.1469 Da; putative annotation: N/A; putative formula: C14H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.223,"smiles":null,"spectrum_id":"CCMSLIB00017215490","spectrum_index":4396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Octahydro-2H-pyrido[1,2-a]pyrazine (delta mass: 27.9953 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.134,"smiles":null,"spectrum_id":"CCMSLIB00017215492","spectrum_index":4397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 44.0065 Da; putative annotation: N/A; putative formula: C5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.093,"smiles":null,"spectrum_id":"CCMSLIB00017215495","spectrum_index":4398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 13.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.171,"smiles":null,"spectrum_id":"CCMSLIB00017215496","spectrum_index":4399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Keto-1-methyl-3H-imidazo[4,5-b]pyridin-6-yl)benzamide (delta mass: 85.0177 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.121,"smiles":null,"spectrum_id":"CCMSLIB00017215497","spectrum_index":4400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 337.1426 Da; putative annotation: N/A; putative formula: C19H19N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.292,"smiles":null,"spectrum_id":"CCMSLIB00017215498","spectrum_index":4401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 36.0477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.144,"smiles":null,"spectrum_id":"CCMSLIB00017215499","spectrum_index":4402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 58.0606 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.136,"smiles":null,"spectrum_id":"CCMSLIB00017215502","spectrum_index":4403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 86.073 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017215504","spectrum_index":4404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 1-piperazinecarboxylate (delta mass: 59.999 Da; putative annotation: N/A; putative formula: C5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.096,"smiles":null,"spectrum_id":"CCMSLIB00017215505","spectrum_index":4405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 164.119 Da; putative annotation: N/A; putative formula: C11H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.174,"smiles":null,"spectrum_id":"CCMSLIB00017215506","spectrum_index":4406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 17.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.15,"smiles":null,"spectrum_id":"CCMSLIB00017215507","spectrum_index":4407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 72.0397 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.288,"smiles":null,"spectrum_id":"CCMSLIB00017215509","spectrum_index":4408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 559.1491 Da; putative annotation: N/A; putative formula: C41H22NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.288,"smiles":null,"spectrum_id":"CCMSLIB00017215512","spectrum_index":4409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 14.0146 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.377,"smiles":null,"spectrum_id":"CCMSLIB00017215513","spectrum_index":4410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 158.1133 Da; putative annotation: N/A; putative formula: C9H18S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.341,"smiles":null,"spectrum_id":"CCMSLIB00017215514","spectrum_index":4411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 73.064 Da; putative annotation: N/A; putative formula: C2H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.135,"smiles":null,"spectrum_id":"CCMSLIB00017215515","spectrum_index":4412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Piperazin-1-yl)ethanamine (delta mass: 85.053 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.187,"smiles":null,"spectrum_id":"CCMSLIB00017215516","spectrum_index":4413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 245.0418 Da; putative annotation: N/A; putative formula: C15H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.18,"smiles":null,"spectrum_id":"CCMSLIB00017215518","spectrum_index":4414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 247.1045 Da; putative annotation: N/A; putative formula: C14H19NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.18,"smiles":null,"spectrum_id":"CCMSLIB00017215521","spectrum_index":4415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017215522","spectrum_index":4416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-8-quinolinol (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017215523","spectrum_index":4417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 137.0462 Da; putative annotation: N/A; putative formula: C3H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.111,"smiles":null,"spectrum_id":"CCMSLIB00017215524","spectrum_index":4418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 343.2679 Da; putative annotation: N/A; putative formula: C18H39N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.37,"smiles":null,"spectrum_id":"CCMSLIB00017215525","spectrum_index":4419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 16.0325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.092,"smiles":null,"spectrum_id":"CCMSLIB00017215526","spectrum_index":4420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethyl-4-hydroxybenzaldehyde (delta mass: 54.0316 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.107,"smiles":null,"spectrum_id":"CCMSLIB00017215530","spectrum_index":4421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 16.9655 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.042,"smiles":null,"spectrum_id":"CCMSLIB00017215531","spectrum_index":4422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 76.0673 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.294,"smiles":null,"spectrum_id":"CCMSLIB00017215532","spectrum_index":4423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Syringaldehyde (delta mass: 46.0024 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.068,"smiles":null,"spectrum_id":"CCMSLIB00017215533","spectrum_index":4424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.226,"smiles":null,"spectrum_id":"CCMSLIB00017215534","spectrum_index":4425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12-Ketodeoxycholic acid from NIST14 (delta mass: 112.9784 Da; putative annotation: N/A; putative formula: C2N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.263,"smiles":null,"spectrum_id":"CCMSLIB00017215535","spectrum_index":4426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid (delta mass: 146.0584 Da; putative annotation: N/A; putative formula: C7H14O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.197,"smiles":null,"spectrum_id":"CCMSLIB00017215539","spectrum_index":4427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 68.0618 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.304,"smiles":null,"spectrum_id":"CCMSLIB00017215540","spectrum_index":4428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 501.491 Da; putative annotation: N/A; putative formula: C34H63NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.562,"smiles":null,"spectrum_id":"CCMSLIB00017215541","spectrum_index":4429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Asp (delta mass: 113.0844 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.182,"smiles":null,"spectrum_id":"CCMSLIB00017215542","spectrum_index":4430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 36.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.154,"smiles":null,"spectrum_id":"CCMSLIB00017215543","spectrum_index":4431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 154.0734 Da; putative annotation: N/A; putative formula: C7H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.133,"smiles":null,"spectrum_id":"CCMSLIB00017215545","spectrum_index":4432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 27.3983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.458,"smiles":null,"spectrum_id":"CCMSLIB00017215548","spectrum_index":4433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Echinocystic acid (delta mass: 149.0685 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.431,"smiles":null,"spectrum_id":"CCMSLIB00017215549","spectrum_index":4434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 299.2075 Da; putative annotation: N/A; putative formula: C20H29NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.434,"smiles":null,"spectrum_id":"CCMSLIB00017215550","spectrum_index":4435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 193.0591 Da; putative annotation: N/A; putative formula: C7H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.302,"smiles":null,"spectrum_id":"CCMSLIB00017215551","spectrum_index":4436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,5R,9S,13R,15S)-15-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 158.0223 Da; putative annotation: N/A; putative formula: C7H10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.249,"smiles":null,"spectrum_id":"CCMSLIB00017215553","spectrum_index":4437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 25-Hydroxycholesterol (delta mass: 255.2559 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.613,"smiles":null,"spectrum_id":"CCMSLIB00017215556","spectrum_index":4438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,8-Dihydroxy-8a-methyl-3,5-dimethylidenedecahydronaphtho[2,3-b]furan-2(3H)-one (delta mass: 179.0772 Da; putative annotation: N/A; putative formula: C10H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.221,"smiles":null,"spectrum_id":"CCMSLIB00017215557","spectrum_index":4439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-3-ol (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.071,"smiles":null,"spectrum_id":"CCMSLIB00017215558","spectrum_index":4440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 62.0751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.286,"smiles":null,"spectrum_id":"CCMSLIB00017215559","spectrum_index":4441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flindersine CollisionEnergy:102040 (delta mass: 74.0364 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.138,"smiles":null,"spectrum_id":"CCMSLIB00017215560","spectrum_index":4442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9,10-Dihydro-9,10-ethanoanthracen-11-yl)methanamine (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.149,"smiles":null,"spectrum_id":"CCMSLIB00017215561","spectrum_index":4443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 185.0686 Da; putative annotation: N/A; putative formula: C8H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.139,"smiles":null,"spectrum_id":"CCMSLIB00017215564","spectrum_index":4444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 244.106 Da; putative annotation: N/A; putative formula: C10H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.229,"smiles":null,"spectrum_id":"CCMSLIB00017215566","spectrum_index":4445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 181.9891 Da; putative annotation: N/A; putative formula: C5H10OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.06,"smiles":null,"spectrum_id":"CCMSLIB00017215567","spectrum_index":4446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 144.0308 Da; putative annotation: N/A; putative formula: C2H5N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017215568","spectrum_index":4447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 342.0758 Da; putative annotation: N/A; putative formula: C12H10N10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.292,"smiles":null,"spectrum_id":"CCMSLIB00017215571","spectrum_index":4448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxycoumarin (delta mass: 122.0369 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.076,"smiles":null,"spectrum_id":"CCMSLIB00017215573","spectrum_index":4449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380224-01!1,7-bis(3,4-dihydroxyphenyl)-6-methoxyheptan-3-one (delta mass: 144.0211 Da; putative annotation: N/A; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.186,"smiles":null,"spectrum_id":"CCMSLIB00017215574","spectrum_index":4450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 17.9769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.105,"smiles":null,"spectrum_id":"CCMSLIB00017215575","spectrum_index":4451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meridinol (delta mass: 179.0798 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.192,"smiles":null,"spectrum_id":"CCMSLIB00017215576","spectrum_index":4452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 180.0795 Da; putative annotation: N/A; putative formula: C11H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.213,"smiles":null,"spectrum_id":"CCMSLIB00017215577","spectrum_index":4453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 583.5534 Da; putative annotation: N/A; putative formula: C36H73NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.817,"smiles":null,"spectrum_id":"CCMSLIB00017215580","spectrum_index":4454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 145.975 Da; putative annotation: N/A; putative formula: C6H-2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.016,"smiles":null,"spectrum_id":"CCMSLIB00017215582","spectrum_index":4455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde (delta mass: 197.141 Da; putative annotation: N/A; putative formula: C11H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.185,"smiles":null,"spectrum_id":"CCMSLIB00017215583","spectrum_index":4456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 177.0639 Da; putative annotation: N/A; putative formula: C6H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.16,"smiles":null,"spectrum_id":"CCMSLIB00017215584","spectrum_index":4457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 106.0418 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.139,"smiles":null,"spectrum_id":"CCMSLIB00017215585","spectrum_index":4458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 63.0324 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017215586","spectrum_index":4459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 63.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017215590","spectrum_index":4460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 61.9202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.09,"smiles":null,"spectrum_id":"CCMSLIB00017215591","spectrum_index":4461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentalenic acid (delta mass: 482.3514 Da; putative annotation: N/A; putative formula: C30H46N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.516,"smiles":null,"spectrum_id":"CCMSLIB00017215592","spectrum_index":4462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thuggacin A (delta mass: 490.952 Da; putative annotation: N/A; putative formula: C13H9N5O10S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1123.31,"smiles":null,"spectrum_id":"CCMSLIB00017215593","spectrum_index":4463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin A (delta mass: 52.0671 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017215594","spectrum_index":4464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 971.5095 Da; putative annotation: N/A; putative formula: C62H65N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1134.57,"smiles":null,"spectrum_id":"CCMSLIB00017215595","spectrum_index":4465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 686.2267 Da; putative annotation: N/A; putative formula: C33H42N4O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1013.36,"smiles":null,"spectrum_id":"CCMSLIB00017215599","spectrum_index":4466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 32.0138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.08,"smiles":null,"spectrum_id":"CCMSLIB00017215600","spectrum_index":4467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 211.8808 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.04,"smiles":null,"spectrum_id":"CCMSLIB00017215601","spectrum_index":4468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 111.0364 Da; putative annotation: N/A; putative formula: C4H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.123,"smiles":null,"spectrum_id":"CCMSLIB00017215602","spectrum_index":4469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 86.0517 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017215603","spectrum_index":4470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 158.0209 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.373,"smiles":null,"spectrum_id":"CCMSLIB00017215606","spectrum_index":4471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 223.1783 Da; putative annotation: N/A; putative formula: C11H21N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.4,"smiles":null,"spectrum_id":"CCMSLIB00017215608","spectrum_index":4472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 366.2744 Da; putative annotation: N/A; putative formula: C26H38O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.313,"smiles":null,"spectrum_id":"CCMSLIB00017215609","spectrum_index":4473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 156.0938 Da; putative annotation: N/A; putative formula: C12H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.305,"smiles":null,"spectrum_id":"CCMSLIB00017215610","spectrum_index":4474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alisol B acetate (delta mass: 148.1326 Da; putative annotation: N/A; putative formula: CH12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.506,"smiles":null,"spectrum_id":"CCMSLIB00017215611","spectrum_index":4475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 28.1755 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.34,"smiles":null,"spectrum_id":"CCMSLIB00017215613","spectrum_index":4476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of halobacillin_08708_dereplictor_pv_2.36662e-33 (delta mass: 17.0241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1052.73,"smiles":null,"spectrum_id":"CCMSLIB00017215616","spectrum_index":4477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 299.2246 Da; putative annotation: N/A; putative formula: C20H29NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.467,"smiles":null,"spectrum_id":"CCMSLIB00017215617","spectrum_index":4478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 239.101 Da; putative annotation: N/A; putative formula: C11H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.255,"smiles":null,"spectrum_id":"CCMSLIB00017215618","spectrum_index":4479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 27.0112 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.092,"smiles":null,"spectrum_id":"CCMSLIB00017215619","spectrum_index":4480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 871.6405 Da; putative annotation: N/A; putative formula: C49H85N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1546.89,"smiles":null,"spectrum_id":"CCMSLIB00017215621","spectrum_index":4481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 52.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.149,"smiles":null,"spectrum_id":"CCMSLIB00017215622","spectrum_index":4482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 75.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.295,"smiles":null,"spectrum_id":"CCMSLIB00017215625","spectrum_index":4483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 202.1328 Da; putative annotation: N/A; putative formula: C10H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.235,"smiles":null,"spectrum_id":"CCMSLIB00017215626","spectrum_index":4484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 297.2674 Da; putative annotation: N/A; putative formula: C18H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.354,"smiles":null,"spectrum_id":"CCMSLIB00017215627","spectrum_index":4485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of heliocurassavicine n-oxyde (delta mass: 255.149 Da; putative annotation: N/A; putative formula: C14H17N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.345,"smiles":null,"spectrum_id":"CCMSLIB00017215629","spectrum_index":4486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 281.1815 Da; putative annotation: N/A; putative formula: C16H27NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.33,"smiles":null,"spectrum_id":"CCMSLIB00017215631","spectrum_index":4487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 79.0988 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.153,"smiles":null,"spectrum_id":"CCMSLIB00017215633","spectrum_index":4488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 71.0362 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.138,"smiles":null,"spectrum_id":"CCMSLIB00017215634","spectrum_index":4489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 84.0577 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.211,"smiles":null,"spectrum_id":"CCMSLIB00017215636","spectrum_index":4490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aloeresin A (delta mass: 146.0366 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.207,"smiles":null,"spectrum_id":"CCMSLIB00017215637","spectrum_index":4491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 72.0624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.097,"smiles":null,"spectrum_id":"CCMSLIB00017215638","spectrum_index":4492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 466.1991 Da; putative annotation: N/A; putative formula: C27H30O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":933.407,"smiles":null,"spectrum_id":"CCMSLIB00017215641","spectrum_index":4493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 196.1106 Da; putative annotation: N/A; putative formula: C12H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.181,"smiles":null,"spectrum_id":"CCMSLIB00017215642","spectrum_index":4494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 217.073 Da; putative annotation: N/A; putative formula: C12H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.154,"smiles":null,"spectrum_id":"CCMSLIB00017215644","spectrum_index":4495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Drostanolone (delta mass: 80.0615 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.309,"smiles":null,"spectrum_id":"CCMSLIB00017215645","spectrum_index":4496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lumichrome (delta mass: 242.0846 Da; putative annotation: N/A; putative formula: C17H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.172,"smiles":null,"spectrum_id":"CCMSLIB00017215646","spectrum_index":4497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 239.0474 Da; putative annotation: N/A; putative formula: C8H17NOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.108,"smiles":null,"spectrum_id":"CCMSLIB00017215649","spectrum_index":4498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 211.1572 Da; putative annotation: N/A; putative formula: C12H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.29,"smiles":null,"spectrum_id":"CCMSLIB00017215651","spectrum_index":4499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 55.9073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.972,"smiles":null,"spectrum_id":"CCMSLIB00017215652","spectrum_index":4500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 193.0581 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.311,"smiles":null,"spectrum_id":"CCMSLIB00017215653","spectrum_index":4501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 337.0111 Da; putative annotation: N/A; putative formula: C11H15NO5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.071,"smiles":null,"spectrum_id":"CCMSLIB00017215654","spectrum_index":4502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 148.036 Da; putative annotation: N/A; putative formula: C2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.117,"smiles":null,"spectrum_id":"CCMSLIB00017215655","spectrum_index":4503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycerol (delta mass: 269.1779 Da; putative annotation: N/A; putative formula: C18H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.723,"smiles":null,"spectrum_id":"CCMSLIB00017215658","spectrum_index":4504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Cycloisolongifol-5-ol (delta mass: 747.5796 Da; putative annotation: N/A; putative formula: C48H77NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":968.77,"smiles":null,"spectrum_id":"CCMSLIB00017215660","spectrum_index":4505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hexyl-4-pentynoic acid (delta mass: 100.0863 Da; putative annotation: N/A; putative formula: C2H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.224,"smiles":null,"spectrum_id":"CCMSLIB00017215661","spectrum_index":4506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoleoylglycine (delta mass: 320.2709 Da; putative annotation: N/A; putative formula: C21H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.54,"smiles":null,"spectrum_id":"CCMSLIB00017215662","spectrum_index":4507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00179862-03_C20H32O2_1-Naphthalenecarboxaldehyde, decahydro-5-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-1,4a-dimethyl-6-methylene-, (1R,4aR,5S)- (delta mass: 253.1157 Da; putative annotation: N/A; putative formula: C9H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.363,"smiles":null,"spectrum_id":"CCMSLIB00017215663","spectrum_index":4508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 232.173 Da; putative annotation: N/A; putative formula: C10H24N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.405,"smiles":null,"spectrum_id":"CCMSLIB00017215664","spectrum_index":4509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 178.1394 Da; putative annotation: N/A; putative formula: C12H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.34,"smiles":null,"spectrum_id":"CCMSLIB00017215668","spectrum_index":4510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 166.0994 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.159,"smiles":null,"spectrum_id":"CCMSLIB00017215669","spectrum_index":4511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 186.1154 Da; putative annotation: N/A; putative formula: C12H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.295,"smiles":null,"spectrum_id":"CCMSLIB00017215670","spectrum_index":4512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 325.1528 Da; putative annotation: N/A; putative formula: C16H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.213,"smiles":null,"spectrum_id":"CCMSLIB00017215671","spectrum_index":4513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 91.8738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.944,"smiles":null,"spectrum_id":"CCMSLIB00017215672","spectrum_index":4514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 18.1049 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.202,"smiles":null,"spectrum_id":"CCMSLIB00017215673","spectrum_index":4515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Oxo-11Z,13E-eicosadienoic acid (delta mass: 44.0257 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.284,"smiles":null,"spectrum_id":"CCMSLIB00017215677","spectrum_index":4516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 312.2029 Da; putative annotation: N/A; putative formula: C20H28N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.341,"smiles":null,"spectrum_id":"CCMSLIB00017215678","spectrum_index":4517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.191,"smiles":null,"spectrum_id":"CCMSLIB00017215679","spectrum_index":4518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 44.0296 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.11,"smiles":null,"spectrum_id":"CCMSLIB00017215680","spectrum_index":4519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 92.0625 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.274,"smiles":null,"spectrum_id":"CCMSLIB00017215681","spectrum_index":4520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 3.1661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.253,"smiles":null,"spectrum_id":"CCMSLIB00017215685","spectrum_index":4521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 110.0362 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.17,"smiles":null,"spectrum_id":"CCMSLIB00017215686","spectrum_index":4522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 16.9286 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.0,"smiles":null,"spectrum_id":"CCMSLIB00017215687","spectrum_index":4523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Erythrodiol (delta mass: 122.1096 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.498,"smiles":null,"spectrum_id":"CCMSLIB00017215688","spectrum_index":4524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetradecanedioic acid (delta mass: 78.082 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.272,"smiles":null,"spectrum_id":"CCMSLIB00017215689","spectrum_index":4525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyclopropyl-1H-imidazol-2-amine (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.098,"smiles":null,"spectrum_id":"CCMSLIB00017215692","spectrum_index":4526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Pro (delta mass: 413.7562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.928,"smiles":null,"spectrum_id":"CCMSLIB00017215694","spectrum_index":4527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 11.9993 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.247,"smiles":null,"spectrum_id":"CCMSLIB00017215695","spectrum_index":4528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 275.1699 Da; putative annotation: N/A; putative formula: C9H21N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.329,"smiles":null,"spectrum_id":"CCMSLIB00017215696","spectrum_index":4529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 17.9656 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.177,"smiles":null,"spectrum_id":"CCMSLIB00017215697","spectrum_index":4530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Dilinolenin (9c,12c,15c) from NIST14 (delta mass: 309.2325 Da; putative annotation: N/A; putative formula: C19H27N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.715,"smiles":null,"spectrum_id":"CCMSLIB00017215698","spectrum_index":4531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 166.1102 Da; putative annotation: N/A; putative formula: C9H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.249,"smiles":null,"spectrum_id":"CCMSLIB00017215702","spectrum_index":4532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ergocalciferol CollisionEnergy:205060 (delta mass: 437.1754 Da; putative annotation: N/A; putative formula: C28H19N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.522,"smiles":null,"spectrum_id":"CCMSLIB00017215703","spectrum_index":4533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 346.0871 Da; putative annotation: N/A; putative formula: C20H15N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":851.263,"smiles":null,"spectrum_id":"CCMSLIB00017215704","spectrum_index":4534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 434.2055 Da; putative annotation: N/A; putative formula: C22H30N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.307,"smiles":null,"spectrum_id":"CCMSLIB00017215705","spectrum_index":4535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 18.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.274,"smiles":null,"spectrum_id":"CCMSLIB00017215706","spectrum_index":4536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 868.3146 Da; putative annotation: N/A; putative formula: C36H56N2O20S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.43,"smiles":null,"spectrum_id":"CCMSLIB00017215707","spectrum_index":4537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 115.0633 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.129,"smiles":null,"spectrum_id":"CCMSLIB00017215711","spectrum_index":4538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 14.0293 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.141,"smiles":null,"spectrum_id":"CCMSLIB00017215712","spectrum_index":4539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 45.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.17,"smiles":null,"spectrum_id":"CCMSLIB00017215713","spectrum_index":4540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 162.0521 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.165,"smiles":null,"spectrum_id":"CCMSLIB00017215714","spectrum_index":4541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1131.4509 Da; putative annotation: N/A; putative formula: C52H65N11O18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1353.55,"smiles":null,"spectrum_id":"CCMSLIB00017215715","spectrum_index":4542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 88.0922 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.152,"smiles":null,"spectrum_id":"CCMSLIB00017215717","spectrum_index":4543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine; AIF; CE0; MS2Dec (delta mass: 96.0435 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.13,"smiles":null,"spectrum_id":"CCMSLIB00017215720","spectrum_index":4544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(R)-Hydroxydocosahexaenoic acid (delta mass: 328.2576 Da; putative annotation: N/A; putative formula: C15H32N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.5,"smiles":null,"spectrum_id":"CCMSLIB00017215721","spectrum_index":4545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-(methylthio)- (delta mass: 72.0237 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.186,"smiles":null,"spectrum_id":"CCMSLIB00017215722","spectrum_index":4546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetic acid methyl ester (delta mass: 100.0667 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.429,"smiles":null,"spectrum_id":"CCMSLIB00017215723","spectrum_index":4547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ319805 Corticosterone|11b,21-Dihydroxyprogesterone|(8S,9S,10R,11S,13S,14S,17S)-11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one (delta mass: 62.0507 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.272,"smiles":null,"spectrum_id":"CCMSLIB00017215724","spectrum_index":4548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 184.0846 Da; putative annotation: N/A; putative formula: C8H12N2O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.145,"smiles":null,"spectrum_id":"CCMSLIB00017215727","spectrum_index":4549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 46.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017215729","spectrum_index":4550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 60.0766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.163,"smiles":null,"spectrum_id":"CCMSLIB00017215730","spectrum_index":4551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 59.8384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.894,"smiles":null,"spectrum_id":"CCMSLIB00017215731","spectrum_index":4552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 125.0992 Da; putative annotation: N/A; putative formula: C6H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.185,"smiles":null,"spectrum_id":"CCMSLIB00017215732","spectrum_index":4553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 439.2053 Da; putative annotation: N/A; putative formula: C18H33NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.276,"smiles":null,"spectrum_id":"CCMSLIB00017215734","spectrum_index":4554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 8.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.096,"smiles":null,"spectrum_id":"CCMSLIB00017215736","spectrum_index":4555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 260.112 Da; putative annotation: N/A; putative formula: C9H16N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.214,"smiles":null,"spectrum_id":"CCMSLIB00017215738","spectrum_index":4556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 76.0087 Da; putative annotation: N/A; putative formula: CH4N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.08,"smiles":null,"spectrum_id":"CCMSLIB00017215739","spectrum_index":4557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Isopentyloxy)benzoic acid (delta mass: 28.0304 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017215740","spectrum_index":4558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 355.2556 Da; putative annotation: N/A; putative formula: C20H37NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.342,"smiles":null,"spectrum_id":"CCMSLIB00017215741","spectrum_index":4559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371601 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017215743","spectrum_index":4560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 96.0313 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017215746","spectrum_index":4561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 92.0663 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.34,"smiles":null,"spectrum_id":"CCMSLIB00017215747","spectrum_index":4562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 124.0676 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.435,"smiles":null,"spectrum_id":"CCMSLIB00017215748","spectrum_index":4563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 241.9892 Da; putative annotation: N/A; putative formula: C2H6N6O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.128,"smiles":null,"spectrum_id":"CCMSLIB00017215749","spectrum_index":4564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)acetamide (delta mass: 133.0377 Da; putative annotation: N/A; putative formula: C4H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.156,"smiles":null,"spectrum_id":"CCMSLIB00017215751","spectrum_index":4565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 105.1771 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.269,"smiles":null,"spectrum_id":"CCMSLIB00017215753","spectrum_index":4566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-4-morpholinyl)acetic acid (delta mass: 133.1825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.243,"smiles":null,"spectrum_id":"CCMSLIB00017215755","spectrum_index":4567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 136.0733 Da; putative annotation: N/A; putative formula: C6H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.112,"smiles":null,"spectrum_id":"CCMSLIB00017215756","spectrum_index":4568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.295,"smiles":null,"spectrum_id":"CCMSLIB00017215757","spectrum_index":4569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-3,8a-dimethyl-5-methylidene-4a,6,7,8,9,9a-hexahydro-4H-benzo[f][1]benzofuran-2-one (delta mass: 436.3363 Da; putative annotation: N/A; putative formula: C16H36N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.485,"smiles":null,"spectrum_id":"CCMSLIB00017215759","spectrum_index":4570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 259.0361 Da; putative annotation: N/A; putative formula: C6H13NO8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.419,"smiles":null,"spectrum_id":"CCMSLIB00017215761","spectrum_index":4571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 70.078 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.305,"smiles":null,"spectrum_id":"CCMSLIB00017215763","spectrum_index":4572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 63.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.128,"smiles":null,"spectrum_id":"CCMSLIB00017215764","spectrum_index":4573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 214.1567 Da; putative annotation: N/A; putative formula: C12H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.238,"smiles":null,"spectrum_id":"CCMSLIB00017215766","spectrum_index":4574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 23.992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.084,"smiles":null,"spectrum_id":"CCMSLIB00017215767","spectrum_index":4575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 449.0656 Da; putative annotation: N/A; putative formula: C18H11N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.188,"smiles":null,"spectrum_id":"CCMSLIB00017215770","spectrum_index":4576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-(2-Ethylphenyl)prop-2-enoic acid (delta mass: 231.999 Da; putative annotation: N/A; putative formula: C8H4N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.09,"smiles":null,"spectrum_id":"CCMSLIB00017215771","spectrum_index":4577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 260.0113 Da; putative annotation: N/A; putative formula: C9H12N2OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.083,"smiles":null,"spectrum_id":"CCMSLIB00017215773","spectrum_index":4578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 247.0204 Da; putative annotation: N/A; putative formula: C14H5N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.117,"smiles":null,"spectrum_id":"CCMSLIB00017215774","spectrum_index":4579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 600.2057 Da; putative annotation: N/A; putative formula: C41H32N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.287,"smiles":null,"spectrum_id":"CCMSLIB00017215775","spectrum_index":4580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Nicotinamide adenine dinucleotide (delta mass: 350.5278 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1014.64,"smiles":null,"spectrum_id":"CCMSLIB00017215777","spectrum_index":4581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 388.2476 Da; putative annotation: N/A; putative formula: C21H32N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.453,"smiles":null,"spectrum_id":"CCMSLIB00017215780","spectrum_index":4582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 303.2566 Da; putative annotation: N/A; putative formula: C20H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.364,"smiles":null,"spectrum_id":"CCMSLIB00017215781","spectrum_index":4583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 68.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.28,"smiles":null,"spectrum_id":"CCMSLIB00017215782","spectrum_index":4584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 66.0318 Da; putative annotation: N/A; putative formula: C2H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.155,"smiles":null,"spectrum_id":"CCMSLIB00017215783","spectrum_index":4585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 125.0478 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.129,"smiles":null,"spectrum_id":"CCMSLIB00017215785","spectrum_index":4586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxy-16-methoxyoctadeca-9,12-dienoic acid (delta mass: 100.0677 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017215788","spectrum_index":4587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.alpha.-Hydroxystanozolol (delta mass: 86.0622 Da; putative annotation: N/A; putative formula: C5H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.316,"smiles":null,"spectrum_id":"CCMSLIB00017215789","spectrum_index":4588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 62.0502 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.288,"smiles":null,"spectrum_id":"CCMSLIB00017215790","spectrum_index":4589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 68.0619 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.273,"smiles":null,"spectrum_id":"CCMSLIB00017215791","spectrum_index":4590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 121.1101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.17,"smiles":null,"spectrum_id":"CCMSLIB00017215793","spectrum_index":4591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 142.0489 Da; putative annotation: N/A; putative formula: C4H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.204,"smiles":null,"spectrum_id":"CCMSLIB00017215795","spectrum_index":4592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16(17)-Epoxy-4Z,7Z,10Z,13Z,19Z-docosapentaenoic acid (delta mass: 54.0305 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.273,"smiles":null,"spectrum_id":"CCMSLIB00017215796","spectrum_index":4593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpyrrole-2,4-dicarboxylic Acid (delta mass: 24.0372 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.082,"smiles":null,"spectrum_id":"CCMSLIB00017215798","spectrum_index":4594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxy-16-methoxyoctadeca-9,12-dienoic acid (delta mass: 116.1004 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.353,"smiles":null,"spectrum_id":"CCMSLIB00017215799","spectrum_index":4595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 94.0625 Da; putative annotation: N/A; putative formula: C4H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017215801","spectrum_index":4596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 100.8851 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.951,"smiles":null,"spectrum_id":"CCMSLIB00017215803","spectrum_index":4597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 38.993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.1,"smiles":null,"spectrum_id":"CCMSLIB00017215804","spectrum_index":4598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 57.0014 Da; putative annotation: N/A; putative formula: C5H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.051,"smiles":null,"spectrum_id":"CCMSLIB00017215805","spectrum_index":4599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Chlorophenyl)-1-pyrrolidinecarboxamide (delta mass: 51.0448 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.124,"smiles":null,"spectrum_id":"CCMSLIB00017215807","spectrum_index":4600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 324.1064 Da; putative annotation: N/A; putative formula: C13H24O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.188,"smiles":null,"spectrum_id":"CCMSLIB00017215808","spectrum_index":4601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 481.3151 Da; putative annotation: N/A; putative formula: C25H43N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":977.655,"smiles":null,"spectrum_id":"CCMSLIB00017215810","spectrum_index":4602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 175.0826 Da; putative annotation: N/A; putative formula: C11H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.148,"smiles":null,"spectrum_id":"CCMSLIB00017215812","spectrum_index":4603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 39.9956 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.055,"smiles":null,"spectrum_id":"CCMSLIB00017215814","spectrum_index":4604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP007601 3-Ketocholanic Acid|AC1LBW7M|4-(10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid (delta mass: 18.0137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.303,"smiles":null,"spectrum_id":"CCMSLIB00017215815","spectrum_index":4605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 205.1054 Da; putative annotation: N/A; putative formula: C9H20NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.14,"smiles":null,"spectrum_id":"CCMSLIB00017215816","spectrum_index":4606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 327.3169 Da; putative annotation: N/A; putative formula: C19H42N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.544,"smiles":null,"spectrum_id":"CCMSLIB00017215817","spectrum_index":4607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 40.0678 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017215820","spectrum_index":4608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 124.0675 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.404,"smiles":null,"spectrum_id":"CCMSLIB00017215822","spectrum_index":4609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 99.0313 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.123,"smiles":null,"spectrum_id":"CCMSLIB00017215823","spectrum_index":4610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 101.9988 Da; putative annotation: N/A; putative formula: C2H3N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.065,"smiles":null,"spectrum_id":"CCMSLIB00017215824","spectrum_index":4611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 114.0681 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.175,"smiles":null,"spectrum_id":"CCMSLIB00017215825","spectrum_index":4612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 222.0743 Da; putative annotation: N/A; putative formula: C11H15N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.15,"smiles":null,"spectrum_id":"CCMSLIB00017215826","spectrum_index":4613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 357.1335 Da; putative annotation: N/A; putative formula: C19H23N3S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.199,"smiles":null,"spectrum_id":"CCMSLIB00017215830","spectrum_index":4614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 124.052 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.128,"smiles":null,"spectrum_id":"CCMSLIB00017215831","spectrum_index":4615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 324.1055 Da; putative annotation: .beta.-Gentiobiose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.229,"smiles":null,"spectrum_id":"CCMSLIB00017215832","spectrum_index":4616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .gamma.-L-Glutamyl-L-alanine (delta mass: 111.0322 Da; putative annotation: 5-OXO-L-PROLINE - 30.0 eV; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.13,"smiles":null,"spectrum_id":"CCMSLIB00017215833","spectrum_index":4617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 119.0372 Da; putative annotation: Anthranilic acid; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017215834","spectrum_index":4618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 312.2677 Da; putative annotation: NCGC00178646-02!2,4-dihydroxyheptadecyl acetate [IIN-based: Match]; putative formula: C19H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.505,"smiles":null,"spectrum_id":"CCMSLIB00017215836","spectrum_index":4619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 312.2661 Da; putative annotation: 1-Palmitoylglycerol; putative formula: C19H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.529,"smiles":null,"spectrum_id":"CCMSLIB00017215839","spectrum_index":4620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 190.1718 Da; putative annotation: 1-Ethynylcyclododecanol; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.357,"smiles":null,"spectrum_id":"CCMSLIB00017215840","spectrum_index":4621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12(13)-Epoxy-9Z-octadecenoic acid from NIST14 (delta mass: 266.2249 Da; putative annotation: Avocadyne; putative formula: C17H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.467,"smiles":null,"spectrum_id":"CCMSLIB00017215841","spectrum_index":4622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 240.1735 Da; putative annotation: Tetradecanedioic acid; putative formula: C14H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.432,"smiles":null,"spectrum_id":"CCMSLIB00017215842","spectrum_index":4623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 185.0946 Da; putative annotation: 1-(2-(1H-indol-3-yl)ethyl)urea; putative formula: C11H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.186,"smiles":null,"spectrum_id":"CCMSLIB00017215843","spectrum_index":4624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 163.063 Da; putative annotation: 3-Hydroxyphenylalanine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.134,"smiles":null,"spectrum_id":"CCMSLIB00017215846","spectrum_index":4625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 310.2133 Da; putative annotation: (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.435,"smiles":null,"spectrum_id":"CCMSLIB00017215848","spectrum_index":4626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 282.2572 Da; putative annotation: Spectral Match to 3-Hydroxyoctadecanoic Acid from NIST14; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.505,"smiles":null,"spectrum_id":"CCMSLIB00017215849","spectrum_index":4627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 307.2562 Da; putative annotation: Gly-C17:1; putative formula: C19H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.472,"smiles":null,"spectrum_id":"CCMSLIB00017215850","spectrum_index":4628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10(S),17(S)-Dihydroxy-4Z,7Z,11E,13Z,15E,19Z-docosahexaenoic acid (delta mass: 345.2684 Da; putative annotation: 20-Hydroxy-N-(2-hydroxyethyl)-5Z,8Z,11Z,14Z-eicosatetraenamide; putative formula: C22H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.506,"smiles":null,"spectrum_id":"CCMSLIB00017215851","spectrum_index":4629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 327.2569 Da; putative annotation: Eicosapentaenoyl ethanolamide; putative formula: C22H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":920.771,"smiles":null,"spectrum_id":"CCMSLIB00017215853","spectrum_index":4630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 292.0919 Da; putative annotation: Picrotin; putative formula: C15H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.194,"smiles":null,"spectrum_id":"CCMSLIB00017215856","spectrum_index":4631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 154.0993 Da; putative annotation: (2E)-4-Hydroxynon-2-enoic acid; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.175,"smiles":null,"spectrum_id":"CCMSLIB00017215857","spectrum_index":4632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 84.0583 Da; putative annotation: Tetrahydro-3-furanylmethanol; putative formula: C5H8O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.124,"smiles":null,"spectrum_id":"CCMSLIB00017215858","spectrum_index":4633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phenol, 4-(2-aminoethyl)- from NIST14 (delta mass: 149.047 Da; putative annotation: Pyridoxal [M+H-H2O]+; AIF; CE10; CorrDec; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.138,"smiles":null,"spectrum_id":"CCMSLIB00017215859","spectrum_index":4634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 261.0826 Da; putative annotation: Decoyinine; putative formula: C11H11N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.138,"smiles":null,"spectrum_id":"CCMSLIB00017215861","spectrum_index":4635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 134.1094 Da; putative annotation: Spectral Match to (1S,4R)-p-Mentha-2,8-dien-1-ol from METLIN; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.18,"smiles":null,"spectrum_id":"CCMSLIB00017215862","spectrum_index":4636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 85.0534 Da; putative annotation: (3R,4S)-3,4-pyrrolidinediol; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017215865","spectrum_index":4637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180518-02!2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one (delta mass: 560.1395 Da; putative annotation: Vitexin 2''-O-p-coumarate; putative formula: C30H24O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1157.32,"smiles":null,"spectrum_id":"CCMSLIB00017215866","spectrum_index":4638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 270.2189 Da; putative annotation: NCGC00381202-01!3,15-dihydroxyhexadecanoic acid; putative formula: C16H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.461,"smiles":null,"spectrum_id":"CCMSLIB00017215867","spectrum_index":4639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 253.1163 Da; putative annotation: N/A; putative formula: C9H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.301,"smiles":null,"spectrum_id":"CCMSLIB00017215869","spectrum_index":4640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 93.0217 Da; putative annotation: N/A; putative formula: C5H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.103,"smiles":null,"spectrum_id":"CCMSLIB00017215870","spectrum_index":4641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 276.1853 Da; putative annotation: N/A; putative formula: C14H29O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.355,"smiles":null,"spectrum_id":"CCMSLIB00017215871","spectrum_index":4642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 101.0426 Da; putative annotation: N/A; putative formula: C3H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.118,"smiles":null,"spectrum_id":"CCMSLIB00017215874","spectrum_index":4643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 24.0001 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.102,"smiles":null,"spectrum_id":"CCMSLIB00017215875","spectrum_index":4644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 214.1104 Da; putative annotation: N/A; putative formula: C13H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.224,"smiles":null,"spectrum_id":"CCMSLIB00017215877","spectrum_index":4645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Val (delta mass: 43.9902 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.178,"smiles":null,"spectrum_id":"CCMSLIB00017215878","spectrum_index":4646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 74.0525 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.264,"smiles":null,"spectrum_id":"CCMSLIB00017215879","spectrum_index":4647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 155.0574 Da; putative annotation: N/A; putative formula: C7H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.133,"smiles":null,"spectrum_id":"CCMSLIB00017215881","spectrum_index":4648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Di-.gamma.-linolenin (6c,9c,12c) from NIST14 (delta mass: 146.1142 Da; putative annotation: N/A; putative formula: CH10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.597,"smiles":null,"spectrum_id":"CCMSLIB00017215882","spectrum_index":4649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 563.3309 Da; putative annotation: N/A; putative formula: C27H49NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":744.402,"smiles":null,"spectrum_id":"CCMSLIB00017215884","spectrum_index":4650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 180.0632 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.311,"smiles":null,"spectrum_id":"CCMSLIB00017215885","spectrum_index":4651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 41.0268 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.14,"smiles":null,"spectrum_id":"CCMSLIB00017215887","spectrum_index":4652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 320.21 Da; putative annotation: N/A; putative formula: C18H28N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.275,"smiles":null,"spectrum_id":"CCMSLIB00017215888","spectrum_index":4653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,9.beta.,10.alpha.)-3-Hydroxypregna-5,7-dien-20-one (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017215890","spectrum_index":4654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017215891","spectrum_index":4655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lofemizole (delta mass: 18.0066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.059,"smiles":null,"spectrum_id":"CCMSLIB00017215893","spectrum_index":4656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-Ranitidine - 40.0 eV (delta mass: 188.0115 Da; putative annotation: N/A; putative formula: C3H4N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.16,"smiles":null,"spectrum_id":"CCMSLIB00017215895","spectrum_index":4657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017215896","spectrum_index":4658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1132.6971 Da; putative annotation: N/A; putative formula: C69H92N6O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1354.79,"smiles":null,"spectrum_id":"CCMSLIB00017215898","spectrum_index":4659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 253.1596 Da; putative annotation: N/A; putative formula: C14H24NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.391,"smiles":null,"spectrum_id":"CCMSLIB00017215900","spectrum_index":4660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 816.4296 Da; putative annotation: N/A; putative formula: C42H52N14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":979.49,"smiles":null,"spectrum_id":"CCMSLIB00017215901","spectrum_index":4661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 93.0418 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.102,"smiles":null,"spectrum_id":"CCMSLIB00017215903","spectrum_index":4662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 161.0686 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017215904","spectrum_index":4663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 598.1892 Da; putative annotation: N/A; putative formula: C24H36N6O6P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.228,"smiles":null,"spectrum_id":"CCMSLIB00017215905","spectrum_index":4664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 206.0552 Da; putative annotation: N/A; putative formula: C7H6N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.115,"smiles":null,"spectrum_id":"CCMSLIB00017215907","spectrum_index":4665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(4S,8aS)-4-acetyloxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 395.2682 Da; putative annotation: N/A; putative formula: C23H41NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.516,"smiles":null,"spectrum_id":"CCMSLIB00017215910","spectrum_index":4666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 285.1851 Da; putative annotation: N/A; putative formula: C15H28NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.276,"smiles":null,"spectrum_id":"CCMSLIB00017215911","spectrum_index":4667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 148.0848 Da; putative annotation: N/A; putative formula: C5H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.176,"smiles":null,"spectrum_id":"CCMSLIB00017215912","spectrum_index":4668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-trans-Chrysanthemic acid (delta mass: 148.1253 Da; putative annotation: N/A; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.248,"smiles":null,"spectrum_id":"CCMSLIB00017215913","spectrum_index":4669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 384.3705 Da; putative annotation: N/A; putative formula: C23H48N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.509,"smiles":null,"spectrum_id":"CCMSLIB00017215915","spectrum_index":4670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 13.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.149,"smiles":null,"spectrum_id":"CCMSLIB00017215918","spectrum_index":4671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 100.0153 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017215919","spectrum_index":4672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 459.3202 Da; putative annotation: N/A; putative formula: C27H46N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.38,"smiles":null,"spectrum_id":"CCMSLIB00017215921","spectrum_index":4673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyltyramine (delta mass: 244.095 Da; putative annotation: N/A; putative formula: C11H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.202,"smiles":null,"spectrum_id":"CCMSLIB00017215924","spectrum_index":4674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 46.0204 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.143,"smiles":null,"spectrum_id":"CCMSLIB00017215925","spectrum_index":4675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydrojasmonic acid (delta mass: 76.0309 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.179,"smiles":null,"spectrum_id":"CCMSLIB00017215926","spectrum_index":4676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 41.9449 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.042,"smiles":null,"spectrum_id":"CCMSLIB00017215927","spectrum_index":4677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 200.1551 Da; putative annotation: N/A; putative formula: C9H21N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.324,"smiles":null,"spectrum_id":"CCMSLIB00017215929","spectrum_index":4678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 176.0313 Da; putative annotation: N/A; putative formula: C10H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.175,"smiles":null,"spectrum_id":"CCMSLIB00017215931","spectrum_index":4679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 78.0459 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.299,"smiles":null,"spectrum_id":"CCMSLIB00017215933","spectrum_index":4680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 61.9449 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.094,"smiles":null,"spectrum_id":"CCMSLIB00017215934","spectrum_index":4681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cedrol (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.2,"smiles":null,"spectrum_id":"CCMSLIB00017215935","spectrum_index":4682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 129.0415 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.144,"smiles":null,"spectrum_id":"CCMSLIB00017215937","spectrum_index":4683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 88.0157 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.143,"smiles":null,"spectrum_id":"CCMSLIB00017215939","spectrum_index":4684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z-octadecadienoic acid (delta mass: 639.5731 Da; putative annotation: N/A; putative formula: C38H77N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":934.8,"smiles":null,"spectrum_id":"CCMSLIB00017215940","spectrum_index":4685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 36.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.284,"smiles":null,"spectrum_id":"CCMSLIB00017215941","spectrum_index":4686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 166.1387 Da; putative annotation: N/A; putative formula: C11H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.217,"smiles":null,"spectrum_id":"CCMSLIB00017215942","spectrum_index":4687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 172.053 Da; putative annotation: N/A; putative formula: C4H8N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.182,"smiles":null,"spectrum_id":"CCMSLIB00017215943","spectrum_index":4688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 675.6162 Da; putative annotation: N/A; putative formula: C43H81NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":958.879,"smiles":null,"spectrum_id":"CCMSLIB00017215947","spectrum_index":4689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hecogenin (delta mass: 122.1101 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.426,"smiles":null,"spectrum_id":"CCMSLIB00017215948","spectrum_index":4690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 315.1195 Da; putative annotation: N/A; putative formula: C20H17N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.248,"smiles":null,"spectrum_id":"CCMSLIB00017215949","spectrum_index":4691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxysebacic acid (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.149,"smiles":null,"spectrum_id":"CCMSLIB00017215950","spectrum_index":4692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 39.1024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.157,"smiles":null,"spectrum_id":"CCMSLIB00017215951","spectrum_index":4693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 105.1044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.17,"smiles":null,"spectrum_id":"CCMSLIB00017215953","spectrum_index":4694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 81.0158 Da; putative annotation: N/A; putative formula: C4H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.055,"smiles":null,"spectrum_id":"CCMSLIB00017215956","spectrum_index":4695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 572.4776 Da; putative annotation: N/A; putative formula: C33H60N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.647,"smiles":null,"spectrum_id":"CCMSLIB00017215957","spectrum_index":4696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 15.0472 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.118,"smiles":null,"spectrum_id":"CCMSLIB00017215958","spectrum_index":4697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl vanillate (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.076,"smiles":null,"spectrum_id":"CCMSLIB00017215959","spectrum_index":4698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 63.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.311,"smiles":null,"spectrum_id":"CCMSLIB00017215961","spectrum_index":4699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 621.3565 Da; putative annotation: N/A; putative formula: C39H47N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":742.421,"smiles":null,"spectrum_id":"CCMSLIB00017215964","spectrum_index":4700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,13-Dihydrolactucin (delta mass: 18.0099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017215965","spectrum_index":4701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 45.5304 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.602,"smiles":null,"spectrum_id":"CCMSLIB00017215966","spectrum_index":4702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 17.933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017215967","spectrum_index":4703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 460.3421 Da; putative annotation: N/A; putative formula: C27H40N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.616,"smiles":null,"spectrum_id":"CCMSLIB00017215969","spectrum_index":4704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 64.9856 Da; putative annotation: N/A; putative formula: C3NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.997,"smiles":null,"spectrum_id":"CCMSLIB00017215972","spectrum_index":4705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Di-.gamma.-linolenin (6c,9c,12c) from NIST14 (delta mass: 35.0353 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.518,"smiles":null,"spectrum_id":"CCMSLIB00017215973","spectrum_index":4706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-methoxybenzoic acid (delta mass: 40.9824 Da; putative annotation: N/A; putative formula: CNO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.048,"smiles":null,"spectrum_id":"CCMSLIB00017215974","spectrum_index":4707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 260.7328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.83,"smiles":null,"spectrum_id":"CCMSLIB00017215975","spectrum_index":4708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 910.2627 Da; putative annotation: N/A; putative formula: C60H40N4O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1073.32,"smiles":null,"spectrum_id":"CCMSLIB00017215977","spectrum_index":4709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 223.0311 Da; putative annotation: N/A; putative formula: C3H9N7OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.17,"smiles":null,"spectrum_id":"CCMSLIB00017215980","spectrum_index":4710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.alpha.-Glycyrrhetinic acid (delta mass: 19.0131 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.36,"smiles":null,"spectrum_id":"CCMSLIB00017215981","spectrum_index":4711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 59.6695 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.859,"smiles":null,"spectrum_id":"CCMSLIB00017215982","spectrum_index":4712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEPROPIONIC ACID (delta mass: 157.0839 Da; putative annotation: N/A; putative formula: C6H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.17,"smiles":null,"spectrum_id":"CCMSLIB00017215983","spectrum_index":4713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 547.2433 Da; putative annotation: N/A; putative formula: C29H33N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.335,"smiles":null,"spectrum_id":"CCMSLIB00017215985","spectrum_index":4714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Diamino-2-methoxyanthraquinone (delta mass: 270.0793 Da; putative annotation: N/A; putative formula: C18H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.171,"smiles":null,"spectrum_id":"CCMSLIB00017215987","spectrum_index":4715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 54.9263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.013,"smiles":null,"spectrum_id":"CCMSLIB00017215988","spectrum_index":4716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 59.0222 Da; putative annotation: N/A; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.109,"smiles":null,"spectrum_id":"CCMSLIB00017215989","spectrum_index":4717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anomalin A (delta mass: 106.1153 Da; putative annotation: N/A; putative formula: C9H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.17,"smiles":null,"spectrum_id":"CCMSLIB00017215990","spectrum_index":4718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxyheptadec-16-ynyl acetate (delta mass: 326.2472 Da; putative annotation: N/A; putative formula: C19H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.5,"smiles":null,"spectrum_id":"CCMSLIB00017215992","spectrum_index":4719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 633.5337 Da; putative annotation: N/A; putative formula: C39H71NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.75,"smiles":null,"spectrum_id":"CCMSLIB00017215994","spectrum_index":4720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S(-)-Cathinone (delta mass: 74.0268 Da; putative annotation: N/A; putative formula: C5H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.118,"smiles":null,"spectrum_id":"CCMSLIB00017215996","spectrum_index":4721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 50.0153 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017215998","spectrum_index":4722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 308.2716 Da; putative annotation: N/A; putative formula: C20H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.519,"smiles":null,"spectrum_id":"CCMSLIB00017215999","spectrum_index":4723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 62.0524 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.295,"smiles":null,"spectrum_id":"CCMSLIB00017216000","spectrum_index":4724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 31.0424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.285,"smiles":null,"spectrum_id":"CCMSLIB00017216004","spectrum_index":4725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methoxycarbonyl)but-3-enoic acid (delta mass: 70.0055 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.055,"smiles":null,"spectrum_id":"CCMSLIB00017216005","spectrum_index":4726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.alpha.)-3-Hydroxy-11-oxoolean-12-en-30-oic acid (delta mass: 174.1463 Da; putative annotation: N/A; putative formula: C3H14N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.493,"smiles":null,"spectrum_id":"CCMSLIB00017216006","spectrum_index":4727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 99.0209 Da; putative annotation: N/A; putative formula: C6HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.087,"smiles":null,"spectrum_id":"CCMSLIB00017216007","spectrum_index":4728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 528.2774 Da; putative annotation: N/A; putative formula: C36H36N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.338,"smiles":null,"spectrum_id":"CCMSLIB00017216008","spectrum_index":4729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 120.0193 Da; putative annotation: N/A; putative formula: C3N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.319,"smiles":null,"spectrum_id":"CCMSLIB00017216012","spectrum_index":4730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 388.143 Da; putative annotation: N/A; putative formula: C16H20N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.199,"smiles":null,"spectrum_id":"CCMSLIB00017216013","spectrum_index":4731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 120.0583 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.322,"smiles":null,"spectrum_id":"CCMSLIB00017216014","spectrum_index":4732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 86.057 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.31,"smiles":null,"spectrum_id":"CCMSLIB00017216015","spectrum_index":4733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-butyric acid CollisionEnergy:102040 (delta mass: 123.0699 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.172,"smiles":null,"spectrum_id":"CCMSLIB00017216016","spectrum_index":4734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 62.0396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.199,"smiles":null,"spectrum_id":"CCMSLIB00017216020","spectrum_index":4735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dimyristin (delta mass: 277.2386 Da; putative annotation: N/A; putative formula: C14H27N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.69,"smiles":null,"spectrum_id":"CCMSLIB00017216021","spectrum_index":4736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 27.0212 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.123,"smiles":null,"spectrum_id":"CCMSLIB00017216022","spectrum_index":4737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 448.0656 Da; putative annotation: N/A; putative formula: C13H26N2O7P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.136,"smiles":null,"spectrum_id":"CCMSLIB00017216023","spectrum_index":4738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 73.9874 Da; putative annotation: N/A; putative formula: C4H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.078,"smiles":null,"spectrum_id":"CCMSLIB00017216024","spectrum_index":4739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-proline (delta mass: 46.0164 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.103,"smiles":null,"spectrum_id":"CCMSLIB00017216028","spectrum_index":4740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 320.2717 Da; putative annotation: N/A; putative formula: C21H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.498,"smiles":null,"spectrum_id":"CCMSLIB00017216029","spectrum_index":4741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxy-.DELTA.9-tetrahydrocannabinol (delta mass: 163.0842 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.311,"smiles":null,"spectrum_id":"CCMSLIB00017216030","spectrum_index":4742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 750.4558 Da; putative annotation: N/A; putative formula: C34H66N6O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":931.526,"smiles":null,"spectrum_id":"CCMSLIB00017216031","spectrum_index":4743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Pinitol (delta mass: 271.2558 Da; putative annotation: N/A; putative formula: C15H34N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.342,"smiles":null,"spectrum_id":"CCMSLIB00017216032","spectrum_index":4744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin Pr-LL (delta mass: 374.2069 Da; putative annotation: N/A; putative formula: C26H30S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":815.525,"smiles":null,"spectrum_id":"CCMSLIB00017216034","spectrum_index":4745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 204.0274 Da; putative annotation: N/A; putative formula: C10H9N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.114,"smiles":null,"spectrum_id":"CCMSLIB00017216037","spectrum_index":4746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 152.046 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.094,"smiles":null,"spectrum_id":"CCMSLIB00017216038","spectrum_index":4747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 92.0538 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.27,"smiles":null,"spectrum_id":"CCMSLIB00017216039","spectrum_index":4748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 102.0832 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017216040","spectrum_index":4749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 286.1928 Da; putative annotation: N/A; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.316,"smiles":null,"spectrum_id":"CCMSLIB00017216041","spectrum_index":4750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 118.0468 Da; putative annotation: N/A; putative formula: C5H12O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.31,"smiles":null,"spectrum_id":"CCMSLIB00017216044","spectrum_index":4751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 92.0462 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.325,"smiles":null,"spectrum_id":"CCMSLIB00017216046","spectrum_index":4752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 146.0731 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.128,"smiles":null,"spectrum_id":"CCMSLIB00017216047","spectrum_index":4753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 116.0472 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.201,"smiles":null,"spectrum_id":"CCMSLIB00017216048","spectrum_index":4754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 132.0789 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.133,"smiles":null,"spectrum_id":"CCMSLIB00017216049","spectrum_index":4755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 890.7854 Da; putative annotation: N/A; putative formula: C58H102N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1109.9,"smiles":null,"spectrum_id":"CCMSLIB00017216053","spectrum_index":4756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:102040 (delta mass: 253.2034 Da; putative annotation: N/A; putative formula: C15H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.472,"smiles":null,"spectrum_id":"CCMSLIB00017216054","spectrum_index":4757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidine (delta mass: 42.0093 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.189,"smiles":null,"spectrum_id":"CCMSLIB00017216055","spectrum_index":4758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 102.0643 Da; putative annotation: N/A; putative formula: CH6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.14,"smiles":null,"spectrum_id":"CCMSLIB00017216056","spectrum_index":4759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol oxide A (delta mass: 161.0144 Da; putative annotation: N/A; putative formula: C7H4N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.215,"smiles":null,"spectrum_id":"CCMSLIB00017216057","spectrum_index":4760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tapentadol (delta mass: 60.0216 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.207,"smiles":null,"spectrum_id":"CCMSLIB00017216061","spectrum_index":4761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 535.7122 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.772,"smiles":null,"spectrum_id":"CCMSLIB00017216062","spectrum_index":4762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 151.0851 Da; putative annotation: N/A; putative formula: H10N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.317,"smiles":null,"spectrum_id":"CCMSLIB00017216063","spectrum_index":4763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 290.2255 Da; putative annotation: N/A; putative formula: C19H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.332,"smiles":null,"spectrum_id":"CCMSLIB00017216064","spectrum_index":4764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethoxybenzoic acid (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017216065","spectrum_index":4765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 477.2838 Da; putative annotation: N/A; putative formula: C25H39N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.624,"smiles":null,"spectrum_id":"CCMSLIB00017216068","spectrum_index":4766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 677.5241 Da; putative annotation: N/A; putative formula: C41H75NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1061.67,"smiles":null,"spectrum_id":"CCMSLIB00017216070","spectrum_index":4767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 867.6051 Da; putative annotation: N/A; putative formula: C44H81N7O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1089.7,"smiles":null,"spectrum_id":"CCMSLIB00017216071","spectrum_index":4768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 729.5019 Da; putative annotation: N/A; putative formula: C52H63N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1006.72,"smiles":null,"spectrum_id":"CCMSLIB00017216072","spectrum_index":4769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 117.035 Da; putative annotation: N/A; putative formula: C4H8NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.07,"smiles":null,"spectrum_id":"CCMSLIB00017216074","spectrum_index":4770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331602 Linoleic acid|(9Z,12Z)-octadeca-9,12-dienoic acid (delta mass: 579.5239 Da; putative annotation: N/A; putative formula: C37H65N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.771,"smiles":null,"spectrum_id":"CCMSLIB00017216076","spectrum_index":4771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 260.2148 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.301,"smiles":null,"spectrum_id":"CCMSLIB00017216078","spectrum_index":4772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trihexyphenidyl (delta mass: 72.0418 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.29,"smiles":null,"spectrum_id":"CCMSLIB00017216079","spectrum_index":4773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4,8,12-Trimethylcyclotetradeca-3,7,11-trien-1-yl)propan-2-ol (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.279,"smiles":null,"spectrum_id":"CCMSLIB00017216081","spectrum_index":4774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 470.1583 Da; putative annotation: N/A; putative formula: C18H26N6O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.255,"smiles":null,"spectrum_id":"CCMSLIB00017216082","spectrum_index":4775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 629.5 Da; putative annotation: N/A; putative formula: C43H67NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.716,"smiles":null,"spectrum_id":"CCMSLIB00017216085","spectrum_index":4776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrograpanin (delta mass: 596.4768 Da; putative annotation: N/A; putative formula: C34H64N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.704,"smiles":null,"spectrum_id":"CCMSLIB00017216086","spectrum_index":4777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MECILLINAM (delta mass: 77.971 Da; putative annotation: N/A; putative formula: H2N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.124,"smiles":null,"spectrum_id":"CCMSLIB00017216088","spectrum_index":4778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 200.0801 Da; putative annotation: N/A; putative formula: C8H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.182,"smiles":null,"spectrum_id":"CCMSLIB00017216089","spectrum_index":4779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":110.071,"smiles":null,"spectrum_id":"CCMSLIB00017216090","spectrum_index":4780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 18.0274 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.109,"smiles":null,"spectrum_id":"CCMSLIB00017216093","spectrum_index":4781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 110.0732 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.202,"smiles":null,"spectrum_id":"CCMSLIB00017216095","spectrum_index":4782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pesticide6_Ethirimol_C11H19N3O_882476 (delta mass: 17.0041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.164,"smiles":null,"spectrum_id":"CCMSLIB00017216096","spectrum_index":4783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufotenine (delta mass: 17.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017216097","spectrum_index":4784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 76.0641 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.182,"smiles":null,"spectrum_id":"CCMSLIB00017216098","spectrum_index":4785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 41.0355 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.076,"smiles":null,"spectrum_id":"CCMSLIB00017216101","spectrum_index":4786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 191.043 Da; putative annotation: N/A; putative formula: C6H9NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.082,"smiles":null,"spectrum_id":"CCMSLIB00017216103","spectrum_index":4787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 46.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.124,"smiles":null,"spectrum_id":"CCMSLIB00017216104","spectrum_index":4788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 100.0886 Da; putative annotation: N/A; putative formula: C6H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.331,"smiles":null,"spectrum_id":"CCMSLIB00017216105","spectrum_index":4789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 190.0996 Da; putative annotation: N/A; putative formula: C12H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.379,"smiles":null,"spectrum_id":"CCMSLIB00017216106","spectrum_index":4790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 26.9985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.142,"smiles":null,"spectrum_id":"CCMSLIB00017216109","spectrum_index":4791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 43.0034 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.079,"smiles":null,"spectrum_id":"CCMSLIB00017216110","spectrum_index":4792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 68.0395 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.09,"smiles":null,"spectrum_id":"CCMSLIB00017216112","spectrum_index":4793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 27.0493 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.13,"smiles":null,"spectrum_id":"CCMSLIB00017216113","spectrum_index":4794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3-(2-Hydroxyethyl)indole from NIST14 (delta mass: 24.0009 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.092,"smiles":null,"spectrum_id":"CCMSLIB00017216115","spectrum_index":4795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatrienoic acid (delta mass: 53.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.342,"smiles":null,"spectrum_id":"CCMSLIB00017216116","spectrum_index":4796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,19-Dihydroxy-3-oxo-12-ursen-28-oic acid (delta mass: 114.083 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.425,"smiles":null,"spectrum_id":"CCMSLIB00017216117","spectrum_index":4797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurane-17,18-dioic acid, 18-methyl ester, (4.alpha.,16.alpha.)- (delta mass: 164.0875 Da; putative annotation: N/A; putative formula: C9H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.325,"smiles":null,"spectrum_id":"CCMSLIB00017216119","spectrum_index":4798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 54.0105 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.097,"smiles":null,"spectrum_id":"CCMSLIB00017216120","spectrum_index":4799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.18,"smiles":null,"spectrum_id":"CCMSLIB00017216121","spectrum_index":4800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 55.9898 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017216124","spectrum_index":4801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 398.234 Da; putative annotation: N/A; putative formula: C20H35N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.367,"smiles":null,"spectrum_id":"CCMSLIB00017216126","spectrum_index":4802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 231.2271 Da; putative annotation: N/A; putative formula: C8H25N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.287,"smiles":null,"spectrum_id":"CCMSLIB00017216127","spectrum_index":4803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 91.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.181,"smiles":null,"spectrum_id":"CCMSLIB00017216128","spectrum_index":4804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385871-01_C15H22O4_2,8-Dihydroxy-5,5,8-trimethyl-11-oxatetracyclo[7.3.1.0~1,9~.0~3,7~]tridecan-10-one (delta mass: 78.0169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.176,"smiles":null,"spectrum_id":"CCMSLIB00017216129","spectrum_index":4805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 78.0207 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017216131","spectrum_index":4806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.05,"smiles":null,"spectrum_id":"CCMSLIB00017216134","spectrum_index":4807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 475.4014 Da; putative annotation: N/A; putative formula: C30H53NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.654,"smiles":null,"spectrum_id":"CCMSLIB00017216135","spectrum_index":4808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 57.0218 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.135,"smiles":null,"spectrum_id":"CCMSLIB00017216136","spectrum_index":4809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,16.Xi.)-17-Hydroxykauran-19-oic acid (delta mass: 96.0932 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017216137","spectrum_index":4810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 125.0449 Da; putative annotation: N/A; putative formula: C2H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.126,"smiles":null,"spectrum_id":"CCMSLIB00017216139","spectrum_index":4811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(8-Chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethanone (delta mass: 103.0176 Da; putative annotation: N/A; putative formula: C5HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.096,"smiles":null,"spectrum_id":"CCMSLIB00017216142","spectrum_index":4812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 311.126 Da; putative annotation: N/A; putative formula: C19H22NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.228,"smiles":null,"spectrum_id":"CCMSLIB00017216143","spectrum_index":4813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 248.0513 Da; putative annotation: N/A; putative formula: C6H12N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.236,"smiles":null,"spectrum_id":"CCMSLIB00017216144","spectrum_index":4814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 333.1504 Da; putative annotation: N/A; putative formula: C19H20N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.252,"smiles":null,"spectrum_id":"CCMSLIB00017216145","spectrum_index":4815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxycodone (delta mass: 160.1016 Da; putative annotation: N/A; putative formula: C8H17OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.24,"smiles":null,"spectrum_id":"CCMSLIB00017216148","spectrum_index":4816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 192.0583 Da; putative annotation: N/A; putative formula: C7H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.108,"smiles":null,"spectrum_id":"CCMSLIB00017216150","spectrum_index":4817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)acetamide (delta mass: 103.0275 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.145,"smiles":null,"spectrum_id":"CCMSLIB00017216151","spectrum_index":4818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxykaurenolide (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.217,"smiles":null,"spectrum_id":"CCMSLIB00017216152","spectrum_index":4819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 78.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.15,"smiles":null,"spectrum_id":"CCMSLIB00017216154","spectrum_index":4820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-3-Hydroxyisovaleroylcarnitine (delta mass: 126.0322 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.197,"smiles":null,"spectrum_id":"CCMSLIB00017216156","spectrum_index":4821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 171.9805 Da; putative annotation: N/A; putative formula: C10H4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.056,"smiles":null,"spectrum_id":"CCMSLIB00017216158","spectrum_index":4822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidinol (delta mass: 1.9428 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017216160","spectrum_index":4823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [6,10a-Dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl-9-oxo-1,2,3,4a,5,6,6a,7,11,11a-decahydronaphtho[2,1-f][1]benzofuran-5-yl] acetate (delta mass: 94.0786 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.301,"smiles":null,"spectrum_id":"CCMSLIB00017216161","spectrum_index":4824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 193.059 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.182,"smiles":null,"spectrum_id":"CCMSLIB00017216162","spectrum_index":4825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 87.0685 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.197,"smiles":null,"spectrum_id":"CCMSLIB00017216165","spectrum_index":4826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinocembrine CollisionEnergy:205060 (delta mass: 152.0115 Da; putative annotation: N/A; putative formula: C2HN8O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.092,"smiles":null,"spectrum_id":"CCMSLIB00017216167","spectrum_index":4827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 325.2399 Da; putative annotation: N/A; putative formula: C16H32N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.321,"smiles":null,"spectrum_id":"CCMSLIB00017216168","spectrum_index":4828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 31.0198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.107,"smiles":null,"spectrum_id":"CCMSLIB00017216169","spectrum_index":4829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)acetamide (delta mass: 160.0836 Da; putative annotation: N/A; putative formula: C8H17O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.202,"smiles":null,"spectrum_id":"CCMSLIB00017216171","spectrum_index":4830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 40.0 eV (delta mass: 142.0375 Da; putative annotation: N/A; putative formula: C5H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.129,"smiles":null,"spectrum_id":"CCMSLIB00017216173","spectrum_index":4831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 325.2972 Da; putative annotation: N/A; putative formula: C20H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.529,"smiles":null,"spectrum_id":"CCMSLIB00017216175","spectrum_index":4832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 91.0639 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.286,"smiles":null,"spectrum_id":"CCMSLIB00017216176","spectrum_index":4833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 80.9177 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.989,"smiles":null,"spectrum_id":"CCMSLIB00017216177","spectrum_index":4834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 78.0318 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.087,"smiles":null,"spectrum_id":"CCMSLIB00017216179","spectrum_index":4835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde - 40.0 eV (delta mass: 104.0473 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017216182","spectrum_index":4836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxyquinoline-2-carboxylic acid CollisionEnergy:205060 (delta mass: 257.1511 Da; putative annotation: N/A; putative formula: C11H15N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.217,"smiles":null,"spectrum_id":"CCMSLIB00017216183","spectrum_index":4837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 517.2831 Da; putative annotation: N/A; putative formula: C27H36N9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.364,"smiles":null,"spectrum_id":"CCMSLIB00017216184","spectrum_index":4838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 518.4394 Da; putative annotation: N/A; putative formula: C24H50N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.521,"smiles":null,"spectrum_id":"CCMSLIB00017216186","spectrum_index":4839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lanosterol (delta mass: 271.2526 Da; putative annotation: N/A; putative formula: C16H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.646,"smiles":null,"spectrum_id":"CCMSLIB00017216187","spectrum_index":4840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-4,10-Dimethylidene-7-propan-2-ylcyclodec-5-en-1-ol (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.184,"smiles":null,"spectrum_id":"CCMSLIB00017216190","spectrum_index":4841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 207.1834 Da; putative annotation: N/A; putative formula: C11H21N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.264,"smiles":null,"spectrum_id":"CCMSLIB00017216191","spectrum_index":4842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Ile (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.27,"smiles":null,"spectrum_id":"CCMSLIB00017216193","spectrum_index":4843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 342.2777 Da; putative annotation: N/A; putative formula: C21H42O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.315,"smiles":null,"spectrum_id":"CCMSLIB00017216194","spectrum_index":4844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 162.025 Da; putative annotation: N/A; putative formula: H2N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.143,"smiles":null,"spectrum_id":"CCMSLIB00017216195","spectrum_index":4845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 242.1639 Da; putative annotation: N/A; putative formula: C13H18N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.319,"smiles":null,"spectrum_id":"CCMSLIB00017216199","spectrum_index":4846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labdanolic acid (delta mass: 17.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.301,"smiles":null,"spectrum_id":"CCMSLIB00017216200","spectrum_index":4847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 66.0458 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.257,"smiles":null,"spectrum_id":"CCMSLIB00017216201","spectrum_index":4848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 146.084 Da; putative annotation: N/A; putative formula: C9H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.175,"smiles":null,"spectrum_id":"CCMSLIB00017216202","spectrum_index":4849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,16.Xi.)-17-Hydroxykauran-19-oic acid (delta mass: 82.078 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017216203","spectrum_index":4850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 85.0531 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.155,"smiles":null,"spectrum_id":"CCMSLIB00017216207","spectrum_index":4851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 354.2044 Da; putative annotation: N/A; putative formula: C19H30O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.264,"smiles":null,"spectrum_id":"CCMSLIB00017216208","spectrum_index":4852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 25.9794 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017216209","spectrum_index":4853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 327.1674 Da; putative annotation: N/A; putative formula: C20H27NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.228,"smiles":null,"spectrum_id":"CCMSLIB00017216210","spectrum_index":4854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 125.0326 Da; putative annotation: N/A; putative formula: C3H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.28,"smiles":null,"spectrum_id":"CCMSLIB00017216211","spectrum_index":4855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.216,"smiles":null,"spectrum_id":"CCMSLIB00017216213","spectrum_index":4856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,6,9,12-Tetraoxatetracosan-1-ol (delta mass: 45.0561 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.367,"smiles":null,"spectrum_id":"CCMSLIB00017216216","spectrum_index":4857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(N-Methylacetamido)benzoic acid (delta mass: 169.0749 Da; putative annotation: N/A; putative formula: C9H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.156,"smiles":null,"spectrum_id":"CCMSLIB00017216217","spectrum_index":4858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 808.5354 Da; putative annotation: N/A; putative formula: C39H72N10O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.632,"smiles":null,"spectrum_id":"CCMSLIB00017216218","spectrum_index":4859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid benzyl ester (delta mass: 42.0101 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.096,"smiles":null,"spectrum_id":"CCMSLIB00017216219","spectrum_index":4860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 106.0502 Da; putative annotation: N/A; putative formula: CH6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.091,"smiles":null,"spectrum_id":"CCMSLIB00017216221","spectrum_index":4861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 145.074 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.166,"smiles":null,"spectrum_id":"CCMSLIB00017216224","spectrum_index":4862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 140.1922 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.236,"smiles":null,"spectrum_id":"CCMSLIB00017216225","spectrum_index":4863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 35.0389 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.25,"smiles":null,"spectrum_id":"CCMSLIB00017216226","spectrum_index":4864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 301.215 Da; putative annotation: N/A; putative formula: C18H27N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.313,"smiles":null,"spectrum_id":"CCMSLIB00017216228","spectrum_index":4865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.alpha.)-3-Hydroxy-11-oxoolean-12-en-30-oic acid (delta mass: 122.1149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.462,"smiles":null,"spectrum_id":"CCMSLIB00017216229","spectrum_index":4866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 85.0119 Da; putative annotation: N/A; putative formula: C2H3N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.066,"smiles":null,"spectrum_id":"CCMSLIB00017216232","spectrum_index":4867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 424.2596 Da; putative annotation: N/A; putative formula: C20H41O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.356,"smiles":null,"spectrum_id":"CCMSLIB00017216233","spectrum_index":4868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 94.0767 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.319,"smiles":null,"spectrum_id":"CCMSLIB00017216235","spectrum_index":4869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 117.0772 Da; putative annotation: N/A; putative formula: CH7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.173,"smiles":null,"spectrum_id":"CCMSLIB00017216236","spectrum_index":4870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 73.0527 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.405,"smiles":null,"spectrum_id":"CCMSLIB00017216237","spectrum_index":4871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 35.0845 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.203,"smiles":null,"spectrum_id":"CCMSLIB00017216240","spectrum_index":4872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 78.0466 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.325,"smiles":null,"spectrum_id":"CCMSLIB00017216242","spectrum_index":4873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RH80_1732_S01_F4 (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017216243","spectrum_index":4874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 112.0729 Da; putative annotation: N/A; putative formula: C7H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.242,"smiles":null,"spectrum_id":"CCMSLIB00017216244","spectrum_index":4875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 29.9516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.016,"smiles":null,"spectrum_id":"CCMSLIB00017216245","spectrum_index":4876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 10.0207 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.06,"smiles":null,"spectrum_id":"CCMSLIB00017216248","spectrum_index":4877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 281.11 Da; putative annotation: N/A; putative formula: C15H15N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.181,"smiles":null,"spectrum_id":"CCMSLIB00017216250","spectrum_index":4878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 518.3729 Da; putative annotation: N/A; putative formula: C31H54N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.798,"smiles":null,"spectrum_id":"CCMSLIB00017216251","spectrum_index":4879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 42.9979 Da; putative annotation: N/A; putative formula: CH2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.97,"smiles":null,"spectrum_id":"CCMSLIB00017216252","spectrum_index":4880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 120.0422 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.248,"smiles":null,"spectrum_id":"CCMSLIB00017216253","spectrum_index":4881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 99.0293 Da; putative annotation: N/A; putative formula: HN7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.1,"smiles":null,"spectrum_id":"CCMSLIB00017216256","spectrum_index":4882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 138.1754 Da; putative annotation: N/A; putative formula: C11H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.262,"smiles":null,"spectrum_id":"CCMSLIB00017216258","spectrum_index":4883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 639.3719 Da; putative annotation: N/A; putative formula: C37H49N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":861.469,"smiles":null,"spectrum_id":"CCMSLIB00017216259","spectrum_index":4884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Pro-Ile from NIST14 (delta mass: 262.1359 Da; putative annotation: N/A; putative formula: C14H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.375,"smiles":null,"spectrum_id":"CCMSLIB00017216260","spectrum_index":4885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Niacinamide (delta mass: 95.0481 Da; putative annotation: N/A; putative formula: C4H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.103,"smiles":null,"spectrum_id":"CCMSLIB00017216261","spectrum_index":4886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 70.0059 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.098,"smiles":null,"spectrum_id":"CCMSLIB00017216264","spectrum_index":4887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 131.0373 Da; putative annotation: N/A; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.129,"smiles":null,"spectrum_id":"CCMSLIB00017216266","spectrum_index":4888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 234.1732 Da; putative annotation: N/A; putative formula: C14H22N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.328,"smiles":null,"spectrum_id":"CCMSLIB00017216267","spectrum_index":4889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 272.1499 Da; putative annotation: N/A; putative formula: C12H16N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.21,"smiles":null,"spectrum_id":"CCMSLIB00017216268","spectrum_index":4890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU102304 Benzocaine|ethyl 4-aminobenzoate (delta mass: 80.0552 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.141,"smiles":null,"spectrum_id":"CCMSLIB00017216269","spectrum_index":4891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 90.0495 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.286,"smiles":null,"spectrum_id":"CCMSLIB00017216272","spectrum_index":4892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 200.2497 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.289,"smiles":null,"spectrum_id":"CCMSLIB00017216274","spectrum_index":4893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.221,"smiles":null,"spectrum_id":"CCMSLIB00017216275","spectrum_index":4894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 40.0301 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.09,"smiles":null,"spectrum_id":"CCMSLIB00017216276","spectrum_index":4895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 182.0691 Da; putative annotation: N/A; putative formula: C8H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.239,"smiles":null,"spectrum_id":"CCMSLIB00017216278","spectrum_index":4896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331602 Linoleic acid|(9Z,12Z)-octadeca-9,12-dienoic acid (delta mass: 49.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.3,"smiles":null,"spectrum_id":"CCMSLIB00017216280","spectrum_index":4897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Phe (delta mass: 129.043 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.188,"smiles":null,"spectrum_id":"CCMSLIB00017216282","spectrum_index":4898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 117.0404 Da; putative annotation: N/A; putative formula: H3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.147,"smiles":null,"spectrum_id":"CCMSLIB00017216283","spectrum_index":4899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 162.0283 Da; putative annotation: N/A; putative formula: C6H13O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.094,"smiles":null,"spectrum_id":"CCMSLIB00017216285","spectrum_index":4900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 251.0387 Da; putative annotation: N/A; putative formula: C6H9N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.13,"smiles":null,"spectrum_id":"CCMSLIB00017216286","spectrum_index":4901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid, 4-(7,8,9,10-tetrahydro-5,7,7,10,10-pentamethyl-5H-benzo[e]naphtho[2,3-b][1,4]diazepin-13-yl)- (delta mass: 395.262 Da; putative annotation: N/A; putative formula: C29H33N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.5,"smiles":null,"spectrum_id":"CCMSLIB00017216289","spectrum_index":4902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 662.3331 Da; putative annotation: N/A; putative formula: C30H50N10OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.446,"smiles":null,"spectrum_id":"CCMSLIB00017216290","spectrum_index":4903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 179.0795 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.239,"smiles":null,"spectrum_id":"CCMSLIB00017216291","spectrum_index":4904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 146.094 Da; putative annotation: N/A; putative formula: C7H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.326,"smiles":null,"spectrum_id":"CCMSLIB00017216293","spectrum_index":4905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 205.0437 Da; putative annotation: N/A; putative formula: C6H12N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.13,"smiles":null,"spectrum_id":"CCMSLIB00017216294","spectrum_index":4906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 359.1355 Da; putative annotation: N/A; putative formula: C16H13N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.312,"smiles":null,"spectrum_id":"CCMSLIB00017216297","spectrum_index":4907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxy-2-decenoic acid (delta mass: 35.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.17,"smiles":null,"spectrum_id":"CCMSLIB00017216299","spectrum_index":4908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 85.0164 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.144,"smiles":null,"spectrum_id":"CCMSLIB00017216300","spectrum_index":4909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 342.1234 Da; putative annotation: N/A; putative formula: C16H23O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.174,"smiles":null,"spectrum_id":"CCMSLIB00017216301","spectrum_index":4910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 108.0323 Da; putative annotation: N/A; putative formula: C5H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017216302","spectrum_index":4911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 46.0992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.164,"smiles":null,"spectrum_id":"CCMSLIB00017216306","spectrum_index":4912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 64.0666 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.127,"smiles":null,"spectrum_id":"CCMSLIB00017216307","spectrum_index":4913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 343.2132 Da; putative annotation: N/A; putative formula: C15H30N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.31,"smiles":null,"spectrum_id":"CCMSLIB00017216308","spectrum_index":4914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 358.2717 Da; putative annotation: N/A; putative formula: C20H38O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.41,"smiles":null,"spectrum_id":"CCMSLIB00017216309","spectrum_index":4915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 419.3609 Da; putative annotation: N/A; putative formula: C20H41N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.421,"smiles":null,"spectrum_id":"CCMSLIB00017216312","spectrum_index":4916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Didodecyl 3,3'-thiodipropionate oxide from NIST14 - Hydroxylated variant ? (delta mass: 31.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.45,"smiles":null,"spectrum_id":"CCMSLIB00017216314","spectrum_index":4917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 335.2291 Da; putative annotation: N/A; putative formula: C13H25N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.289,"smiles":null,"spectrum_id":"CCMSLIB00017216315","spectrum_index":4918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 357.2875 Da; putative annotation: N/A; putative formula: C20H39NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.348,"smiles":null,"spectrum_id":"CCMSLIB00017216316","spectrum_index":4919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 283.2865 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.363,"smiles":null,"spectrum_id":"CCMSLIB00017216317","spectrum_index":4920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 27.9811 Da; putative annotation: N/A; putative formula: CO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.078,"smiles":null,"spectrum_id":"CCMSLIB00017216319","spectrum_index":4921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 83.9885 Da; putative annotation: N/A; putative formula: C2HN2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.069,"smiles":null,"spectrum_id":"CCMSLIB00017216322","spectrum_index":4922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2R,3aS,3bS,8S,9aR,9bR,11aR)-1-[(2R,4E)-2,6-dihydroxy-6-methyl-3-oxohept-4-en-2-yl]-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-7,10-dione (delta mass: 179.0811 Da; putative annotation: N/A; putative formula: C7H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.397,"smiles":null,"spectrum_id":"CCMSLIB00017216323","spectrum_index":4923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 784.3877 Da; putative annotation: N/A; putative formula: C45H60N4O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":965.458,"smiles":null,"spectrum_id":"CCMSLIB00017216324","spectrum_index":4924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid (delta mass: 393.254 Da; putative annotation: N/A; putative formula: C22H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.496,"smiles":null,"spectrum_id":"CCMSLIB00017216325","spectrum_index":4925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Methionine (delta mass: 170.0945 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.153,"smiles":null,"spectrum_id":"CCMSLIB00017216329","spectrum_index":4926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 190.0954 Da; putative annotation: N/A; putative formula: C7H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.16,"smiles":null,"spectrum_id":"CCMSLIB00017216330","spectrum_index":4927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 74.051 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.22,"smiles":null,"spectrum_id":"CCMSLIB00017216331","spectrum_index":4928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 547.301 Da; putative annotation: N/A; putative formula: C28H53NOS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.517,"smiles":null,"spectrum_id":"CCMSLIB00017216332","spectrum_index":4929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1148.5611 Da; putative annotation: N/A; putative formula: C53H84N10O14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1311.62,"smiles":null,"spectrum_id":"CCMSLIB00017216333","spectrum_index":4930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-myo-Inositol-2,3,5-triphosphate (delta mass: 79.9669 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.937,"smiles":null,"spectrum_id":"CCMSLIB00017216337","spectrum_index":4931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 300.0842 Da; putative annotation: N/A; putative formula: C8H21N4O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.15,"smiles":null,"spectrum_id":"CCMSLIB00017216338","spectrum_index":4932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of rac-all-trans-4-Hydroxyretinal (delta mass: 52.0641 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.28,"smiles":null,"spectrum_id":"CCMSLIB00017216339","spectrum_index":4933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 480.3019 Da; putative annotation: N/A; putative formula: C18H40N8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":976.642,"smiles":null,"spectrum_id":"CCMSLIB00017216340","spectrum_index":4934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017216342","spectrum_index":4935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylsulfonyl)piperidin-4-amine (delta mass: 94.0551 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.14,"smiles":null,"spectrum_id":"CCMSLIB00017216344","spectrum_index":4936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 14.0263 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.086,"smiles":null,"spectrum_id":"CCMSLIB00017216346","spectrum_index":4937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 350.2655 Da; putative annotation: N/A; putative formula: C25H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.482,"smiles":null,"spectrum_id":"CCMSLIB00017216347","spectrum_index":4938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 128.0468 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.326,"smiles":null,"spectrum_id":"CCMSLIB00017216349","spectrum_index":4939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 50.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.3,"smiles":null,"spectrum_id":"CCMSLIB00017216351","spectrum_index":4940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 90.0868 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.35,"smiles":null,"spectrum_id":"CCMSLIB00017216353","spectrum_index":4941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 76.0682 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.321,"smiles":null,"spectrum_id":"CCMSLIB00017216354","spectrum_index":4942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 12.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.102,"smiles":null,"spectrum_id":"CCMSLIB00017216356","spectrum_index":4943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU043704 Monomethyl phthalate|2-(Methoxycarbonyl)benzoic acid|2-methoxycarbonylbenzoic acid (delta mass: 44.0264 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.076,"smiles":null,"spectrum_id":"CCMSLIB00017216358","spectrum_index":4944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 279.1322 Da; putative annotation: N/A; putative formula: C11H21NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.192,"smiles":null,"spectrum_id":"CCMSLIB00017216359","spectrum_index":4945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 105.0426 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.15,"smiles":null,"spectrum_id":"CCMSLIB00017216360","spectrum_index":4946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 103.0996 Da; putative annotation: N/A; putative formula: CH9N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.17,"smiles":null,"spectrum_id":"CCMSLIB00017216361","spectrum_index":4947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-[(3S)-piperidin-3-yl]acetate (delta mass: 264.2457 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.363,"smiles":null,"spectrum_id":"CCMSLIB00017216363","spectrum_index":4948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,6,7,11b-Hexahydro-2H-pyrazino[2,1-a]isoquinoline (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.149,"smiles":null,"spectrum_id":"CCMSLIB00017216366","spectrum_index":4949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kirenol (delta mass: 100.0673 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017216367","spectrum_index":4950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxyculmorin (delta mass: 170.1461 Da; putative annotation: N/A; putative formula: C14H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.342,"smiles":null,"spectrum_id":"CCMSLIB00017216368","spectrum_index":4951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 79.9643 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.051,"smiles":null,"spectrum_id":"CCMSLIB00017216369","spectrum_index":4952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F1.alpha. alcohol (delta mass: 156.1354 Da; putative annotation: N/A; putative formula: C10H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.42,"smiles":null,"spectrum_id":"CCMSLIB00017216371","spectrum_index":4953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 56.0694 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.085,"smiles":null,"spectrum_id":"CCMSLIB00017216372","spectrum_index":4954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 128.0622 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.273,"smiles":null,"spectrum_id":"CCMSLIB00017216375","spectrum_index":4955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 128.0626 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017216376","spectrum_index":4956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Leu (delta mass: 88.0162 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.219,"smiles":null,"spectrum_id":"CCMSLIB00017216377","spectrum_index":4957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 46.0039 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.126,"smiles":null,"spectrum_id":"CCMSLIB00017216379","spectrum_index":4958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 405.157 Da; putative annotation: N/A; putative formula: C16H27N3O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.228,"smiles":null,"spectrum_id":"CCMSLIB00017216380","spectrum_index":4959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 361.1718 Da; putative annotation: N/A; putative formula: C13H19N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.268,"smiles":null,"spectrum_id":"CCMSLIB00017216382","spectrum_index":4960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 278.1508 Da; putative annotation: N/A; putative formula: C10H23N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.218,"smiles":null,"spectrum_id":"CCMSLIB00017216383","spectrum_index":4961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.165,"smiles":null,"spectrum_id":"CCMSLIB00017216384","spectrum_index":4962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 782.4399 Da; putative annotation: N/A; putative formula: C33H58N12O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1237.79,"smiles":null,"spectrum_id":"CCMSLIB00017216387","spectrum_index":4963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 74.0573 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.54,"smiles":null,"spectrum_id":"CCMSLIB00017216389","spectrum_index":4964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 674.4638 Da; putative annotation: N/A; putative formula: C35H67N2O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":951.68,"smiles":null,"spectrum_id":"CCMSLIB00017216390","spectrum_index":4965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Norepiandrosterone (delta mass: 686.4938 Da; putative annotation: N/A; putative formula: C34H66N6O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":963.71,"smiles":null,"spectrum_id":"CCMSLIB00017216391","spectrum_index":4966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Di-.gamma.-linolenin (6c,9c,12c) from NIST14 (delta mass: 92.0488 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.531,"smiles":null,"spectrum_id":"CCMSLIB00017216393","spectrum_index":4967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 312.3026 Da; putative annotation: N/A; putative formula: C20H40O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.566,"smiles":null,"spectrum_id":"CCMSLIB00017216396","spectrum_index":4968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S)-4-Amino-5-hydroxypentanoic acid (delta mass: 368.344 Da; putative annotation: N/A; putative formula: C27H44)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.425,"smiles":null,"spectrum_id":"CCMSLIB00017216397","spectrum_index":4969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 137.0841 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017216398","spectrum_index":4970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 17.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.222,"smiles":null,"spectrum_id":"CCMSLIB00017216399","spectrum_index":4971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 126.0815 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.397,"smiles":null,"spectrum_id":"CCMSLIB00017216401","spectrum_index":4972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 134.0441 Da; putative annotation: N/A; putative formula: C2H6N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.13,"smiles":null,"spectrum_id":"CCMSLIB00017216402","spectrum_index":4973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 293.1114 Da; putative annotation: N/A; putative formula: C6H16N9O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.192,"smiles":null,"spectrum_id":"CCMSLIB00017216405","spectrum_index":4974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.beta.,17.alpha.-Dimethyl-5.beta.-androstane-3.alpha.,17.beta.-diol (delta mass: 78.0846 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.363,"smiles":null,"spectrum_id":"CCMSLIB00017216406","spectrum_index":4975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 77.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.295,"smiles":null,"spectrum_id":"CCMSLIB00017216408","spectrum_index":4976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kendomycin (delta mass: 109.0356 Da; putative annotation: N/A; putative formula: C6H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.341,"smiles":null,"spectrum_id":"CCMSLIB00017216409","spectrum_index":4977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxycapric acid (delta mass: 84.0575 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.206,"smiles":null,"spectrum_id":"CCMSLIB00017216410","spectrum_index":4978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ANISOMYCIN (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.149,"smiles":null,"spectrum_id":"CCMSLIB00017216414","spectrum_index":4979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethylbenzoic acid (delta mass: 41.0494 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.125,"smiles":null,"spectrum_id":"CCMSLIB00017216415","spectrum_index":4980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 32.0232 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.125,"smiles":null,"spectrum_id":"CCMSLIB00017216416","spectrum_index":4981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 74.0516 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.284,"smiles":null,"spectrum_id":"CCMSLIB00017216417","spectrum_index":4982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 165.1144 Da; putative annotation: N/A; putative formula: C10H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.19,"smiles":null,"spectrum_id":"CCMSLIB00017216418","spectrum_index":4983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetylamino-6-formylamino-3-methyluracil (delta mass: 17.0183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.096,"smiles":null,"spectrum_id":"CCMSLIB00017216421","spectrum_index":4984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 102.0815 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.345,"smiles":null,"spectrum_id":"CCMSLIB00017216423","spectrum_index":4985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopropyl 4-hydroxybenzoate (delta mass: 98.048 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017216424","spectrum_index":4986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 227.0794 Da; putative annotation: N/A; putative formula: C10H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.198,"smiles":null,"spectrum_id":"CCMSLIB00017216425","spectrum_index":4987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arsubin (delta mass: 239.1009 Da; putative annotation: N/A; putative formula: C11H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.249,"smiles":null,"spectrum_id":"CCMSLIB00017216427","spectrum_index":4988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 15.0143 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.074,"smiles":null,"spectrum_id":"CCMSLIB00017216429","spectrum_index":4989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 330.0954 Da; putative annotation: N/A; putative formula: C17H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.177,"smiles":null,"spectrum_id":"CCMSLIB00017216430","spectrum_index":4990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 213.0851 Da; putative annotation: N/A; putative formula: C9H16N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.27,"smiles":null,"spectrum_id":"CCMSLIB00017216431","spectrum_index":4991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 85.0927 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.163,"smiles":null,"spectrum_id":"CCMSLIB00017216433","spectrum_index":4992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP007502 Lithocholenic Acid|AC1N11MC|4-(3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid (delta mass: 36.9609 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.25,"smiles":null,"spectrum_id":"CCMSLIB00017216434","spectrum_index":4993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 55.9901 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.081,"smiles":null,"spectrum_id":"CCMSLIB00017216437","spectrum_index":4994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 114.0947 Da; putative annotation: N/A; putative formula: C7H15O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017216438","spectrum_index":4995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026502 5?-CHOLANIC ACID-3?_ 12?-DIOL-7-ONE|7-Ketodeoxycholic acid|(4R)-4-[(3R,5S,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]ph (delta mass: 330.1843 Da; putative annotation: N/A; putative formula: C21H22N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.464,"smiles":null,"spectrum_id":"CCMSLIB00017216442","spectrum_index":4996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Ala-Gly-Gly-Gly (delta mass: 100.0493 Da; putative annotation: N/A; putative formula: CH4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.169,"smiles":null,"spectrum_id":"CCMSLIB00017216443","spectrum_index":4997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 18.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.197,"smiles":null,"spectrum_id":"CCMSLIB00017216444","spectrum_index":4998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 376.1364 Da; putative annotation: N/A; putative formula: C29H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.27,"smiles":null,"spectrum_id":"CCMSLIB00017216446","spectrum_index":4999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 487.1019 Da; putative annotation: N/A; putative formula: C18H25N5O5S3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.167,"smiles":null,"spectrum_id":"CCMSLIB00017216448","spectrum_index":5000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 127.0418 Da; putative annotation: 1H-Indole-4-carboxaldehyde; putative formula: C9H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.123,"smiles":null,"spectrum_id":"CCMSLIB00017216450","spectrum_index":5001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 463.305 Da; putative annotation: 1-Pentadecanoyl-sn-glycero-3-phosphocholine; putative formula: C23H46NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":959.645,"smiles":null,"spectrum_id":"CCMSLIB00017216451","spectrum_index":5002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 105.0215 Da; putative annotation: Massbank:FIO00681 Picolinic acid; putative formula: C6H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.145,"smiles":null,"spectrum_id":"CCMSLIB00017216452","spectrum_index":5003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diprotin B (delta mass: 210.1373 Da; putative annotation: Pro-Ile; putative formula: C11H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.36,"smiles":null,"spectrum_id":"CCMSLIB00017216454","spectrum_index":5004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 210.1981 Da; putative annotation: tetradecanoic acid; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.467,"smiles":null,"spectrum_id":"CCMSLIB00017216455","spectrum_index":5005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 260.2125 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.466,"smiles":null,"spectrum_id":"CCMSLIB00017216458","spectrum_index":5006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 226.0792 Da; putative annotation: BIOTIN; putative formula: C10H14N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.182,"smiles":null,"spectrum_id":"CCMSLIB00017216459","spectrum_index":5007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10(S),17(S)-Dihydroxy-4Z,7Z,11E,13Z,15E,19Z-docosahexaenoic acid (delta mass: 327.2586 Da; putative annotation: Eicosapentaenoyl ethanolamide; putative formula: C22H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.496,"smiles":null,"spectrum_id":"CCMSLIB00017216460","spectrum_index":5008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lumisterol 3 (delta mass: 198.1253 Da; putative annotation: Virginiaebutanolide C; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.472,"smiles":null,"spectrum_id":"CCMSLIB00017216462","spectrum_index":5009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 302.1877 Da; putative annotation: 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE; putative formula: C19H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.404,"smiles":null,"spectrum_id":"CCMSLIB00017216463","spectrum_index":5010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 279.2558 Da; putative annotation: Palmitoleoyl ethanolamide; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.509,"smiles":null,"spectrum_id":"CCMSLIB00017216464","spectrum_index":5011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoleic acid (delta mass: 319.2488 Da; putative annotation: Gly-C18:2; putative formula: C20H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.496,"smiles":null,"spectrum_id":"CCMSLIB00017216467","spectrum_index":5012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 303.2549 Da; putative annotation: Massbank:RP003403 alpha-Linolenoyl Ethanolamide|(9Z,12Z,15Z)-N-(2-hydroxyethyl)octadeca-9,12,15-trienamide; putative formula: C20H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.769,"smiles":null,"spectrum_id":"CCMSLIB00017216468","spectrum_index":5013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 147.0684 Da; putative annotation: 1-(4-Hydroxyphenyl)-2-methylaminoethanone; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017216470","spectrum_index":5014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 106.0437 Da; putative annotation: guaiacol CollisionEnergy:102040; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.22,"smiles":null,"spectrum_id":"CCMSLIB00017216471","spectrum_index":5015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 156.1145 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.195,"smiles":null,"spectrum_id":"CCMSLIB00017216472","spectrum_index":5016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 144.0554 Da; putative annotation: N/A; putative formula: C6H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.084,"smiles":null,"spectrum_id":"CCMSLIB00017216473","spectrum_index":5017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 227.1485 Da; putative annotation: N/A; putative formula: C8H17N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.396,"smiles":null,"spectrum_id":"CCMSLIB00017216476","spectrum_index":5018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 137.0686 Da; putative annotation: N/A; putative formula: C5H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.118,"smiles":null,"spectrum_id":"CCMSLIB00017216478","spectrum_index":5019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 276.0979 Da; putative annotation: N/A; putative formula: C11H22N2P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.178,"smiles":null,"spectrum_id":"CCMSLIB00017216479","spectrum_index":5020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 410.2997 Da; putative annotation: N/A; putative formula: C20H38N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.558,"smiles":null,"spectrum_id":"CCMSLIB00017216480","spectrum_index":5021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 558.1765 Da; putative annotation: N/A; putative formula: C38H26N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.237,"smiles":null,"spectrum_id":"CCMSLIB00017216481","spectrum_index":5022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 41.0828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.138,"smiles":null,"spectrum_id":"CCMSLIB00017216482","spectrum_index":5023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 281.1361 Da; putative annotation: N/A; putative formula: C15H24NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.249,"smiles":null,"spectrum_id":"CCMSLIB00017216484","spectrum_index":5024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 391.2935 Da; putative annotation: N/A; putative formula: C20H41NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.484,"smiles":null,"spectrum_id":"CCMSLIB00017216487","spectrum_index":5025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 587.2417 Da; putative annotation: N/A; putative formula: C36H33N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.338,"smiles":null,"spectrum_id":"CCMSLIB00017216488","spectrum_index":5026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 194.1312 Da; putative annotation: N/A; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.249,"smiles":null,"spectrum_id":"CCMSLIB00017216489","spectrum_index":5027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Gln (delta mass: 194.1291 Da; putative annotation: N/A; putative formula: C8H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.264,"smiles":null,"spectrum_id":"CCMSLIB00017216490","spectrum_index":5028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 197.0902 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.13,"smiles":null,"spectrum_id":"CCMSLIB00017216492","spectrum_index":5029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-OxoOTrE from NIST14 (delta mass: 83.0581 Da; putative annotation: N/A; putative formula: C2H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.269,"smiles":null,"spectrum_id":"CCMSLIB00017216494","spectrum_index":5030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Itopride (delta mass: 139.0382 Da; putative annotation: N/A; putative formula: C5H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.235,"smiles":null,"spectrum_id":"CCMSLIB00017216496","spectrum_index":5031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310809 Guanosine (delta mass: 165.064 Da; putative annotation: N/A; putative formula: C5H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.163,"smiles":null,"spectrum_id":"CCMSLIB00017216497","spectrum_index":5032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 86.0373 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017216499","spectrum_index":5033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 167.0253 Da; putative annotation: N/A; putative formula: C4H9NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.122,"smiles":null,"spectrum_id":"CCMSLIB00017216500","spectrum_index":5034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentalenolactone D (delta mass: 72.0393 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.183,"smiles":null,"spectrum_id":"CCMSLIB00017216501","spectrum_index":5035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 122.1092 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.185,"smiles":null,"spectrum_id":"CCMSLIB00017216504","spectrum_index":5036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017216506","spectrum_index":5037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 236.0897 Da; putative annotation: N/A; putative formula: C9H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.337,"smiles":null,"spectrum_id":"CCMSLIB00017216507","spectrum_index":5038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(8Z,11Z,14Z-Eicosatrienoyl)ethanolamine (delta mass: 82.0785 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.384,"smiles":null,"spectrum_id":"CCMSLIB00017216508","spectrum_index":5039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic JBIR 27 (delta mass: 70.0458 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.21,"smiles":null,"spectrum_id":"CCMSLIB00017216509","spectrum_index":5040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 98.0369 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.15,"smiles":null,"spectrum_id":"CCMSLIB00017216511","spectrum_index":5041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 163.0569 Da; putative annotation: N/A; putative formula: C8H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.168,"smiles":null,"spectrum_id":"CCMSLIB00017216514","spectrum_index":5042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 174.1469 Da; putative annotation: N/A; putative formula: C7H18N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.494,"smiles":null,"spectrum_id":"CCMSLIB00017216515","spectrum_index":5043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1-piperidinyl)cyclohexanol (delta mass: 91.0513 Da; putative annotation: N/A; putative formula: H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.252,"smiles":null,"spectrum_id":"CCMSLIB00017216516","spectrum_index":5044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 53.9775 Da; putative annotation: N/A; putative formula: CH-1N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.111,"smiles":null,"spectrum_id":"CCMSLIB00017216517","spectrum_index":5045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,12Z)-11-Acetyloxy-3a-hydroxy-2,5,8,8,12-pentamethyl-4,9-dioxo-2,3,5,10,11,13a-hexahydro-1H-cyclopenta[12]annulen-1-yl benzoate (delta mass: 139.0978 Da; putative annotation: N/A; putative formula: C4H9N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.351,"smiles":null,"spectrum_id":"CCMSLIB00017216518","spectrum_index":5046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 681.3932 Da; putative annotation: N/A; putative formula: C45H51N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":862.464,"smiles":null,"spectrum_id":"CCMSLIB00017216522","spectrum_index":5047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 623.3149 Da; putative annotation: N/A; putative formula: C41H41N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.375,"smiles":null,"spectrum_id":"CCMSLIB00017216523","spectrum_index":5048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 46.0502 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.131,"smiles":null,"spectrum_id":"CCMSLIB00017216524","spectrum_index":5049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 83.0733 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017216525","spectrum_index":5050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 255.1683 Da; putative annotation: N/A; putative formula: C11H21N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.432,"smiles":null,"spectrum_id":"CCMSLIB00017216527","spectrum_index":5051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 118.115 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.368,"smiles":null,"spectrum_id":"CCMSLIB00017216528","spectrum_index":5052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 254.2713 Da; putative annotation: N/A; putative formula: C16H34N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.363,"smiles":null,"spectrum_id":"CCMSLIB00017216531","spectrum_index":5053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 50.0 eV (delta mass: 226.0881 Da; putative annotation: N/A; putative formula: C9H14N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.179,"smiles":null,"spectrum_id":"CCMSLIB00017216532","spectrum_index":5054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 17.1148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.421,"smiles":null,"spectrum_id":"CCMSLIB00017216533","spectrum_index":5055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 326.2432 Da; putative annotation: N/A; putative formula: C19H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.47,"smiles":null,"spectrum_id":"CCMSLIB00017216535","spectrum_index":5056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine CollisionEnergy:102040 (delta mass: 196.0722 Da; putative annotation: N/A; putative formula: C4H13N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.169,"smiles":null,"spectrum_id":"CCMSLIB00017216536","spectrum_index":5057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 52.0315 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.185,"smiles":null,"spectrum_id":"CCMSLIB00017216539","spectrum_index":5058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 205.1311 Da; putative annotation: N/A; putative formula: C9H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.233,"smiles":null,"spectrum_id":"CCMSLIB00017216540","spectrum_index":5059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 148.0525 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.139,"smiles":null,"spectrum_id":"CCMSLIB00017216542","spectrum_index":5060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 194.1907 Da; putative annotation: N/A; putative formula: C11H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.269,"smiles":null,"spectrum_id":"CCMSLIB00017216543","spectrum_index":5061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 42.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.159,"smiles":null,"spectrum_id":"CCMSLIB00017216544","spectrum_index":5062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 58.0418 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.133,"smiles":null,"spectrum_id":"CCMSLIB00017216547","spectrum_index":5063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3S_2349_Tetrahydro_1h_pyrido_34b_indole_carboxylic_acid (delta mass: 292.1059 Da; putative annotation: N/A; putative formula: C14H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.203,"smiles":null,"spectrum_id":"CCMSLIB00017216549","spectrum_index":5064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 69.0577 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.149,"smiles":null,"spectrum_id":"CCMSLIB00017216550","spectrum_index":5065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 67.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.311,"smiles":null,"spectrum_id":"CCMSLIB00017216551","spectrum_index":5066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 140.0913 Da; putative annotation: N/A; putative formula: C3H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.189,"smiles":null,"spectrum_id":"CCMSLIB00017216552","spectrum_index":5067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 275.1026 Da; putative annotation: N/A; putative formula: C13H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.241,"smiles":null,"spectrum_id":"CCMSLIB00017216554","spectrum_index":5068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 17.9394 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":122.01,"smiles":null,"spectrum_id":"CCMSLIB00017216557","spectrum_index":5069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 134.1092 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.362,"smiles":null,"spectrum_id":"CCMSLIB00017216558","spectrum_index":5070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 266.2603 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.336,"smiles":null,"spectrum_id":"CCMSLIB00017216559","spectrum_index":5071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 66.0466 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.42,"smiles":null,"spectrum_id":"CCMSLIB00017216560","spectrum_index":5072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 44.0268 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.18,"smiles":null,"spectrum_id":"CCMSLIB00017216562","spectrum_index":5073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 326.2607 Da; putative annotation: N/A; putative formula: C23H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.415,"smiles":null,"spectrum_id":"CCMSLIB00017216563","spectrum_index":5074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 257.2348 Da; putative annotation: N/A; putative formula: C15H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.425,"smiles":null,"spectrum_id":"CCMSLIB00017216566","spectrum_index":5075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 37.0406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.095,"smiles":null,"spectrum_id":"CCMSLIB00017216567","spectrum_index":5076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 82.0783 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.305,"smiles":null,"spectrum_id":"CCMSLIB00017216568","spectrum_index":5077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 122.107 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.36,"smiles":null,"spectrum_id":"CCMSLIB00017216569","spectrum_index":5078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 134.1097 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017216571","spectrum_index":5079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl deoxycholate (delta mass: 112.074 Da; putative annotation: N/A; putative formula: C4H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.39,"smiles":null,"spectrum_id":"CCMSLIB00017216574","spectrum_index":5080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 64.0684 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.421,"smiles":null,"spectrum_id":"CCMSLIB00017216575","spectrum_index":5081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 96.0948 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.238,"smiles":null,"spectrum_id":"CCMSLIB00017216576","spectrum_index":5082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 61.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.342,"smiles":null,"spectrum_id":"CCMSLIB00017216578","spectrum_index":5083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 17.0273 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.13,"smiles":null,"spectrum_id":"CCMSLIB00017216579","spectrum_index":5084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 40.919 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.974,"smiles":null,"spectrum_id":"CCMSLIB00017216581","spectrum_index":5085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 459.8156 Da; putative annotation: N/A; putative formula: C15H8O-1S9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.907,"smiles":null,"spectrum_id":"CCMSLIB00017216582","spectrum_index":5086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 471.3393 Da; putative annotation: N/A; putative formula: C27H53NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.378,"smiles":null,"spectrum_id":"CCMSLIB00017216585","spectrum_index":5087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 214.1621 Da; putative annotation: N/A; putative formula: C10H22N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.301,"smiles":null,"spectrum_id":"CCMSLIB00017216586","spectrum_index":5088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxy-5.beta.-pregnane-3,11,20-trione (delta mass: 63.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.29,"smiles":null,"spectrum_id":"CCMSLIB00017216587","spectrum_index":5089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 223.1565 Da; putative annotation: N/A; putative formula: C13H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.446,"smiles":null,"spectrum_id":"CCMSLIB00017216589","spectrum_index":5090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1-piperidinyl)cyclohexanol (delta mass: 92.0552 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.256,"smiles":null,"spectrum_id":"CCMSLIB00017216591","spectrum_index":5091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 89.0474 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.19,"smiles":null,"spectrum_id":"CCMSLIB00017216593","spectrum_index":5092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid; AIF; CE0; MS2Dec (delta mass: 176.0348 Da; putative annotation: N/A; putative formula: C5H9N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.105,"smiles":null,"spectrum_id":"CCMSLIB00017216594","spectrum_index":5093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 73.0866 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.289,"smiles":null,"spectrum_id":"CCMSLIB00017216596","spectrum_index":5094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 222.1976 Da; putative annotation: N/A; putative formula: C15H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.44,"smiles":null,"spectrum_id":"CCMSLIB00017216597","spectrum_index":5095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 214.1562 Da; putative annotation: N/A; putative formula: C12H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.221,"smiles":null,"spectrum_id":"CCMSLIB00017216600","spectrum_index":5096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 67.0634 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.306,"smiles":null,"spectrum_id":"CCMSLIB00017216601","spectrum_index":5097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrooroselol (delta mass: 214.1446 Da; putative annotation: N/A; putative formula: C9H18N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.241,"smiles":null,"spectrum_id":"CCMSLIB00017216602","spectrum_index":5098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380198-01!4-[5-chloro-7-(3,5-dihydroxyhexanoyloxy)-3-[(1E,3E,5E)-hepta-1,3,5-trienyl]-7-methyl-6,8-dioxoisoquinolin-2-yl]butanoic acid (delta mass: 533.186 Da; putative annotation: N/A; putative formula: C24H32N5O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1067.37,"smiles":null,"spectrum_id":"CCMSLIB00017216604","spectrum_index":5099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chamanetin (delta mass: 106.0434 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.166,"smiles":null,"spectrum_id":"CCMSLIB00017216607","spectrum_index":5100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxybenzoic acid (delta mass: 186.1753 Da; putative annotation: N/A; putative formula: C15H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.251,"smiles":null,"spectrum_id":"CCMSLIB00017216608","spectrum_index":5101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 130.0273 Da; putative annotation: N/A; putative formula: C6H10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.155,"smiles":null,"spectrum_id":"CCMSLIB00017216609","spectrum_index":5102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 107.0369 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017216611","spectrum_index":5103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid propyl ester (delta mass: 41.9886 Da; putative annotation: N/A; putative formula: C5H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.074,"smiles":null,"spectrum_id":"CCMSLIB00017216612","spectrum_index":5104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 49.9791 Da; putative annotation: N/A; putative formula: C3H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.086,"smiles":null,"spectrum_id":"CCMSLIB00017216614","spectrum_index":5105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 129.0455 Da; putative annotation: N/A; putative formula: C4H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.19,"smiles":null,"spectrum_id":"CCMSLIB00017216617","spectrum_index":5106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 78.0302 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.246,"smiles":null,"spectrum_id":"CCMSLIB00017216618","spectrum_index":5107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 650.4775 Da; putative annotation: N/A; putative formula: C39H62N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":859.667,"smiles":null,"spectrum_id":"CCMSLIB00017216619","spectrum_index":5108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 234.1394 Da; putative annotation: N/A; putative formula: C12H19N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.201,"smiles":null,"spectrum_id":"CCMSLIB00017216620","spectrum_index":5109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gln (delta mass: 110.0481 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.167,"smiles":null,"spectrum_id":"CCMSLIB00017216622","spectrum_index":5110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(R)-Hydroxydocosahexaenoic acid (delta mass: 53.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.29,"smiles":null,"spectrum_id":"CCMSLIB00017216624","spectrum_index":5111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 332.2578 Da; putative annotation: N/A; putative formula: C19H32N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.5,"smiles":null,"spectrum_id":"CCMSLIB00017216625","spectrum_index":5112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU279501 5-Hydroxyindole-3-acetic acid|2-(5-hydroxy-1H-indol-3-yl)acetic acid (delta mass: 230.1511 Da; putative annotation: N/A; putative formula: C12H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.217,"smiles":null,"spectrum_id":"CCMSLIB00017216627","spectrum_index":5113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 509.3186 Da; putative annotation: N/A; putative formula: C21H39N11O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.379,"smiles":null,"spectrum_id":"CCMSLIB00017216628","spectrum_index":5114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 419.3387 Da; putative annotation: N/A; putative formula: C20H46N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.645,"smiles":null,"spectrum_id":"CCMSLIB00017216630","spectrum_index":5115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 578.3783 Da; putative annotation: N/A; putative formula: C28H54N2O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.47,"smiles":null,"spectrum_id":"CCMSLIB00017216632","spectrum_index":5116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380944-01_C30H46O3_(3beta,5xi,9xi,13alpha,17alpha,18xi)-3-Hydroxy-13,28-epoxyurs-11-en-28-one (delta mass: 132.042 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.394,"smiles":null,"spectrum_id":"CCMSLIB00017216633","spectrum_index":5117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-methylolivetolcarboxylic acid (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.159,"smiles":null,"spectrum_id":"CCMSLIB00017216634","spectrum_index":5118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 97.0415 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.149,"smiles":null,"spectrum_id":"CCMSLIB00017216635","spectrum_index":5119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 134.1096 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.347,"smiles":null,"spectrum_id":"CCMSLIB00017216636","spectrum_index":5120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 48.0406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.33,"smiles":null,"spectrum_id":"CCMSLIB00017216638","spectrum_index":5121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 134.0194 Da; putative annotation: N/A; putative formula: C8H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.09,"smiles":null,"spectrum_id":"CCMSLIB00017216641","spectrum_index":5122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 74.0364 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.138,"smiles":null,"spectrum_id":"CCMSLIB00017216642","spectrum_index":5123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Echinulin (delta mass: 45.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.37,"smiles":null,"spectrum_id":"CCMSLIB00017216643","spectrum_index":5124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 18.0722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.107,"smiles":null,"spectrum_id":"CCMSLIB00017216644","spectrum_index":5125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4R,6R)-4-Amino-2-oxabicyclo[3.1.0]hexane-4,6-dicarboxylic acid (delta mass: 101.0383 Da; putative annotation: N/A; putative formula: C6H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.094,"smiles":null,"spectrum_id":"CCMSLIB00017216645","spectrum_index":5126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 254.0895 Da; putative annotation: N/A; putative formula: C13H19OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.171,"smiles":null,"spectrum_id":"CCMSLIB00017216649","spectrum_index":5127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 195.0902 Da; putative annotation: N/A; putative formula: C10H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.192,"smiles":null,"spectrum_id":"CCMSLIB00017216650","spectrum_index":5128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetic acid, 2-(2,4,6-trichlorophenoxy)-, (2E)-2-(1H-pyrrol-2-ylmethylene)hydrazide (delta mass: 243.9858 Da; putative annotation: N/A; putative formula: C8H4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.977,"smiles":null,"spectrum_id":"CCMSLIB00017216651","spectrum_index":5129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 513.3294 Da; putative annotation: N/A; putative formula: C32H43N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.546,"smiles":null,"spectrum_id":"CCMSLIB00017216652","spectrum_index":5130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 110.0823 Da; putative annotation: N/A; putative formula: C6H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.34,"smiles":null,"spectrum_id":"CCMSLIB00017216654","spectrum_index":5131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Methylsulfonyl)-13-(3-pentyloxiranyl)-5Z,8Z,11Z-tridecatrienamide (delta mass: 36.0389 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.275,"smiles":null,"spectrum_id":"CCMSLIB00017216656","spectrum_index":5132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 87.0565 Da; putative annotation: N/A; putative formula: CH5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.121,"smiles":null,"spectrum_id":"CCMSLIB00017216657","spectrum_index":5133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 391.1317 Da; putative annotation: N/A; putative formula: C17H21N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.317,"smiles":null,"spectrum_id":"CCMSLIB00017216658","spectrum_index":5134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 144.0415 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.305,"smiles":null,"spectrum_id":"CCMSLIB00017216659","spectrum_index":5135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 148.0052 Da; putative annotation: N/A; putative formula: C2H4N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.055,"smiles":null,"spectrum_id":"CCMSLIB00017216661","spectrum_index":5136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 801.7635 Da; putative annotation: N/A; putative formula: C42H95N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1306.94,"smiles":null,"spectrum_id":"CCMSLIB00017216663","spectrum_index":5137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 720.2331 Da; putative annotation: N/A; putative formula: C41H32N6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1225.41,"smiles":null,"spectrum_id":"CCMSLIB00017216665","spectrum_index":5138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sericic acid (delta mass: 120.0937 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.446,"smiles":null,"spectrum_id":"CCMSLIB00017216666","spectrum_index":5139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.297,"smiles":null,"spectrum_id":"CCMSLIB00017216668","spectrum_index":5140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 150.0906 Da; putative annotation: N/A; putative formula: C7H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.38,"smiles":null,"spectrum_id":"CCMSLIB00017216669","spectrum_index":5141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 296.2706 Da; putative annotation: N/A; putative formula: C19H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":889.546,"smiles":null,"spectrum_id":"CCMSLIB00017216671","spectrum_index":5142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 89.0843 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.15,"smiles":null,"spectrum_id":"CCMSLIB00017216673","spectrum_index":5143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydropiperlonguminine (delta mass: 60.0217 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.181,"smiles":null,"spectrum_id":"CCMSLIB00017216675","spectrum_index":5144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 88.0497 Da; putative annotation: N/A; putative formula: H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.146,"smiles":null,"spectrum_id":"CCMSLIB00017216676","spectrum_index":5145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 45.0216 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.165,"smiles":null,"spectrum_id":"CCMSLIB00017216677","spectrum_index":5146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 550.2995 Da; putative annotation: N/A; putative formula: C27H50O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":844.579,"smiles":null,"spectrum_id":"CCMSLIB00017216680","spectrum_index":5147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Ketofusidic acid (delta mass: 52.0675 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.404,"smiles":null,"spectrum_id":"CCMSLIB00017216682","spectrum_index":5148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 299.2818 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.503,"smiles":null,"spectrum_id":"CCMSLIB00017216683","spectrum_index":5149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 102.0679 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.149,"smiles":null,"spectrum_id":"CCMSLIB00017216685","spectrum_index":5150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 40.031 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017216686","spectrum_index":5151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 678.5043 Da; putative annotation: N/A; putative formula: C36H66N6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.596,"smiles":null,"spectrum_id":"CCMSLIB00017216688","spectrum_index":5152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxycinnamic acid (delta mass: 70.0448 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.11,"smiles":null,"spectrum_id":"CCMSLIB00017216690","spectrum_index":5153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 162.0683 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.149,"smiles":null,"spectrum_id":"CCMSLIB00017216692","spectrum_index":5154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2,3-dione (delta mass: 23.0153 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.045,"smiles":null,"spectrum_id":"CCMSLIB00017216694","spectrum_index":5155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.18,"smiles":null,"spectrum_id":"CCMSLIB00017216695","spectrum_index":5156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 156.0089 Da; putative annotation: N/A; putative formula: C5H5N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.079,"smiles":null,"spectrum_id":"CCMSLIB00017216697","spectrum_index":5157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.alpha.-estrane-3.alpha.,17.beta.-diol (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.346,"smiles":null,"spectrum_id":"CCMSLIB00017216699","spectrum_index":5158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 169.074 Da; putative annotation: N/A; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.145,"smiles":null,"spectrum_id":"CCMSLIB00017216700","spectrum_index":5159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxabicyclo[4.1.0]hept-3-en-2-one, 5-hydroxy-3-(hydroxymethyl)-1-(1-hydroxy-3-methyl-2-buten-1-yl)-4-(1-propen-1-yl)- (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017216702","spectrum_index":5160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 64.0314 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017216704","spectrum_index":5161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _120109 (delta mass: 32.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.082,"smiles":null,"spectrum_id":"CCMSLIB00017216706","spectrum_index":5162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _120109 (delta mass: 134.0224 Da; putative annotation: N/A; putative formula: C5H10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.077,"smiles":null,"spectrum_id":"CCMSLIB00017216707","spectrum_index":5163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 80.0655 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.116,"smiles":null,"spectrum_id":"CCMSLIB00017216708","spectrum_index":5164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PAR_146.0966_8.3 (delta mass: 45.0489 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.145,"smiles":null,"spectrum_id":"CCMSLIB00017216710","spectrum_index":5165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 62.0531 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.124,"smiles":null,"spectrum_id":"CCMSLIB00017216711","spectrum_index":5166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 81.0682 Da; putative annotation: N/A; putative formula: C4H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.144,"smiles":null,"spectrum_id":"CCMSLIB00017216713","spectrum_index":5167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Pyrazolo[3,4-b]pyridine (delta mass: 38.0051 Da; putative annotation: N/A; putative formula: H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.061,"smiles":null,"spectrum_id":"CCMSLIB00017216715","spectrum_index":5168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 315.1161 Da; putative annotation: N/A; putative formula: C23H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.192,"smiles":null,"spectrum_id":"CCMSLIB00017216716","spectrum_index":5169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maleic hydrazide (delta mass: 45.0041 Da; putative annotation: N/A; putative formula: CH3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.039,"smiles":null,"spectrum_id":"CCMSLIB00017216717","spectrum_index":5170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 24.0046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.107,"smiles":null,"spectrum_id":"CCMSLIB00017216718","spectrum_index":5171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 136.0163 Da; putative annotation: N/A; putative formula: C7H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.071,"smiles":null,"spectrum_id":"CCMSLIB00017216719","spectrum_index":5172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 70.0771 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.184,"smiles":null,"spectrum_id":"CCMSLIB00017216723","spectrum_index":5173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 249.1869 Da; putative annotation: N/A; putative formula: C19H23NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.268,"smiles":null,"spectrum_id":"CCMSLIB00017216724","spectrum_index":5174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-nitro-1H-indole-2-carboxylate (delta mass: 107.0659 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.137,"smiles":null,"spectrum_id":"CCMSLIB00017216725","spectrum_index":5175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-7,12-Dihydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 154.1184 Da; putative annotation: N/A; putative formula: C10H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.325,"smiles":null,"spectrum_id":"CCMSLIB00017216726","spectrum_index":5176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 79.0648 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.276,"smiles":null,"spectrum_id":"CCMSLIB00017216727","spectrum_index":5177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 400.213 Da; putative annotation: N/A; putative formula: C19H33N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.331,"smiles":null,"spectrum_id":"CCMSLIB00017216730","spectrum_index":5178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 91.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.16,"smiles":null,"spectrum_id":"CCMSLIB00017216732","spectrum_index":5179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017216733","spectrum_index":5180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 333.2869 Da; putative annotation: N/A; putative formula: C22H39NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.534,"smiles":null,"spectrum_id":"CCMSLIB00017216734","spectrum_index":5181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 218.1418 Da; putative annotation: N/A; putative formula: C13H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.259,"smiles":null,"spectrum_id":"CCMSLIB00017216735","spectrum_index":5182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 90.0137 Da; putative annotation: N/A; putative formula: C3H6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.131,"smiles":null,"spectrum_id":"CCMSLIB00017216738","spectrum_index":5183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 128.0241 Da; putative annotation: N/A; putative formula: C5N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.235,"smiles":null,"spectrum_id":"CCMSLIB00017216740","spectrum_index":5184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 136.0536 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.145,"smiles":null,"spectrum_id":"CCMSLIB00017216741","spectrum_index":5185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cresotinic acid (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017216742","spectrum_index":5186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 361.285 Da; putative annotation: N/A; putative formula: C18H40N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.512,"smiles":null,"spectrum_id":"CCMSLIB00017216743","spectrum_index":5187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 573.2638 Da; putative annotation: N/A; putative formula: C26H44N3O7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.334,"smiles":null,"spectrum_id":"CCMSLIB00017216746","spectrum_index":5188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 331.3409 Da; putative annotation: N/A; putative formula: C22H41N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.693,"smiles":null,"spectrum_id":"CCMSLIB00017216748","spectrum_index":5189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 362.107 Da; putative annotation: N/A; putative formula: C16H30O-1P4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.167,"smiles":null,"spectrum_id":"CCMSLIB00017216749","spectrum_index":5190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 46.9208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.023,"smiles":null,"spectrum_id":"CCMSLIB00017216750","spectrum_index":5191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 90.0686 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017216751","spectrum_index":5192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxopimara-8(14),15-dien-20-oic acid (delta mass: 14.0152 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.226,"smiles":null,"spectrum_id":"CCMSLIB00017216754","spectrum_index":5193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 182.1672 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017216756","spectrum_index":5194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 200.1044 Da; putative annotation: N/A; putative formula: C10H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.155,"smiles":null,"spectrum_id":"CCMSLIB00017216757","spectrum_index":5195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 64.0675 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.299,"smiles":null,"spectrum_id":"CCMSLIB00017216758","spectrum_index":5196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 339.2782 Da; putative annotation: N/A; putative formula: C21H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.489,"smiles":null,"spectrum_id":"CCMSLIB00017216759","spectrum_index":5197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pristanic acid (delta mass: 108.0937 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.388,"smiles":null,"spectrum_id":"CCMSLIB00017216761","spectrum_index":5198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 9.9188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017216764","spectrum_index":5199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 133.0421 Da; putative annotation: N/A; putative formula: C2H7N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.134,"smiles":null,"spectrum_id":"CCMSLIB00017216765","spectrum_index":5200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Oxyclozapine (delta mass: 32.0218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.154,"smiles":null,"spectrum_id":"CCMSLIB00017216766","spectrum_index":5201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.263,"smiles":null,"spectrum_id":"CCMSLIB00017216767","spectrum_index":5202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 197.1053 Da; putative annotation: N/A; putative formula: C10H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.176,"smiles":null,"spectrum_id":"CCMSLIB00017216770","spectrum_index":5203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 50.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.284,"smiles":null,"spectrum_id":"CCMSLIB00017216771","spectrum_index":5204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Boldenone (delta mass: 54.0464 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.247,"smiles":null,"spectrum_id":"CCMSLIB00017216772","spectrum_index":5205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 75.9947 Da; putative annotation: N/A; putative formula: C5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.091,"smiles":null,"spectrum_id":"CCMSLIB00017216773","spectrum_index":5206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.264,"smiles":null,"spectrum_id":"CCMSLIB00017216775","spectrum_index":5207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 69.0581 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.14,"smiles":null,"spectrum_id":"CCMSLIB00017216777","spectrum_index":5208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 207.0884 Da; putative annotation: N/A; putative formula: C11H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.243,"smiles":null,"spectrum_id":"CCMSLIB00017216779","spectrum_index":5209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.107,"smiles":null,"spectrum_id":"CCMSLIB00017216780","spectrum_index":5210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 107.0366 Da; putative annotation: N/A; putative formula: H6N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.128,"smiles":null,"spectrum_id":"CCMSLIB00017216781","spectrum_index":5211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,16.Xi.)-17-Hydroxykauran-19-oic acid (delta mass: 110.0728 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.315,"smiles":null,"spectrum_id":"CCMSLIB00017216782","spectrum_index":5212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoyl-rac-glycerol (delta mass: 859.5347 Da; putative annotation: N/A; putative formula: C50H73N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1429.05,"smiles":null,"spectrum_id":"CCMSLIB00017216785","spectrum_index":5213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoyl-rac-glycerol (delta mass: 137.0241 Da; putative annotation: N/A; putative formula: C3H8NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.538,"smiles":null,"spectrum_id":"CCMSLIB00017216787","spectrum_index":5214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 106.031 Da; putative annotation: N/A; putative formula: CH6N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.103,"smiles":null,"spectrum_id":"CCMSLIB00017216788","spectrum_index":5215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-1-(2-Hydroxyethyl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol (delta mass: 66.0469 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.279,"smiles":null,"spectrum_id":"CCMSLIB00017216789","spectrum_index":5216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 252.2462 Da; putative annotation: N/A; putative formula: C17H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.515,"smiles":null,"spectrum_id":"CCMSLIB00017216790","spectrum_index":5217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Silychristin (delta mass: 30.0103 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.139,"smiles":null,"spectrum_id":"CCMSLIB00017216793","spectrum_index":5218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:102040 (delta mass: 253.1306 Da; putative annotation: N/A; putative formula: C13H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.175,"smiles":null,"spectrum_id":"CCMSLIB00017216795","spectrum_index":5219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MECILLINAM (delta mass: 45.0675 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.221,"smiles":null,"spectrum_id":"CCMSLIB00017216796","spectrum_index":5220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 152.1206 Da; putative annotation: N/A; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.254,"smiles":null,"spectrum_id":"CCMSLIB00017216797","spectrum_index":5221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 120.0573 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.31,"smiles":null,"spectrum_id":"CCMSLIB00017216799","spectrum_index":5222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,15-Labdanediol (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.321,"smiles":null,"spectrum_id":"CCMSLIB00017216801","spectrum_index":5223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 92.0825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.247,"smiles":null,"spectrum_id":"CCMSLIB00017216802","spectrum_index":5224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 298.1412 Da; putative annotation: N/A; putative formula: C15H22O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.253,"smiles":null,"spectrum_id":"CCMSLIB00017216803","spectrum_index":5225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 32.0235 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.282,"smiles":null,"spectrum_id":"CCMSLIB00017216805","spectrum_index":5226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatrienoic acid (delta mass: 82.0777 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.372,"smiles":null,"spectrum_id":"CCMSLIB00017216807","spectrum_index":5227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 568.378 Da; putative annotation: N/A; putative formula: C36H48N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.449,"smiles":null,"spectrum_id":"CCMSLIB00017216809","spectrum_index":5228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentianose (delta mass: 294.2564 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.433,"smiles":null,"spectrum_id":"CCMSLIB00017216810","spectrum_index":5229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 154.0627 Da; putative annotation: N/A; putative formula: C8H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.342,"smiles":null,"spectrum_id":"CCMSLIB00017216811","spectrum_index":5230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 325.3339 Da; putative annotation: N/A; putative formula: C21H43NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.446,"smiles":null,"spectrum_id":"CCMSLIB00017216813","spectrum_index":5231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 44.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.118,"smiles":null,"spectrum_id":"CCMSLIB00017216815","spectrum_index":5232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 48.1089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.12,"smiles":null,"spectrum_id":"CCMSLIB00017216817","spectrum_index":5233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 871.4956 Da; putative annotation: N/A; putative formula: C46H65N9O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1052.57,"smiles":null,"spectrum_id":"CCMSLIB00017216818","spectrum_index":5234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Azaindole (delta mass: 26.9994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.06,"smiles":null,"spectrum_id":"CCMSLIB00017216820","spectrum_index":5235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 208.1833 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.317,"smiles":null,"spectrum_id":"CCMSLIB00017216821","spectrum_index":5236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 28.032 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.17,"smiles":null,"spectrum_id":"CCMSLIB00017216824","spectrum_index":5237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 42.0367 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.048,"smiles":null,"spectrum_id":"CCMSLIB00017216826","spectrum_index":5238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 114.3028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.366,"smiles":null,"spectrum_id":"CCMSLIB00017216827","spectrum_index":5239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 154.0108 Da; putative annotation: N/A; putative formula: C3H6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.048,"smiles":null,"spectrum_id":"CCMSLIB00017216828","spectrum_index":5240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 213.0045 Da; putative annotation: N/A; putative formula: C5H12NO2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.039,"smiles":null,"spectrum_id":"CCMSLIB00017216830","spectrum_index":5241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 228.1728 Da; putative annotation: N/A; putative formula: C13H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.332,"smiles":null,"spectrum_id":"CCMSLIB00017216831","spectrum_index":5242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.,17.alpha.-Dimethyl-5.beta.-androstane-3.alpha.,17.beta.-diol (delta mass: 62.0496 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.328,"smiles":null,"spectrum_id":"CCMSLIB00017216833","spectrum_index":5243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 136.0886 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017216835","spectrum_index":5244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 130.1149 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.378,"smiles":null,"spectrum_id":"CCMSLIB00017216837","spectrum_index":5245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 59.962 Da; putative annotation: N/A; putative formula: CHO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.21,"smiles":null,"spectrum_id":"CCMSLIB00017216838","spectrum_index":5246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 160.0738 Da; putative annotation: N/A; putative formula: C2H9N8O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.29,"smiles":null,"spectrum_id":"CCMSLIB00017216839","spectrum_index":5247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 78.0841 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.353,"smiles":null,"spectrum_id":"CCMSLIB00017216842","spectrum_index":5248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis,cis-9,12-Octadecadien-1-ol (delta mass: 212.9617 Da; putative annotation: N/A; putative formula: C10NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.23,"smiles":null,"spectrum_id":"CCMSLIB00017216844","spectrum_index":5249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.128,"smiles":null,"spectrum_id":"CCMSLIB00017216845","spectrum_index":5250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decahydronaphthalene-2-carboxylic acid (delta mass: 60.0206 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.159,"smiles":null,"spectrum_id":"CCMSLIB00017216846","spectrum_index":5251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-QUINOLINECARBOXYLIC ACID - 40.0 eV (delta mass: 15.0355 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.09,"smiles":null,"spectrum_id":"CCMSLIB00017216848","spectrum_index":5252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017216850","spectrum_index":5253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.263,"smiles":null,"spectrum_id":"CCMSLIB00017216851","spectrum_index":5254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 70.0 eV (delta mass: 42.0096 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.123,"smiles":null,"spectrum_id":"CCMSLIB00017216852","spectrum_index":5255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLIC ACID (delta mass: 102.0314 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.07,"smiles":null,"spectrum_id":"CCMSLIB00017216854","spectrum_index":5256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 142.0057 Da; putative annotation: N/A; putative formula: C9H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.076,"smiles":null,"spectrum_id":"CCMSLIB00017216856","spectrum_index":5257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 112.0889 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017216857","spectrum_index":5258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentanedioic acid, 3-(1E)-1-propen-1-yl- (delta mass: 124.089 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.17,"smiles":null,"spectrum_id":"CCMSLIB00017216859","spectrum_index":5259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-palmitoyl-D-erythro-sphinganine (delta mass: 615.2019 Da; putative annotation: N/A; putative formula: C37H25N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1155.74,"smiles":null,"spectrum_id":"CCMSLIB00017216860","spectrum_index":5260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 195.0898 Da; putative annotation: N/A; putative formula: C10H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.213,"smiles":null,"spectrum_id":"CCMSLIB00017216862","spectrum_index":5261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 84.0165 Da; putative annotation: N/A; putative formula: C3H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.14,"smiles":null,"spectrum_id":"CCMSLIB00017216865","spectrum_index":5262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 108.0942 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017216866","spectrum_index":5263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 316.258 Da; putative annotation: N/A; putative formula: C14H32N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.505,"smiles":null,"spectrum_id":"CCMSLIB00017216867","spectrum_index":5264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 392.2324 Da; putative annotation: N/A; putative formula: C22H28N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.319,"smiles":null,"spectrum_id":"CCMSLIB00017216868","spectrum_index":5265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 410.2432 Da; putative annotation: N/A; putative formula: C30H34O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.34,"smiles":null,"spectrum_id":"CCMSLIB00017216870","spectrum_index":5266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 170.1129 Da; putative annotation: N/A; putative formula: C10H18S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.278,"smiles":null,"spectrum_id":"CCMSLIB00017216872","spectrum_index":5267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 279.1829 Da; putative annotation: N/A; putative formula: C16H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.451,"smiles":null,"spectrum_id":"CCMSLIB00017216873","spectrum_index":5268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 167.1309 Da; putative annotation: N/A; putative formula: C10H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.217,"smiles":null,"spectrum_id":"CCMSLIB00017216874","spectrum_index":5269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-indole-3-carbaldehyde (delta mass: 17.0911 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.167,"smiles":null,"spectrum_id":"CCMSLIB00017216876","spectrum_index":5270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 266.987 Da; putative annotation: N/A; putative formula: C7H9NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.047,"smiles":null,"spectrum_id":"CCMSLIB00017216877","spectrum_index":5271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-.alpha.-ethylaminobutiophenone (delta mass: 99.9688 Da; putative annotation: N/A; putative formula: C3HO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.123,"smiles":null,"spectrum_id":"CCMSLIB00017216879","spectrum_index":5272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 412.2835 Da; putative annotation: N/A; putative formula: C24H44OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.344,"smiles":null,"spectrum_id":"CCMSLIB00017216881","spectrum_index":5273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 59.0565 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.143,"smiles":null,"spectrum_id":"CCMSLIB00017216882","spectrum_index":5274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11-Methyl-2-dodecenoic acid (delta mass: 60.0215 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.206,"smiles":null,"spectrum_id":"CCMSLIB00017216883","spectrum_index":5275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C4:0 (delta mass: 132.0407 Da; putative annotation: N/A; putative formula: C9H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.169,"smiles":null,"spectrum_id":"CCMSLIB00017216885","spectrum_index":5276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 222.2347 Da; putative annotation: N/A; putative formula: C16H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.3,"smiles":null,"spectrum_id":"CCMSLIB00017216887","spectrum_index":5277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 43.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.16,"smiles":null,"spectrum_id":"CCMSLIB00017216889","spectrum_index":5278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU244302 2-Amino-9H-pyrido[2,3-b]indole (AalphaC)|2-Amino-9H-pyrido[2,3-b]indole|9H-pyrido[2,3-b]indol-2-amine (delta mass: 63.0506 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.137,"smiles":null,"spectrum_id":"CCMSLIB00017216890","spectrum_index":5279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 185.0689 Da; putative annotation: N/A; putative formula: C8H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.155,"smiles":null,"spectrum_id":"CCMSLIB00017216891","spectrum_index":5280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 162.0521 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.143,"smiles":null,"spectrum_id":"CCMSLIB00017216892","spectrum_index":5281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 260.0897 Da; putative annotation: N/A; putative formula: C11H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.15,"smiles":null,"spectrum_id":"CCMSLIB00017216894","spectrum_index":5282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 125.0508 Da; putative annotation: N/A; putative formula: C5H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.319,"smiles":null,"spectrum_id":"CCMSLIB00017216897","spectrum_index":5283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 58.0421 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.092,"smiles":null,"spectrum_id":"CCMSLIB00017216898","spectrum_index":5284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 175.0644 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.151,"smiles":null,"spectrum_id":"CCMSLIB00017216899","spectrum_index":5285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 130.1113 Da; putative annotation: N/A; putative formula: C6H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.25,"smiles":null,"spectrum_id":"CCMSLIB00017216900","spectrum_index":5286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 539.3096 Da; putative annotation: N/A; putative formula: C28H45NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.39,"smiles":null,"spectrum_id":"CCMSLIB00017216901","spectrum_index":5287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.336,"smiles":null,"spectrum_id":"CCMSLIB00017216903","spectrum_index":5288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 86.0383 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.098,"smiles":null,"spectrum_id":"CCMSLIB00017216906","spectrum_index":5289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 70.0817 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.157,"smiles":null,"spectrum_id":"CCMSLIB00017216907","spectrum_index":5290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.133,"smiles":null,"spectrum_id":"CCMSLIB00017216908","spectrum_index":5291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 123.0411 Da; putative annotation: N/A; putative formula: CHN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.096,"smiles":null,"spectrum_id":"CCMSLIB00017216909","spectrum_index":5292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 202.129 Da; putative annotation: N/A; putative formula: C5H14N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.185,"smiles":null,"spectrum_id":"CCMSLIB00017216911","spectrum_index":5293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Leu-DL-Val (delta mass: 99.0685 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.239,"smiles":null,"spectrum_id":"CCMSLIB00017216914","spectrum_index":5294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-[2-(Furan-3-yl)ethyl]-5-hydroxy-7,8-dimethyl-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-3-one (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.273,"smiles":null,"spectrum_id":"CCMSLIB00017216915","spectrum_index":5295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Pro (delta mass: 147.0683 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.192,"smiles":null,"spectrum_id":"CCMSLIB00017216916","spectrum_index":5296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 201.1725 Da; putative annotation: N/A; putative formula: C11H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.431,"smiles":null,"spectrum_id":"CCMSLIB00017216917","spectrum_index":5297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 147.0684 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.118,"smiles":null,"spectrum_id":"CCMSLIB00017216919","spectrum_index":5298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 113.0259 Da; putative annotation: N/A; putative formula: C2H4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017216922","spectrum_index":5299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methylthio)-1-propanol (delta mass: 106.0542 Da; putative annotation: N/A; putative formula: C6H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.107,"smiles":null,"spectrum_id":"CCMSLIB00017216923","spectrum_index":5300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 46.0962 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.108,"smiles":null,"spectrum_id":"CCMSLIB00017216924","spectrum_index":5301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 238.1422 Da; putative annotation: N/A; putative formula: C11H18N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.207,"smiles":null,"spectrum_id":"CCMSLIB00017216925","spectrum_index":5302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 428.3003 Da; putative annotation: N/A; putative formula: C21H40N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":918.596,"smiles":null,"spectrum_id":"CCMSLIB00017216927","spectrum_index":5303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 632.8495 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.963,"smiles":null,"spectrum_id":"CCMSLIB00017216930","spectrum_index":5304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 664.6875 Da; putative annotation: N/A; putative formula: C48H88)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.801,"smiles":null,"spectrum_id":"CCMSLIB00017216931","spectrum_index":5305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 123.0761 Da; putative annotation: N/A; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.209,"smiles":null,"spectrum_id":"CCMSLIB00017216932","spectrum_index":5306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.279,"smiles":null,"spectrum_id":"CCMSLIB00017216933","spectrum_index":5307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 205.1322 Da; putative annotation: N/A; putative formula: C10H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.354,"smiles":null,"spectrum_id":"CCMSLIB00017216935","spectrum_index":5308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-2-carboxylic acid (delta mass: 32.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.059,"smiles":null,"spectrum_id":"CCMSLIB00017216938","spectrum_index":5309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one (delta mass: 32.0188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.112,"smiles":null,"spectrum_id":"CCMSLIB00017216939","spectrum_index":5310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 119.077 Da; putative annotation: N/A; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.148,"smiles":null,"spectrum_id":"CCMSLIB00017216940","spectrum_index":5311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 684.2272 Da; putative annotation: N/A; putative formula: C45H28N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1027.35,"smiles":null,"spectrum_id":"CCMSLIB00017216941","spectrum_index":5312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 27.011 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.108,"smiles":null,"spectrum_id":"CCMSLIB00017216943","spectrum_index":5313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 360.2008 Da; putative annotation: N/A; putative formula: C15H28N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.324,"smiles":null,"spectrum_id":"CCMSLIB00017216945","spectrum_index":5314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 59.0257 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.096,"smiles":null,"spectrum_id":"CCMSLIB00017216946","spectrum_index":5315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:205060 (delta mass: 312.9083 Da; putative annotation: N/A; putative formula: C3H-1N5O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017216947","spectrum_index":5316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000475 Tyramine|4-(2-aminoethyl)phenol (delta mass: 386.9087 Da; putative annotation: N/A; putative formula: C4H9NO12P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017216948","spectrum_index":5317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 347.2666 Da; putative annotation: N/A; putative formula: C18H37NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.327,"smiles":null,"spectrum_id":"CCMSLIB00017216950","spectrum_index":5318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylene Glycol Monododecyl Ether (delta mass: 176.099 Da; putative annotation: N/A; putative formula: C15H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.383,"smiles":null,"spectrum_id":"CCMSLIB00017216953","spectrum_index":5319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 890.6967 Da; putative annotation: N/A; putative formula: C52H94N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1112.79,"smiles":null,"spectrum_id":"CCMSLIB00017216954","spectrum_index":5320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.1,"smiles":null,"spectrum_id":"CCMSLIB00017216955","spectrum_index":5321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 196.1145 Da; putative annotation: N/A; putative formula: C9H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.229,"smiles":null,"spectrum_id":"CCMSLIB00017216956","spectrum_index":5322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 24.0369 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.264,"smiles":null,"spectrum_id":"CCMSLIB00017216958","spectrum_index":5323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 124.0585 Da; putative annotation: N/A; putative formula: C2H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.134,"smiles":null,"spectrum_id":"CCMSLIB00017216961","spectrum_index":5324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-myo-Inositol-1-phosphate (delta mass: 396.3952 Da; putative annotation: N/A; putative formula: C22H48N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.432,"smiles":null,"spectrum_id":"CCMSLIB00017216962","spectrum_index":5325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-myo-Inositol-1-phosphate (delta mass: 410.4113 Da; putative annotation: N/A; putative formula: C27H54O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.448,"smiles":null,"spectrum_id":"CCMSLIB00017216963","spectrum_index":5326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 193.0586 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.238,"smiles":null,"spectrum_id":"CCMSLIB00017216964","spectrum_index":5327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 340.1049 Da; putative annotation: N/A; putative formula: C12H17N6O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.207,"smiles":null,"spectrum_id":"CCMSLIB00017216966","spectrum_index":5328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 392.1829 Da; putative annotation: N/A; putative formula: C15H29N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.338,"smiles":null,"spectrum_id":"CCMSLIB00017216969","spectrum_index":5329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 202.1202 Da; putative annotation: N/A; putative formula: C10H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.207,"smiles":null,"spectrum_id":"CCMSLIB00017216970","spectrum_index":5330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 204.2091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.311,"smiles":null,"spectrum_id":"CCMSLIB00017216971","spectrum_index":5331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 58.0461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.185,"smiles":null,"spectrum_id":"CCMSLIB00017216972","spectrum_index":5332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 156.1147 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.221,"smiles":null,"spectrum_id":"CCMSLIB00017216974","spectrum_index":5333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 200.1569 Da; putative annotation: N/A; putative formula: C15H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.228,"smiles":null,"spectrum_id":"CCMSLIB00017216976","spectrum_index":5334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 54.011 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.134,"smiles":null,"spectrum_id":"CCMSLIB00017216978","spectrum_index":5335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 906.5649 Da; putative annotation: N/A; putative formula: C42H74N12O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1402.9,"smiles":null,"spectrum_id":"CCMSLIB00017216979","spectrum_index":5336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 238.2675 Da; putative annotation: N/A; putative formula: C17H34)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.531,"smiles":null,"spectrum_id":"CCMSLIB00017216980","spectrum_index":5337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 119.0943 Da; putative annotation: N/A; putative formula: CH9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.321,"smiles":null,"spectrum_id":"CCMSLIB00017216983","spectrum_index":5338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Nitroso-8-quinolinol (delta mass: 32.0452 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.095,"smiles":null,"spectrum_id":"CCMSLIB00017216985","spectrum_index":5339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,16-Dimethylprostaglandin D2 (delta mass: 17.0271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.291,"smiles":null,"spectrum_id":"CCMSLIB00017216986","spectrum_index":5340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 70.0787 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.306,"smiles":null,"spectrum_id":"CCMSLIB00017216987","spectrum_index":5341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 28.9987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.096,"smiles":null,"spectrum_id":"CCMSLIB00017216988","spectrum_index":5342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 104.1032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.33,"smiles":null,"spectrum_id":"CCMSLIB00017216992","spectrum_index":5343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 60.0181 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.25,"smiles":null,"spectrum_id":"CCMSLIB00017216993","spectrum_index":5344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 74.05 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.287,"smiles":null,"spectrum_id":"CCMSLIB00017216994","spectrum_index":5345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 112.1249 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.185,"smiles":null,"spectrum_id":"CCMSLIB00017216995","spectrum_index":5346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 46.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.18,"smiles":null,"spectrum_id":"CCMSLIB00017216996","spectrum_index":5347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 112.0424 Da; putative annotation: N/A; putative formula: C8H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.171,"smiles":null,"spectrum_id":"CCMSLIB00017216998","spectrum_index":5348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Syringic acid (delta mass: 11.9998 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.06,"smiles":null,"spectrum_id":"CCMSLIB00017217001","spectrum_index":5349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 64.0159 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.055,"smiles":null,"spectrum_id":"CCMSLIB00017217002","spectrum_index":5350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 110.0462 Da; putative annotation: N/A; putative formula: CH2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.128,"smiles":null,"spectrum_id":"CCMSLIB00017217003","spectrum_index":5351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocorticosterone (delta mass: 72.0361 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.289,"smiles":null,"spectrum_id":"CCMSLIB00017217004","spectrum_index":5352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 122.1121 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.339,"smiles":null,"spectrum_id":"CCMSLIB00017217005","spectrum_index":5353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 242.0094 Da; putative annotation: N/A; putative formula: C8H7N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.393,"smiles":null,"spectrum_id":"CCMSLIB00017217008","spectrum_index":5354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 451.3507 Da; putative annotation: N/A; putative formula: C20H41N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.578,"smiles":null,"spectrum_id":"CCMSLIB00017217010","spectrum_index":5355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-6-methoxy-3-methyl-5-(propan-2-ylidene)furo[2,3,4-de]chromen-2(5H)-one (delta mass: 16.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.122,"smiles":null,"spectrum_id":"CCMSLIB00017217011","spectrum_index":5356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid (delta mass: 151.1202 Da; putative annotation: N/A; putative formula: C7H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.159,"smiles":null,"spectrum_id":"CCMSLIB00017217012","spectrum_index":5357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 59.0486 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.193,"smiles":null,"spectrum_id":"CCMSLIB00017217013","spectrum_index":5358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 100.0886 Da; putative annotation: N/A; putative formula: C6H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.232,"smiles":null,"spectrum_id":"CCMSLIB00017217015","spectrum_index":5359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 88.067 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017217018","spectrum_index":5360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxybenzoic acid (delta mass: 412.1986 Da; putative annotation: N/A; putative formula: C20H20N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.274,"smiles":null,"spectrum_id":"CCMSLIB00017217019","spectrum_index":5361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 415.8967 Da; putative annotation: N/A; putative formula: C18H8S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.968,"smiles":null,"spectrum_id":"CCMSLIB00017217020","spectrum_index":5362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 44.9281 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.182,"smiles":null,"spectrum_id":"CCMSLIB00017217021","spectrum_index":5363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 8.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.106,"smiles":null,"spectrum_id":"CCMSLIB00017217025","spectrum_index":5364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Heptynoic acid (delta mass: 301.297 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.372,"smiles":null,"spectrum_id":"CCMSLIB00017217026","spectrum_index":5365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 775.5737 Da; putative annotation: N/A; putative formula: C42H82NO9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1082.84,"smiles":null,"spectrum_id":"CCMSLIB00017217027","spectrum_index":5366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norhydrocodone (delta mass: 3.3562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.5,"smiles":null,"spectrum_id":"CCMSLIB00017217028","spectrum_index":5367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 347.3037 Da; putative annotation: N/A; putative formula: C20H37N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.531,"smiles":null,"spectrum_id":"CCMSLIB00017217029","spectrum_index":5368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 307.2642 Da; putative annotation: N/A; putative formula: C18H33N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.54,"smiles":null,"spectrum_id":"CCMSLIB00017217031","spectrum_index":5369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxygypsogenic acid (delta mass: 168.1311 Da; putative annotation: N/A; putative formula: C14H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.468,"smiles":null,"spectrum_id":"CCMSLIB00017217034","spectrum_index":5370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 371.2585 Da; putative annotation: N/A; putative formula: C20H38NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.543,"smiles":null,"spectrum_id":"CCMSLIB00017217035","spectrum_index":5371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 310.2139 Da; putative annotation: N/A; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.311,"smiles":null,"spectrum_id":"CCMSLIB00017217036","spectrum_index":5372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[5-(7-Hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentoxy]-4-oxobutanoic acid (delta mass: 52.0664 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.361,"smiles":null,"spectrum_id":"CCMSLIB00017217037","spectrum_index":5373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydroprostaglandin F2.alpha. (delta mass: 66.0104 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.274,"smiles":null,"spectrum_id":"CCMSLIB00017217039","spectrum_index":5374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 485.9011 Da; putative annotation: N/A; putative formula: C20H6O7S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.998,"smiles":null,"spectrum_id":"CCMSLIB00017217042","spectrum_index":5375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 48.0357 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.288,"smiles":null,"spectrum_id":"CCMSLIB00017217043","spectrum_index":5376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 279.2081 Da; putative annotation: N/A; putative formula: C19H25N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.487,"smiles":null,"spectrum_id":"CCMSLIB00017217044","spectrum_index":5377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Ala (delta mass: 113.0835 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.213,"smiles":null,"spectrum_id":"CCMSLIB00017217045","spectrum_index":5378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 67.067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.17,"smiles":null,"spectrum_id":"CCMSLIB00017217048","spectrum_index":5379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 30.0 eV (delta mass: 59.0365 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017217050","spectrum_index":5380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-(benzo[d][1,3]dioxol-5-ylmethyl)-2-hydroxy-5-oxo-4,5-dihydro-1H-imidazol-4-yl)-N-((1-methyl-1H-pyrrol-2-yl)methyl)acetamide (delta mass: 86.0132 Da; putative annotation: N/A; putative formula: CH3N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.164,"smiles":null,"spectrum_id":"CCMSLIB00017217051","spectrum_index":5381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 40.0313 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017217052","spectrum_index":5382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclovirobuxine D (delta mass: 130.0809 Da; putative annotation: N/A; putative formula: C7H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.449,"smiles":null,"spectrum_id":"CCMSLIB00017217053","spectrum_index":5383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naringenin-4'-O-.beta.-D-glucuronide (delta mass: 193.0561 Da; putative annotation: N/A; putative formula: C10H11NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.164,"smiles":null,"spectrum_id":"CCMSLIB00017217055","spectrum_index":5384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 155.1407 Da; putative annotation: N/A; putative formula: C8H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.207,"smiles":null,"spectrum_id":"CCMSLIB00017217058","spectrum_index":5385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 443.3244 Da; putative annotation: N/A; putative formula: C24H45NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.426,"smiles":null,"spectrum_id":"CCMSLIB00017217059","spectrum_index":5386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 240.1153 Da; putative annotation: N/A; putative formula: C16H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.155,"smiles":null,"spectrum_id":"CCMSLIB00017217060","spectrum_index":5387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 44.0604 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.11,"smiles":null,"spectrum_id":"CCMSLIB00017217062","spectrum_index":5388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 546.4125 Da; putative annotation: N/A; putative formula: C35H54N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.451,"smiles":null,"spectrum_id":"CCMSLIB00017217065","spectrum_index":5389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 150.0898 Da; putative annotation: N/A; putative formula: C7H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.144,"smiles":null,"spectrum_id":"CCMSLIB00017217066","spectrum_index":5390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 145.0871 Da; putative annotation: N/A; putative formula: C10H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.122,"smiles":null,"spectrum_id":"CCMSLIB00017217067","spectrum_index":5391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvaol (delta mass: 114.0793 Da; putative annotation: N/A; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.468,"smiles":null,"spectrum_id":"CCMSLIB00017217068","spectrum_index":5392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2,3-dione (delta mass: 23.0601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.09,"smiles":null,"spectrum_id":"CCMSLIB00017217069","spectrum_index":5393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 266.26 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.373,"smiles":null,"spectrum_id":"CCMSLIB00017217073","spectrum_index":5394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 134.037 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.081,"smiles":null,"spectrum_id":"CCMSLIB00017217074","spectrum_index":5395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 18.9572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.236,"smiles":null,"spectrum_id":"CCMSLIB00017217075","spectrum_index":5396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-8,11,14-Eicosatrienoic acid from NIST14 (delta mass: 54.0314 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.295,"smiles":null,"spectrum_id":"CCMSLIB00017217076","spectrum_index":5397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12-Ketodeoxycholic acid from NIST14 (delta mass: 507.2481 Da; putative annotation: N/A; putative formula: C27H33N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.532,"smiles":null,"spectrum_id":"CCMSLIB00017217077","spectrum_index":5398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 333.1247 Da; putative annotation: N/A; putative formula: C14H23NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.258,"smiles":null,"spectrum_id":"CCMSLIB00017217081","spectrum_index":5399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 42.0098 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.179,"smiles":null,"spectrum_id":"CCMSLIB00017217082","spectrum_index":5400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 117.0655 Da; putative annotation: N/A; putative formula: C2H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.152,"smiles":null,"spectrum_id":"CCMSLIB00017217083","spectrum_index":5401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 86.0576 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.337,"smiles":null,"spectrum_id":"CCMSLIB00017217084","spectrum_index":5402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-5Z,8Z,11Z,13E,17Z-eicosapentaenoic acid (delta mass: 300.2092 Da; putative annotation: 17(18)-Epoxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid; putative formula: C20H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.436,"smiles":null,"spectrum_id":"CCMSLIB00017217085","spectrum_index":5403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 120.0574 Da; putative annotation: 4-Hydroxyphenethyl alcohol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017217087","spectrum_index":5404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 278.2271 Da; putative annotation: 9(10)-Epoxy-12Z-octadecenoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.454,"smiles":null,"spectrum_id":"CCMSLIB00017217090","spectrum_index":5405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 191.059 Da; putative annotation: 2-[(2-Methoxy-2-oxoethyl)amino]benzoic acid; putative formula: C10H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.182,"smiles":null,"spectrum_id":"CCMSLIB00017217091","spectrum_index":5406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 296.234 Da; putative annotation: 12,13-Dihydroxy-9Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.45,"smiles":null,"spectrum_id":"CCMSLIB00017217092","spectrum_index":5407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 126.0581 Da; putative annotation: 3-Aminoquinoline; putative formula: C9H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.149,"smiles":null,"spectrum_id":"CCMSLIB00017217093","spectrum_index":5408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 169.1468 Da; putative annotation: 10-Aminodecanoic acid; putative formula: C10H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.332,"smiles":null,"spectrum_id":"CCMSLIB00017217094","spectrum_index":5409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 105.0594 Da; putative annotation: 2-(Aminomethyl)phenol; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.138,"smiles":null,"spectrum_id":"CCMSLIB00017217098","spectrum_index":5410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 332.2353 Da; putative annotation: 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid; putative formula: C21H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.425,"smiles":null,"spectrum_id":"CCMSLIB00017217099","spectrum_index":5411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(6-Aminohexanamido)hexanoic acid (delta mass: 113.0844 Da; putative annotation: DL-.beta.-Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.27,"smiles":null,"spectrum_id":"CCMSLIB00017217100","spectrum_index":5412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 121.052 Da; putative annotation: 3-Amino-2,3-dihydrobenzoic acid; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.17,"smiles":null,"spectrum_id":"CCMSLIB00017217101","spectrum_index":5413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 396.2523 Da; putative annotation: 2-Furanacetic acid, tetrahydro-5-(2-hydroxybutyl)-.alpha.-methyl-, 1-[[5-(1-carboxyethyl)tetrahydro-2-furanyl]methyl]propyl ester; putative formula: C22H36O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.474,"smiles":null,"spectrum_id":"CCMSLIB00017217102","spectrum_index":5414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 146.0577 Da; putative annotation: 2-DEOXY-D-GLUCOSE - 30.0 eV; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.274,"smiles":null,"spectrum_id":"CCMSLIB00017217105","spectrum_index":5415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 134.1104 Da; putative annotation: Carveol; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.28,"smiles":null,"spectrum_id":"CCMSLIB00017217107","spectrum_index":5416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 115.027 Da; putative annotation: D-Aspartic acid; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.077,"smiles":null,"spectrum_id":"CCMSLIB00017217108","spectrum_index":5417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 98.0717 Da; putative annotation: 2-Methylvaleric acid; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.163,"smiles":null,"spectrum_id":"CCMSLIB00017217109","spectrum_index":5418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Hydroxy-4Z,7Z,10Z,14E,16Z,19Z-docosahexaenoic acid (delta mass: 208.1833 Da; putative annotation: Myristoleic acid; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.426,"smiles":null,"spectrum_id":"CCMSLIB00017217111","spectrum_index":5419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-17-ol-3,20-dione (delta mass: 361.2625 Da; putative annotation: Leukotriene B4 ethanolamide; putative formula: C22H35NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.505,"smiles":null,"spectrum_id":"CCMSLIB00017217114","spectrum_index":5420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 122.1095 Da; putative annotation: trans,cis-3,6-Nonadien-1-ol; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.321,"smiles":null,"spectrum_id":"CCMSLIB00017217117","spectrum_index":5421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 300.0787 Da; putative annotation: Clencyclohexerol; putative formula: C14H18Cl2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.238,"smiles":null,"spectrum_id":"CCMSLIB00017217119","spectrum_index":5422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 161.0851 Da; putative annotation: .beta.-Phenyl-.gamma.-aminobutyric acid; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.145,"smiles":null,"spectrum_id":"CCMSLIB00017217120","spectrum_index":5423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 142.0628 Da; putative annotation: 3-Methyladipic acid; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017217122","spectrum_index":5424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 344.2387 Da; putative annotation: 6-[(2,5,5,8a-Tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol; putative formula: C22H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.481,"smiles":null,"spectrum_id":"CCMSLIB00017217123","spectrum_index":5425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 132.0789 Da; putative annotation: Triethylene glycol; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.128,"smiles":null,"spectrum_id":"CCMSLIB00017217125","spectrum_index":5426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 169.1455 Da; putative annotation: 10-Aminodecanoic acid; putative formula: C10H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.19,"smiles":null,"spectrum_id":"CCMSLIB00017217127","spectrum_index":5427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 353.293 Da; putative annotation: Massbank:RP025403 Tetradecanoyl-L-Carnitine|L-Myristoylcarnitine|(3R)-3-tetradecanoyloxy-4-(trimethylazaniumyl)butanoate; putative formula: C21H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.541,"smiles":null,"spectrum_id":"CCMSLIB00017217129","spectrum_index":5428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 294.2193 Da; putative annotation: (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid; putative formula: C18H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.446,"smiles":null,"spectrum_id":"CCMSLIB00017217130","spectrum_index":5429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenol (delta mass: 178.0625 Da; putative annotation: 2-Hydroxy-3-(4-methoxyphenyl)propanoic acid; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.154,"smiles":null,"spectrum_id":"CCMSLIB00017217132","spectrum_index":5430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-(-)-Nopol CollisionEnergy:205060 (delta mass: 296.1623 Da; putative annotation: (2R,3R,4S,5S,6R)-2-[(2E)-4-ethenyl-2,5-dimethylhexa-2,5-dienoxy]-6-(hydroxymethyl)oxane-3,4,5-triol; putative formula: C16H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.305,"smiles":null,"spectrum_id":"CCMSLIB00017217134","spectrum_index":5431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 136.1252 Da; putative annotation: 9-Decyn-1-ol; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.31,"smiles":null,"spectrum_id":"CCMSLIB00017217136","spectrum_index":5432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 323.2837 Da; putative annotation: N-Acetylsphingosine; putative formula: C20H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.563,"smiles":null,"spectrum_id":"CCMSLIB00017217137","spectrum_index":5433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anemosapogenin (delta mass: 472.3523 Da; putative annotation: NCGC00380239-01!16-hydroxy-4,4,8,10,14-pentamethyl-17-(4,5,6-trihydroxy-6-methylheptan-2-yl)-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-3-one [IIN-based: Match]; putative formula: C30H48O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.715,"smiles":null,"spectrum_id":"CCMSLIB00017217138","spectrum_index":5434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINOSALICYLIC ACID (delta mass: 114.068 Da; putative annotation: 2-ETHYL-2-HYDROXYBUTYRIC ACID; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.118,"smiles":null,"spectrum_id":"CCMSLIB00017217140","spectrum_index":5435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 325.2995 Da; putative annotation: N-Acetyldihydrosphingosine; putative formula: C20H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.573,"smiles":null,"spectrum_id":"CCMSLIB00017217142","spectrum_index":5436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 306.2191 Da; putative annotation: allo-Protolichesterinic acid; putative formula: C19H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.435,"smiles":null,"spectrum_id":"CCMSLIB00017217144","spectrum_index":5437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde - 40.0 eV (delta mass: 158.0578 Da; putative annotation: N/A; putative formula: C7H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017217145","spectrum_index":5438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 12-hydroxystearate (delta mass: 241.2395 Da; putative annotation: N/A; putative formula: C15H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.529,"smiles":null,"spectrum_id":"CCMSLIB00017217146","spectrum_index":5439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 53.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.113,"smiles":null,"spectrum_id":"CCMSLIB00017217148","spectrum_index":5440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 273.2682 Da; putative annotation: N/A; putative formula: C12H31N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.484,"smiles":null,"spectrum_id":"CCMSLIB00017217151","spectrum_index":5441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid (delta mass: 146.0327 Da; putative annotation: N/A; putative formula: C4H6N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.4,"smiles":null,"spectrum_id":"CCMSLIB00017217152","spectrum_index":5442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 59.0366 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.42,"smiles":null,"spectrum_id":"CCMSLIB00017217153","spectrum_index":5443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 73.089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.321,"smiles":null,"spectrum_id":"CCMSLIB00017217155","spectrum_index":5444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vanillin CollisionEnergy:205060 (delta mass: 72.0576 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017217156","spectrum_index":5445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 188.1395 Da; putative annotation: N/A; putative formula: C6H16N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.204,"smiles":null,"spectrum_id":"CCMSLIB00017217159","spectrum_index":5446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 132.1146 Da; putative annotation: N/A; putative formula: C3H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.157,"smiles":null,"spectrum_id":"CCMSLIB00017217160","spectrum_index":5447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 306.2404 Da; putative annotation: N/A; putative formula: C13H26N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.457,"smiles":null,"spectrum_id":"CCMSLIB00017217161","spectrum_index":5448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 316.0775 Da; putative annotation: N/A; putative formula: C10H16N6O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.226,"smiles":null,"spectrum_id":"CCMSLIB00017217163","spectrum_index":5449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 141.0631 Da; putative annotation: N/A; putative formula: H3N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.134,"smiles":null,"spectrum_id":"CCMSLIB00017217164","spectrum_index":5450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 116.0528 Da; putative annotation: N/A; putative formula: C3H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.129,"smiles":null,"spectrum_id":"CCMSLIB00017217167","spectrum_index":5451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-2-Decenoic acid (delta mass: 79.9094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.047,"smiles":null,"spectrum_id":"CCMSLIB00017217168","spectrum_index":5452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 189.1155 Da; putative annotation: N/A; putative formula: C12H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.207,"smiles":null,"spectrum_id":"CCMSLIB00017217170","spectrum_index":5453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 238.2291 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.294,"smiles":null,"spectrum_id":"CCMSLIB00017217171","spectrum_index":5454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 815.4509 Da; putative annotation: N/A; putative formula: C50H61N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":996.522,"smiles":null,"spectrum_id":"CCMSLIB00017217172","spectrum_index":5455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Norbornene-2-carboxylic acid (delta mass: 56.0381 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.113,"smiles":null,"spectrum_id":"CCMSLIB00017217175","spectrum_index":5456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 679.5388 Da; putative annotation: N/A; putative formula: C40H73NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1008.81,"smiles":null,"spectrum_id":"CCMSLIB00017217177","spectrum_index":5457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 172.0637 Da; putative annotation: N/A; putative formula: C10H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.145,"smiles":null,"spectrum_id":"CCMSLIB00017217178","spectrum_index":5458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 806.5076 Da; putative annotation: N/A; putative formula: C47H70N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1085.74,"smiles":null,"spectrum_id":"CCMSLIB00017217179","spectrum_index":5459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 125.0836 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.159,"smiles":null,"spectrum_id":"CCMSLIB00017217181","spectrum_index":5460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 287.1143 Da; putative annotation: N/A; putative formula: C10H18N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.216,"smiles":null,"spectrum_id":"CCMSLIB00017217184","spectrum_index":5461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid (delta mass: 28.0511 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.293,"smiles":null,"spectrum_id":"CCMSLIB00017217185","spectrum_index":5462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 131.004 Da; putative annotation: N/A; putative formula: C4H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.085,"smiles":null,"spectrum_id":"CCMSLIB00017217186","spectrum_index":5463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 78.9488 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.03,"smiles":null,"spectrum_id":"CCMSLIB00017217187","spectrum_index":5464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.beta.-Leucine (delta mass: 71.0378 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.14,"smiles":null,"spectrum_id":"CCMSLIB00017217188","spectrum_index":5465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 182.0851 Da; putative annotation: N/A; putative formula: C12H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.156,"smiles":null,"spectrum_id":"CCMSLIB00017217192","spectrum_index":5466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 127.0729 Da; putative annotation: N/A; putative formula: CH5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017217193","spectrum_index":5467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 43.9969 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.04,"smiles":null,"spectrum_id":"CCMSLIB00017217194","spectrum_index":5468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 504.1532 Da; putative annotation: N/A; putative formula: C27H24N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.194,"smiles":null,"spectrum_id":"CCMSLIB00017217195","spectrum_index":5469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 628.3436 Da; putative annotation: N/A; putative formula: C32H52O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":955.472,"smiles":null,"spectrum_id":"CCMSLIB00017217196","spectrum_index":5470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385982-01_C27H30N2O10_ (delta mass: 542.1866 Da; putative annotation: N/A; putative formula: C25H31N6O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1085.38,"smiles":null,"spectrum_id":"CCMSLIB00017217200","spectrum_index":5471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380550-01_C24H40O5_4-{[5-(6-Hydroxy-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl)-3-methylpentyl]oxy}-4-oxobutanoic acid (delta mass: 117.0417 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.337,"smiles":null,"spectrum_id":"CCMSLIB00017217201","spectrum_index":5472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1341.8176 Da; putative annotation: N/A; putative formula: C68H107N15O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1563.91,"smiles":null,"spectrum_id":"CCMSLIB00017217202","spectrum_index":5473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 252.1117 Da; putative annotation: N/A; putative formula: C13H20N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.203,"smiles":null,"spectrum_id":"CCMSLIB00017217203","spectrum_index":5474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,5R,9S,13R,15S)-15-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 96.9836 Da; putative annotation: N/A; putative formula: C2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.21,"smiles":null,"spectrum_id":"CCMSLIB00017217204","spectrum_index":5475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 225.0631 Da; putative annotation: N/A; putative formula: C4H12N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.218,"smiles":null,"spectrum_id":"CCMSLIB00017217207","spectrum_index":5476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 30.0 eV (delta mass: 281.1994 Da; putative annotation: N/A; putative formula: C16H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.275,"smiles":null,"spectrum_id":"CCMSLIB00017217209","spectrum_index":5477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 64.0161 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.076,"smiles":null,"spectrum_id":"CCMSLIB00017217210","spectrum_index":5478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 128.1103 Da; putative annotation: N/A; putative formula: C8H17O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.176,"smiles":null,"spectrum_id":"CCMSLIB00017217211","spectrum_index":5479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 37.9424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.085,"smiles":null,"spectrum_id":"CCMSLIB00017217212","spectrum_index":5480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levallorphan (delta mass: 162.0519 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.253,"smiles":null,"spectrum_id":"CCMSLIB00017217216","spectrum_index":5481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Glu (delta mass: 101.0485 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.177,"smiles":null,"spectrum_id":"CCMSLIB00017217217","spectrum_index":5482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 148.0633 Da; putative annotation: N/A; putative formula: C8H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.128,"smiles":null,"spectrum_id":"CCMSLIB00017217218","spectrum_index":5483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.097,"smiles":null,"spectrum_id":"CCMSLIB00017217219","spectrum_index":5484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one (delta mass: 18.0097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.226,"smiles":null,"spectrum_id":"CCMSLIB00017217220","spectrum_index":5485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 246.236 Da; putative annotation: N/A; putative formula: C18H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.333,"smiles":null,"spectrum_id":"CCMSLIB00017217224","spectrum_index":5486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholic Acid, Methyl Ester (delta mass: 154.1151 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.426,"smiles":null,"spectrum_id":"CCMSLIB00017217225","spectrum_index":5487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 146.0729 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017217226","spectrum_index":5488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 118.0784 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.306,"smiles":null,"spectrum_id":"CCMSLIB00017217227","spectrum_index":5489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 87.0684 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.207,"smiles":null,"spectrum_id":"CCMSLIB00017217228","spectrum_index":5490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 138.0992 Da; putative annotation: N/A; putative formula: C5H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.17,"smiles":null,"spectrum_id":"CCMSLIB00017217232","spectrum_index":5491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa - 30.0 eV (delta mass: 46.0161 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.092,"smiles":null,"spectrum_id":"CCMSLIB00017217233","spectrum_index":5492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 512.1142 Da; putative annotation: N/A; putative formula: C15H29O17P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.185,"smiles":null,"spectrum_id":"CCMSLIB00017217234","spectrum_index":5493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 212.1528 Da; putative annotation: N/A; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.254,"smiles":null,"spectrum_id":"CCMSLIB00017217235","spectrum_index":5494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 80.0622 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.305,"smiles":null,"spectrum_id":"CCMSLIB00017217236","spectrum_index":5495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 23.0244 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.074,"smiles":null,"spectrum_id":"CCMSLIB00017217240","spectrum_index":5496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cresotinic acid (delta mass: 37.9771 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.032,"smiles":null,"spectrum_id":"CCMSLIB00017217241","spectrum_index":5497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 91.0618 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.262,"smiles":null,"spectrum_id":"CCMSLIB00017217242","spectrum_index":5498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinic Acid (delta mass: 171.0318 Da; putative annotation: N/A; putative formula: C10H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.103,"smiles":null,"spectrum_id":"CCMSLIB00017217243","spectrum_index":5499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 13.9794 Da; putative annotation: N/A; putative formula: H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017217244","spectrum_index":5500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 142.1219 Da; putative annotation: N/A; putative formula: C6H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.38,"smiles":null,"spectrum_id":"CCMSLIB00017217248","spectrum_index":5501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 270.0377 Da; putative annotation: N/A; putative formula: C11H10O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.134,"smiles":null,"spectrum_id":"CCMSLIB00017217249","spectrum_index":5502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 549.2276 Da; putative annotation: N/A; putative formula: C34H27N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.267,"smiles":null,"spectrum_id":"CCMSLIB00017217250","spectrum_index":5503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 103.0269 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.186,"smiles":null,"spectrum_id":"CCMSLIB00017217251","spectrum_index":5504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 46.0095 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.195,"smiles":null,"spectrum_id":"CCMSLIB00017217252","spectrum_index":5505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.394,"smiles":null,"spectrum_id":"CCMSLIB00017217255","spectrum_index":5506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 41.0253 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.273,"smiles":null,"spectrum_id":"CCMSLIB00017217257","spectrum_index":5507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 104.0263 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.076,"smiles":null,"spectrum_id":"CCMSLIB00017217258","spectrum_index":5508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 92.0095 Da; putative annotation: N/A; putative formula: C6H4O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.101,"smiles":null,"spectrum_id":"CCMSLIB00017217259","spectrum_index":5509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-6-Octadecenoic acid (delta mass: 42.0472 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.31,"smiles":null,"spectrum_id":"CCMSLIB00017217260","spectrum_index":5510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Loggerpeptin A (delta mass: 139.0632 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1132.59,"smiles":null,"spectrum_id":"CCMSLIB00017217264","spectrum_index":5511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 255.2191 Da; putative annotation: N/A; putative formula: C15H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.409,"smiles":null,"spectrum_id":"CCMSLIB00017217265","spectrum_index":5512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 437.1543 Da; putative annotation: N/A; putative formula: C18H31NO7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.246,"smiles":null,"spectrum_id":"CCMSLIB00017217266","spectrum_index":5513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 392.2331 Da; putative annotation: N/A; putative formula: C15H28N12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.325,"smiles":null,"spectrum_id":"CCMSLIB00017217267","spectrum_index":5514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 621.2052 Da; putative annotation: N/A; putative formula: C42H27N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":827.286,"smiles":null,"spectrum_id":"CCMSLIB00017217268","spectrum_index":5515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 41.1365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.296,"smiles":null,"spectrum_id":"CCMSLIB00017217271","spectrum_index":5516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desoxypipradrol (delta mass: 144.0995 Da; putative annotation: N/A; putative formula: CH8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.274,"smiles":null,"spectrum_id":"CCMSLIB00017217273","spectrum_index":5517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 70.0627 Da; putative annotation: N/A; putative formula: C2H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.274,"smiles":null,"spectrum_id":"CCMSLIB00017217274","spectrum_index":5518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Amyrin (delta mass: 138.0612 Da; putative annotation: N/A; putative formula: C7H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.455,"smiles":null,"spectrum_id":"CCMSLIB00017217275","spectrum_index":5519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 46.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.118,"smiles":null,"spectrum_id":"CCMSLIB00017217276","spectrum_index":5520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 151.0094 Da; putative annotation: N/A; putative formula: C7H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.069,"smiles":null,"spectrum_id":"CCMSLIB00017217280","spectrum_index":5521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 149.1418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.322,"smiles":null,"spectrum_id":"CCMSLIB00017217281","spectrum_index":5522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 421.2115 Da; putative annotation: N/A; putative formula: C23H27N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":794.376,"smiles":null,"spectrum_id":"CCMSLIB00017217282","spectrum_index":5523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 142.1175 Da; putative annotation: N/A; putative formula: C9H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.371,"smiles":null,"spectrum_id":"CCMSLIB00017217283","spectrum_index":5524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 688.204 Da; putative annotation: N/A; putative formula: C44H36N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":851.264,"smiles":null,"spectrum_id":"CCMSLIB00017217284","spectrum_index":5525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 234.074 Da; putative annotation: N/A; putative formula: C9H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.171,"smiles":null,"spectrum_id":"CCMSLIB00017217288","spectrum_index":5526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,6-Trimethyl-1-(4-methylphenyl)-1,4-dihydro-2-pyrimidinethiol (delta mass: 143.0515 Da; putative annotation: N/A; putative formula: C5H9N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.178,"smiles":null,"spectrum_id":"CCMSLIB00017217289","spectrum_index":5527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 66.0836 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.274,"smiles":null,"spectrum_id":"CCMSLIB00017217290","spectrum_index":5528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyluridine (delta mass: 200.0763 Da; putative annotation: N/A; putative formula: C4H8N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.169,"smiles":null,"spectrum_id":"CCMSLIB00017217291","spectrum_index":5529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Naltrexone (delta mass: 225.1054 Da; putative annotation: N/A; putative formula: C9H15N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.275,"smiles":null,"spectrum_id":"CCMSLIB00017217292","spectrum_index":5530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 144.0598 Da; putative annotation: N/A; putative formula: C7H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.141,"smiles":null,"spectrum_id":"CCMSLIB00017217295","spectrum_index":5531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 359.143 Da; putative annotation: N/A; putative formula: C17H23N5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.266,"smiles":null,"spectrum_id":"CCMSLIB00017217297","spectrum_index":5532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 300.1052 Da; putative annotation: N/A; putative formula: C8H16N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.342,"smiles":null,"spectrum_id":"CCMSLIB00017217298","spectrum_index":5533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indirubin (delta mass: 240.0556 Da; putative annotation: N/A; putative formula: C12H17O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.137,"smiles":null,"spectrum_id":"CCMSLIB00017217299","spectrum_index":5534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corydine (delta mass: 357.1606 Da; putative annotation: N/A; putative formula: C19H24N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.331,"smiles":null,"spectrum_id":"CCMSLIB00017217300","spectrum_index":5535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxy-4,5-dimethylphenyl)ethanone (delta mass: 182.096 Da; putative annotation: N/A; putative formula: C11H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.187,"smiles":null,"spectrum_id":"CCMSLIB00017217301","spectrum_index":5536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381058-01![3-hydroxy-1-[3-hydroxy-1-oxo-1-(2,3,4,5,6-pentahydroxyhexoxy)decan-5-yl]oxy-1-oxodecan-5-yl] 3,5-dihydroxydecanoate (delta mass: 186.1172 Da; putative annotation: N/A; putative formula: C10H19OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":927.58,"smiles":null,"spectrum_id":"CCMSLIB00017217305","spectrum_index":5537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 236.0997 Da; putative annotation: N/A; putative formula: C12H18N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.212,"smiles":null,"spectrum_id":"CCMSLIB00017217306","spectrum_index":5538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 96.0216 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.108,"smiles":null,"spectrum_id":"CCMSLIB00017217307","spectrum_index":5539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 128.0193 Da; putative annotation: N/A; putative formula: N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.158,"smiles":null,"spectrum_id":"CCMSLIB00017217308","spectrum_index":5540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxybenzoate (delta mass: 56.0048 Da; putative annotation: N/A; putative formula: C6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.075,"smiles":null,"spectrum_id":"CCMSLIB00017217309","spectrum_index":5541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 280.2925 Da; putative annotation: N/A; putative formula: C18H36N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.54,"smiles":null,"spectrum_id":"CCMSLIB00017217313","spectrum_index":5542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L_DOPA (delta mass: 45.009 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.085,"smiles":null,"spectrum_id":"CCMSLIB00017217314","spectrum_index":5543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 454.3656 Da; putative annotation: N/A; putative formula: C27H50O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.473,"smiles":null,"spectrum_id":"CCMSLIB00017217315","spectrum_index":5544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dereplicator+ Identification - Nonoxynol-9 (delta mass: 96.9818 Da; putative annotation: N/A; putative formula: C2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.408,"smiles":null,"spectrum_id":"CCMSLIB00017217316","spectrum_index":5545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 556.3063 Da; putative annotation: N/A; putative formula: C34H36N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.366,"smiles":null,"spectrum_id":"CCMSLIB00017217318","spectrum_index":5546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 425.1894 Da; putative annotation: N/A; putative formula: C30H23N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.27,"smiles":null,"spectrum_id":"CCMSLIB00017217320","spectrum_index":5547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 61.0492 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.09,"smiles":null,"spectrum_id":"CCMSLIB00017217321","spectrum_index":5548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-7-carboxylic acid (delta mass: 50.0601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.123,"smiles":null,"spectrum_id":"CCMSLIB00017217322","spectrum_index":5549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucovanillin (delta mass: 123.0323 Da; putative annotation: N/A; putative formula: C6H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.14,"smiles":null,"spectrum_id":"CCMSLIB00017217323","spectrum_index":5550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethoxy-2(1H)-quinolinone (delta mass: 130.0995 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.181,"smiles":null,"spectrum_id":"CCMSLIB00017217325","spectrum_index":5551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 330.116 Da; putative annotation: N/A; putative formula: C16H28O-1P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.369,"smiles":null,"spectrum_id":"CCMSLIB00017217328","spectrum_index":5552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 189.1066 Da; putative annotation: N/A; putative formula: C12H16NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.183,"smiles":null,"spectrum_id":"CCMSLIB00017217329","spectrum_index":5553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 34.9695 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.093,"smiles":null,"spectrum_id":"CCMSLIB00017217330","spectrum_index":5554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 15.9436 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.03,"smiles":null,"spectrum_id":"CCMSLIB00017217332","spectrum_index":5555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 27.0151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.065,"smiles":null,"spectrum_id":"CCMSLIB00017217334","spectrum_index":5556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 27.0108 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.097,"smiles":null,"spectrum_id":"CCMSLIB00017217336","spectrum_index":5557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 69.9453 Da; putative annotation: N/A; putative formula: C2H-1O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.004,"smiles":null,"spectrum_id":"CCMSLIB00017217337","spectrum_index":5558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetyl-5-(tetrahydroxybutyl)imidazole (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.124,"smiles":null,"spectrum_id":"CCMSLIB00017217339","spectrum_index":5559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 266.2738 Da; putative annotation: N/A; putative formula: C17H34N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.36,"smiles":null,"spectrum_id":"CCMSLIB00017217341","spectrum_index":5560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 313.1244 Da; putative annotation: N/A; putative formula: C17H19N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.165,"smiles":null,"spectrum_id":"CCMSLIB00017217342","spectrum_index":5561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 351.3984 Da; putative annotation: N/A; putative formula: C23H49N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.48,"smiles":null,"spectrum_id":"CCMSLIB00017217343","spectrum_index":5562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311057 Glutamyltyrosine (delta mass: 436.1483 Da; putative annotation: N/A; putative formula: C20H24N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.272,"smiles":null,"spectrum_id":"CCMSLIB00017217346","spectrum_index":5563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLADENINE - 70.0 eV (delta mass: 69.0355 Da; putative annotation: N/A; putative formula: C2H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017217348","spectrum_index":5564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 202.0463 Da; putative annotation: N/A; putative formula: C5H2N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.111,"smiles":null,"spectrum_id":"CCMSLIB00017217349","spectrum_index":5565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 194.1246 Da; putative annotation: N/A; putative formula: C11H18N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.172,"smiles":null,"spectrum_id":"CCMSLIB00017217350","spectrum_index":5566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 95.0586 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.139,"smiles":null,"spectrum_id":"CCMSLIB00017217351","spectrum_index":5567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310824 N-Fructosyl isoleucine (delta mass: 274.1514 Da; putative annotation: N/A; putative formula: C9H14N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.306,"smiles":null,"spectrum_id":"CCMSLIB00017217353","spectrum_index":5568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine; LC-tDDA; CE10 (delta mass: 333.9163 Da; putative annotation: N/A; putative formula: C12H2N2O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.013,"smiles":null,"spectrum_id":"CCMSLIB00017217356","spectrum_index":5569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 684.2034 Da; putative annotation: N/A; putative formula: C31H36N6O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.285,"smiles":null,"spectrum_id":"CCMSLIB00017217357","spectrum_index":5570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 685.2088 Da; putative annotation: N/A; putative formula: C28H39N5O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":891.29,"smiles":null,"spectrum_id":"CCMSLIB00017217358","spectrum_index":5571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomopsidin (delta mass: 104.0999 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.327,"smiles":null,"spectrum_id":"CCMSLIB00017217359","spectrum_index":5572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 101.0727 Da; putative annotation: N/A; putative formula: C2H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017217360","spectrum_index":5573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 56.0266 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.128,"smiles":null,"spectrum_id":"CCMSLIB00017217364","spectrum_index":5574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 434.285 Da; putative annotation: N/A; putative formula: C28H39N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":775.44,"smiles":null,"spectrum_id":"CCMSLIB00017217365","spectrum_index":5575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 209.1305 Da; putative annotation: N/A; putative formula: C14H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.227,"smiles":null,"spectrum_id":"CCMSLIB00017217366","spectrum_index":5576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Glu Phe from METLIN (delta mass: 288.1325 Da; putative annotation: N/A; putative formula: C12H20N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.261,"smiles":null,"spectrum_id":"CCMSLIB00017217367","spectrum_index":5577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 41.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.16,"smiles":null,"spectrum_id":"CCMSLIB00017217368","spectrum_index":5578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 282.2556 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.467,"smiles":null,"spectrum_id":"CCMSLIB00017217372","spectrum_index":5579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.216,"smiles":null,"spectrum_id":"CCMSLIB00017217373","spectrum_index":5580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 74.037 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.144,"smiles":null,"spectrum_id":"CCMSLIB00017217374","spectrum_index":5581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 715.5218 Da; putative annotation: N/A; putative formula: C36H73N7O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":992.738,"smiles":null,"spectrum_id":"CCMSLIB00017217375","spectrum_index":5582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 255.1476 Da; putative annotation: N/A; putative formula: C14H25NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.25,"smiles":null,"spectrum_id":"CCMSLIB00017217378","spectrum_index":5583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pentenedioic acid, 2-octyl- (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017217379","spectrum_index":5584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lupeol (delta mass: 58.0549 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.448,"smiles":null,"spectrum_id":"CCMSLIB00017217380","spectrum_index":5585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 192.0175 Da; putative annotation: N/A; putative formula: CH4N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.071,"smiles":null,"spectrum_id":"CCMSLIB00017217381","spectrum_index":5586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one (delta mass: 279.2183 Da; putative annotation: N/A; putative formula: C13H25N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.352,"smiles":null,"spectrum_id":"CCMSLIB00017217383","spectrum_index":5587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 159.0926 Da; putative annotation: N/A; putative formula: C6H14N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.163,"smiles":null,"spectrum_id":"CCMSLIB00017217386","spectrum_index":5588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Diamino-2-methoxyanthraquinone (delta mass: 33.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.128,"smiles":null,"spectrum_id":"CCMSLIB00017217387","spectrum_index":5589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Streptomycin A (delta mass: 115.9773 Da; putative annotation: N/A; putative formula: C2HN2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.25,"smiles":null,"spectrum_id":"CCMSLIB00017217388","spectrum_index":5590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 15.0245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.117,"smiles":null,"spectrum_id":"CCMSLIB00017217390","spectrum_index":5591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 36.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.274,"smiles":null,"spectrum_id":"CCMSLIB00017217391","spectrum_index":5592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Taxifolin (delta mass: 162.0517 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.117,"smiles":null,"spectrum_id":"CCMSLIB00017217394","spectrum_index":5593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 99.9831 Da; putative annotation: N/A; putative formula: C2HN2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.148,"smiles":null,"spectrum_id":"CCMSLIB00017217395","spectrum_index":5594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11(12)-Epoxy-5Z,8Z,14Z-eicosatrienoic acid (delta mass: 239.1003 Da; putative annotation: N/A; putative formula: C8H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.343,"smiles":null,"spectrum_id":"CCMSLIB00017217397","spectrum_index":5595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 27.9928 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.11,"smiles":null,"spectrum_id":"CCMSLIB00017217398","spectrum_index":5596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(N-Methylacetamido)benzoic acid (delta mass: 28.0317 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017217399","spectrum_index":5597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 38.0265 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.129,"smiles":null,"spectrum_id":"CCMSLIB00017217402","spectrum_index":5598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100188 Piperacillin|Pentcillin|Pipracil|Pipril (delta mass: 549.1882 Da; putative annotation: N/A; putative formula: C44H23NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1067.36,"smiles":null,"spectrum_id":"CCMSLIB00017217404","spectrum_index":5599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[1-(5-hydroxy-2,6,6-trimethyltetrahydro-2H-pyran-2-yl)ethyl]-2(1H)-quinolinone (delta mass: 17.0733 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.259,"smiles":null,"spectrum_id":"CCMSLIB00017217405","spectrum_index":5600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 85.0891 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017217406","spectrum_index":5601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 282.1497 Da; putative annotation: N/A; putative formula: C14H23N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.283,"smiles":null,"spectrum_id":"CCMSLIB00017217408","spectrum_index":5602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 300.2655 Da; putative annotation: N/A; putative formula: C18H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.513,"smiles":null,"spectrum_id":"CCMSLIB00017217410","spectrum_index":5603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 264.2442 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.497,"smiles":null,"spectrum_id":"CCMSLIB00017217412","spectrum_index":5604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 77.0456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.1,"smiles":null,"spectrum_id":"CCMSLIB00017217413","spectrum_index":5605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 133.089 Da; putative annotation: N/A; putative formula: C9H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.207,"smiles":null,"spectrum_id":"CCMSLIB00017217415","spectrum_index":5606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 132.0414 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.159,"smiles":null,"spectrum_id":"CCMSLIB00017217417","spectrum_index":5607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 67.0058 Da; putative annotation: N/A; putative formula: C3HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.108,"smiles":null,"spectrum_id":"CCMSLIB00017217419","spectrum_index":5608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 361.2486 Da; putative annotation: N/A; putative formula: C17H36N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.47,"smiles":null,"spectrum_id":"CCMSLIB00017217420","spectrum_index":5609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 142.1005 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.165,"smiles":null,"spectrum_id":"CCMSLIB00017217422","spectrum_index":5610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 216.0822 Da; putative annotation: N/A; putative formula: C10H16O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.163,"smiles":null,"spectrum_id":"CCMSLIB00017217424","spectrum_index":5611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 43.1036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.19,"smiles":null,"spectrum_id":"CCMSLIB00017217426","spectrum_index":5612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 144.0512 Da; putative annotation: N/A; putative formula: CH4N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.169,"smiles":null,"spectrum_id":"CCMSLIB00017217427","spectrum_index":5613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,3-DIAMINOPROPANE\"\" (delta mass: 109.0386 Da; putative annotation: N/A; putative formula: C3H3N5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.13,"smiles":null,"spectrum_id":"CCMSLIB00017217429","spectrum_index":5614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 88.0159 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.185,"smiles":null,"spectrum_id":"CCMSLIB00017217431","spectrum_index":5615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 640.3648 Da; putative annotation: N/A; putative formula: C34H56O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.425,"smiles":null,"spectrum_id":"CCMSLIB00017217432","spectrum_index":5616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1(4H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-4,6-dihydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl- (delta mass: 35.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.212,"smiles":null,"spectrum_id":"CCMSLIB00017217433","spectrum_index":5617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Leu (delta mass: 200.117 Da; putative annotation: N/A; putative formula: C10H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.298,"smiles":null,"spectrum_id":"CCMSLIB00017217435","spectrum_index":5618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 165.115 Da; putative annotation: N/A; putative formula: C10H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.238,"smiles":null,"spectrum_id":"CCMSLIB00017217436","spectrum_index":5619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 168.0892 Da; putative annotation: N/A; putative formula: C8H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.149,"smiles":null,"spectrum_id":"CCMSLIB00017217439","spectrum_index":5620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017217440","spectrum_index":5621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 154.0698 Da; putative annotation: N/A; putative formula: C3H6N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.129,"smiles":null,"spectrum_id":"CCMSLIB00017217442","spectrum_index":5622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-15-Tetracosenoic acid (delta mass: 177.0658 Da; putative annotation: N/A; putative formula: C7H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.423,"smiles":null,"spectrum_id":"CCMSLIB00017217443","spectrum_index":5623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyanomethyl)-1H-indole-2-carboxylic acid (delta mass: 146.0692 Da; putative annotation: N/A; putative formula: C5H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.135,"smiles":null,"spectrum_id":"CCMSLIB00017217445","spectrum_index":5624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 46.9869 Da; putative annotation: N/A; putative formula: HNS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.052,"smiles":null,"spectrum_id":"CCMSLIB00017217447","spectrum_index":5625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 17.0307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017217448","spectrum_index":5626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Epoxy-5Z,8Z,11Z-eicosatrienoic acid (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017217450","spectrum_index":5627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 52.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.264,"smiles":null,"spectrum_id":"CCMSLIB00017217451","spectrum_index":5628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 17.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.118,"smiles":null,"spectrum_id":"CCMSLIB00017217454","spectrum_index":5629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 143.1158 Da; putative annotation: N/A; putative formula: C5H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.207,"smiles":null,"spectrum_id":"CCMSLIB00017217455","spectrum_index":5630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 228.143 Da; putative annotation: N/A; putative formula: C16H21O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.191,"smiles":null,"spectrum_id":"CCMSLIB00017217457","spectrum_index":5631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 13.0177 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.093,"smiles":null,"spectrum_id":"CCMSLIB00017217458","spectrum_index":5632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-(3-methyl-2-butenyl)benzaldehyde (delta mass: 285.1946 Da; putative annotation: N/A; putative formula: C16H31NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.301,"smiles":null,"spectrum_id":"CCMSLIB00017217460","spectrum_index":5633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304055 p-Coumaraldehyde (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017217462","spectrum_index":5634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 321.8666 Da; putative annotation: N/A; putative formula: C12H2OS5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.958,"smiles":null,"spectrum_id":"CCMSLIB00017217464","spectrum_index":5635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to p-Acetaminobenzoic acid from NIST14 (delta mass: 58.0053 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.071,"smiles":null,"spectrum_id":"CCMSLIB00017217465","spectrum_index":5636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 281.1846 Da; putative annotation: N/A; putative formula: C13H23N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.318,"smiles":null,"spectrum_id":"CCMSLIB00017217467","spectrum_index":5637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 109.1101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.332,"smiles":null,"spectrum_id":"CCMSLIB00017217469","spectrum_index":5638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 361.2473 Da; putative annotation: N/A; putative formula: C19H39NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.458,"smiles":null,"spectrum_id":"CCMSLIB00017217471","spectrum_index":5639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 33.9874 Da; putative annotation: N/A; putative formula: C3H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.121,"smiles":null,"spectrum_id":"CCMSLIB00017217472","spectrum_index":5640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 141.1519 Da; putative annotation: N/A; putative formula: C9H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.248,"smiles":null,"spectrum_id":"CCMSLIB00017217474","spectrum_index":5641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 341.2952 Da; putative annotation: N/A; putative formula: C21H35N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.543,"smiles":null,"spectrum_id":"CCMSLIB00017217476","spectrum_index":5642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lotusine (delta mass: 16.0287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.204,"smiles":null,"spectrum_id":"CCMSLIB00017217478","spectrum_index":5643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 309.296 Da; putative annotation: N/A; putative formula: C20H40NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.544,"smiles":null,"spectrum_id":"CCMSLIB00017217480","spectrum_index":5644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxyheptadec-16-ynyl acetate (delta mass: 427.2897 Da; putative annotation: N/A; putative formula: C21H42N5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.543,"smiles":null,"spectrum_id":"CCMSLIB00017217481","spectrum_index":5645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoleoyl-sn-glycero-3-phosphoethanolamine (delta mass: 54.0463 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":742.537,"smiles":null,"spectrum_id":"CCMSLIB00017217483","spectrum_index":5646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 104.0987 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017217486","spectrum_index":5647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4,6-dimethylpyrimidine (delta mass: 76.0491 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.12,"smiles":null,"spectrum_id":"CCMSLIB00017217487","spectrum_index":5648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 184.0858 Da; putative annotation: N/A; putative formula: C9H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.255,"smiles":null,"spectrum_id":"CCMSLIB00017217488","spectrum_index":5649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 31.0427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.155,"smiles":null,"spectrum_id":"CCMSLIB00017217490","spectrum_index":5650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 45.9454 Da; putative annotation: N/A; putative formula: C14H19N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.063,"smiles":null,"spectrum_id":"CCMSLIB00017217492","spectrum_index":5651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 26.8124 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.93,"smiles":null,"spectrum_id":"CCMSLIB00017217494","spectrum_index":5652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 336.3476 Da; putative annotation: N/A; putative formula: C22H44N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.408,"smiles":null,"spectrum_id":"CCMSLIB00017217495","spectrum_index":5653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Khelloside (delta mass: 347.1578 Da; putative annotation: N/A; putative formula: C15H25NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.271,"smiles":null,"spectrum_id":"CCMSLIB00017217496","spectrum_index":5654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 30.024 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.095,"smiles":null,"spectrum_id":"CCMSLIB00017217498","spectrum_index":5655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C20:5 (delta mass: 103.0172 Da; putative annotation: N/A; putative formula: C5HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.271,"smiles":null,"spectrum_id":"CCMSLIB00017217501","spectrum_index":5656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 114.0927 Da; putative annotation: N/A; putative formula: C4H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017217502","spectrum_index":5657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Fexofenadine (delta mass: 515.3054 Da; putative annotation: N/A; putative formula: C34H37N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1031.62,"smiles":null,"spectrum_id":"CCMSLIB00017217503","spectrum_index":5658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8(9)-Epoxy-5Z,11Z,14Z-eicosatrienoic acid (delta mass: 14.0149 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.257,"smiles":null,"spectrum_id":"CCMSLIB00017217504","spectrum_index":5659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 68.0623 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.326,"smiles":null,"spectrum_id":"CCMSLIB00017217505","spectrum_index":5660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 82.0421 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.389,"smiles":null,"spectrum_id":"CCMSLIB00017217509","spectrum_index":5661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 107.0582 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.134,"smiles":null,"spectrum_id":"CCMSLIB00017217510","spectrum_index":5662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methanone, [1-(2-hydroxypentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)- (delta mass: 64.0157 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.243,"smiles":null,"spectrum_id":"CCMSLIB00017217511","spectrum_index":5663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 56.0264 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017217512","spectrum_index":5664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 12.0 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.086,"smiles":null,"spectrum_id":"CCMSLIB00017217513","spectrum_index":5665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 22.0301 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.08,"smiles":null,"spectrum_id":"CCMSLIB00017217517","spectrum_index":5666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 196.1316 Da; putative annotation: N/A; putative formula: C9H16N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.218,"smiles":null,"spectrum_id":"CCMSLIB00017217518","spectrum_index":5667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Erucamide (delta mass: 46.8413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.183,"smiles":null,"spectrum_id":"CCMSLIB00017217519","spectrum_index":5668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE (delta mass: 126.1047 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.192,"smiles":null,"spectrum_id":"CCMSLIB00017217520","spectrum_index":5669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,4-Diazepan-1-yl)-4-methyl-1,3-thiazole (delta mass: 70.0747 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.181,"smiles":null,"spectrum_id":"CCMSLIB00017217521","spectrum_index":5670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxy-4Z,7Z,10Z,13Z,17E,19Z-docosahexaenoic acid (delta mass: 35.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.279,"smiles":null,"spectrum_id":"CCMSLIB00017217524","spectrum_index":5671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 126.068 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.186,"smiles":null,"spectrum_id":"CCMSLIB00017217526","spectrum_index":5672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthylamine (delta mass: 17.9592 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.04,"smiles":null,"spectrum_id":"CCMSLIB00017217527","spectrum_index":5673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 52.0427 Da; putative annotation: N/A; putative formula: C3H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.131,"smiles":null,"spectrum_id":"CCMSLIB00017217528","spectrum_index":5674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Coumaryl alcohol (delta mass: 103.0243 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.1,"smiles":null,"spectrum_id":"CCMSLIB00017217529","spectrum_index":5675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 356.125 Da; putative annotation: N/A; putative formula: C14H21N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.254,"smiles":null,"spectrum_id":"CCMSLIB00017217532","spectrum_index":5676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid (delta mass: 196.1613 Da; putative annotation: N/A; putative formula: C16H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.514,"smiles":null,"spectrum_id":"CCMSLIB00017217534","spectrum_index":5677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 347.304 Da; putative annotation: N/A; putative formula: C20H37N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.385,"smiles":null,"spectrum_id":"CCMSLIB00017217535","spectrum_index":5678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.218,"smiles":null,"spectrum_id":"CCMSLIB00017217536","spectrum_index":5679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 131.1041 Da; putative annotation: N/A; putative formula: CH9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.17,"smiles":null,"spectrum_id":"CCMSLIB00017217538","spectrum_index":5680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 50.0517 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.331,"smiles":null,"spectrum_id":"CCMSLIB00017217541","spectrum_index":5681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zilpaterol (delta mass: 25.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.197,"smiles":null,"spectrum_id":"CCMSLIB00017217542","spectrum_index":5682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 1031.3563 Da; putative annotation: N/A; putative formula: C53H49N11O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1536.53,"smiles":null,"spectrum_id":"CCMSLIB00017217543","spectrum_index":5683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid (delta mass: 68.0625 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.102,"smiles":null,"spectrum_id":"CCMSLIB00017217544","spectrum_index":5684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.207,"smiles":null,"spectrum_id":"CCMSLIB00017217545","spectrum_index":5685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Cycloisolongifol-5-ol (delta mass: 43.0425 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.233,"smiles":null,"spectrum_id":"CCMSLIB00017217549","spectrum_index":5686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 396.2296 Da; putative annotation: N/A; putative formula: C17H36N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.342,"smiles":null,"spectrum_id":"CCMSLIB00017217550","spectrum_index":5687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 16.0021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.083,"smiles":null,"spectrum_id":"CCMSLIB00017217551","spectrum_index":5688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 18.0071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.312,"smiles":null,"spectrum_id":"CCMSLIB00017217552","spectrum_index":5689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 187.9953 Da; putative annotation: N/A; putative formula: C6H4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.074,"smiles":null,"spectrum_id":"CCMSLIB00017217553","spectrum_index":5690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 130.0264 Da; putative annotation: N/A; putative formula: C5H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.076,"smiles":null,"spectrum_id":"CCMSLIB00017217555","spectrum_index":5691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 58.063 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017217558","spectrum_index":5692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 163.0701 Da; putative annotation: N/A; putative formula: C5H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.167,"smiles":null,"spectrum_id":"CCMSLIB00017217559","spectrum_index":5693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 399.2128 Da; putative annotation: N/A; putative formula: C18H33N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.33,"smiles":null,"spectrum_id":"CCMSLIB00017217560","spectrum_index":5694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 42.9726 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.043,"smiles":null,"spectrum_id":"CCMSLIB00017217561","spectrum_index":5695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Pyrazolo[3,4-b]pyridine (delta mass: 26.9881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.044,"smiles":null,"spectrum_id":"CCMSLIB00017217564","spectrum_index":5696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Thiophen-2-yl)piperazin-2-one (delta mass: 34.0204 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.079,"smiles":null,"spectrum_id":"CCMSLIB00017217566","spectrum_index":5697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(1-Phenylethyl)hydrazine (delta mass: 72.046 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.153,"smiles":null,"spectrum_id":"CCMSLIB00017217567","spectrum_index":5698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 267.2982 Da; putative annotation: N/A; putative formula: C18H37N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.396,"smiles":null,"spectrum_id":"CCMSLIB00017217568","spectrum_index":5699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 116.0576 Da; putative annotation: N/A; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.139,"smiles":null,"spectrum_id":"CCMSLIB00017217570","spectrum_index":5700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 359.1411 Da; putative annotation: N/A; putative formula: C17H29NOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1332.47,"smiles":null,"spectrum_id":"CCMSLIB00017217572","spectrum_index":5701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-DL-methionine CollisionEnergy:205060 (delta mass: 73.0164 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.085,"smiles":null,"spectrum_id":"CCMSLIB00017217573","spectrum_index":5702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 187.0634 Da; putative annotation: N/A; putative formula: C11H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.255,"smiles":null,"spectrum_id":"CCMSLIB00017217574","spectrum_index":5703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 393.2906 Da; putative annotation: N/A; putative formula: C16H41N7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.58,"smiles":null,"spectrum_id":"CCMSLIB00017217575","spectrum_index":5704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labdanolic acid (delta mass: 76.0683 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.342,"smiles":null,"spectrum_id":"CCMSLIB00017217578","spectrum_index":5705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 328.1376 Da; putative annotation: N/A; putative formula: C15H25N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.208,"smiles":null,"spectrum_id":"CCMSLIB00017217580","spectrum_index":5706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 50.0 eV (delta mass: 228.0517 Da; putative annotation: N/A; putative formula: C5H13N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.139,"smiles":null,"spectrum_id":"CCMSLIB00017217581","spectrum_index":5707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,3aS,6aR)-Hexahydrofuro[2,3-b]furan-3-ol (delta mass: 371.4122 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.483,"smiles":null,"spectrum_id":"CCMSLIB00017217582","spectrum_index":5708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxypimara-8(14),15-dien-18-oic acid (delta mass: 76.0675 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.294,"smiles":null,"spectrum_id":"CCMSLIB00017217583","spectrum_index":5709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(6-Aminohexanamido)hexanoic acid (delta mass: 140.1222 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.308,"smiles":null,"spectrum_id":"CCMSLIB00017217585","spectrum_index":5710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 124.0628 Da; putative annotation: N/A; putative formula: C6H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.149,"smiles":null,"spectrum_id":"CCMSLIB00017217588","spectrum_index":5711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brassicasterol (delta mass: 377.1488 Da; putative annotation: N/A; putative formula: C20H19N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.511,"smiles":null,"spectrum_id":"CCMSLIB00017217589","spectrum_index":5712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bis(2-hydroxyethyl) phthalate (delta mass: 130.0055 Da; putative annotation: N/A; putative formula: C8H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.092,"smiles":null,"spectrum_id":"CCMSLIB00017217590","spectrum_index":5713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 515.1096 Da; putative annotation: N/A; putative formula: C23H22N3O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.477,"smiles":null,"spectrum_id":"CCMSLIB00017217592","spectrum_index":5714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 965.0667 Da; putative annotation: N/A; putative formula: C73H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1349.22,"smiles":null,"spectrum_id":"CCMSLIB00017217593","spectrum_index":5715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Pyrrole-3-propanoic acid, 5-[(1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl]-2,4-dimethyl- (delta mass: 60.1152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.254,"smiles":null,"spectrum_id":"CCMSLIB00017217596","spectrum_index":5716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 144.0425 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.29,"smiles":null,"spectrum_id":"CCMSLIB00017217597","spectrum_index":5717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 42.0332 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.088,"smiles":null,"spectrum_id":"CCMSLIB00017217599","spectrum_index":5718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 418.2184 Da; putative annotation: N/A; putative formula: C17H34N6O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.368,"smiles":null,"spectrum_id":"CCMSLIB00017217600","spectrum_index":5719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 316.2403 Da; putative annotation: N/A; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.364,"smiles":null,"spectrum_id":"CCMSLIB00017217602","spectrum_index":5720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monolaurin (delta mass: 36.0363 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.258,"smiles":null,"spectrum_id":"CCMSLIB00017217605","spectrum_index":5721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meropenem (delta mass: 338.0949 Da; putative annotation: N/A; putative formula: C16H14N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.254,"smiles":null,"spectrum_id":"CCMSLIB00017217606","spectrum_index":5722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 96.0937 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.342,"smiles":null,"spectrum_id":"CCMSLIB00017217607","spectrum_index":5723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 211.0692 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.238,"smiles":null,"spectrum_id":"CCMSLIB00017217609","spectrum_index":5724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 261.1512 Da; putative annotation: N/A; putative formula: C11H23N3O2S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.216,"smiles":null,"spectrum_id":"CCMSLIB00017217611","spectrum_index":5725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydodecanoic acid (delta mass: 36.0359 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.216,"smiles":null,"spectrum_id":"CCMSLIB00017217612","spectrum_index":5726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 468.2707 Da; putative annotation: N/A; putative formula: C22H40N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.482,"smiles":null,"spectrum_id":"CCMSLIB00017217613","spectrum_index":5727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 288.2296 Da; putative annotation: N/A; putative formula: C16H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.472,"smiles":null,"spectrum_id":"CCMSLIB00017217615","spectrum_index":5728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 101.0175 Da; putative annotation: N/A; putative formula: CH3N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.063,"smiles":null,"spectrum_id":"CCMSLIB00017217616","spectrum_index":5729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 68.9457 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.017,"smiles":null,"spectrum_id":"CCMSLIB00017217618","spectrum_index":5730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 106.0835 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.566,"smiles":null,"spectrum_id":"CCMSLIB00017217620","spectrum_index":5731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 254.0792 Da; putative annotation: N/A; putative formula: C12H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.118,"smiles":null,"spectrum_id":"CCMSLIB00017217622","spectrum_index":5732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2R,4R)-4-(2-Hydroxypropan-2-yl)-1-methylcyclohexane-1,2-diol (delta mass: 189.1004 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.249,"smiles":null,"spectrum_id":"CCMSLIB00017217623","spectrum_index":5733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 420.2877 Da; putative annotation: N/A; putative formula: C25H40O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.359,"smiles":null,"spectrum_id":"CCMSLIB00017217625","spectrum_index":5734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.191,"smiles":null,"spectrum_id":"CCMSLIB00017217626","spectrum_index":5735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 74.0364 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.206,"smiles":null,"spectrum_id":"CCMSLIB00017217627","spectrum_index":5736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 84.0206 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.138,"smiles":null,"spectrum_id":"CCMSLIB00017217629","spectrum_index":5737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D3 (delta mass: 33.0286 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.37,"smiles":null,"spectrum_id":"CCMSLIB00017217632","spectrum_index":5738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 231.1687 Da; putative annotation: N/A; putative formula: C9H21N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.26,"smiles":null,"spectrum_id":"CCMSLIB00017217633","spectrum_index":5739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.279,"smiles":null,"spectrum_id":"CCMSLIB00017217634","spectrum_index":5740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 50.0522 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.315,"smiles":null,"spectrum_id":"CCMSLIB00017217635","spectrum_index":5741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 106.0264 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.258,"smiles":null,"spectrum_id":"CCMSLIB00017217637","spectrum_index":5742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-1-(2-Hydroxyethyl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol (delta mass: 148.1307 Da; putative annotation: N/A; putative formula: CH12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.363,"smiles":null,"spectrum_id":"CCMSLIB00017217640","spectrum_index":5743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 118.0157 Da; putative annotation: N/A; putative formula: H3N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.185,"smiles":null,"spectrum_id":"CCMSLIB00017217641","spectrum_index":5744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 136.0522 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017217642","spectrum_index":5745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 110.0481 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.151,"smiles":null,"spectrum_id":"CCMSLIB00017217644","spectrum_index":5746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 66.0452 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.126,"smiles":null,"spectrum_id":"CCMSLIB00017217645","spectrum_index":5747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 299.2824 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.53,"smiles":null,"spectrum_id":"CCMSLIB00017217648","spectrum_index":5748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 145.0893 Da; putative annotation: N/A; putative formula: C10H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.176,"smiles":null,"spectrum_id":"CCMSLIB00017217649","spectrum_index":5749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 88.0468 Da; putative annotation: N/A; putative formula: C3H8N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.124,"smiles":null,"spectrum_id":"CCMSLIB00017217651","spectrum_index":5750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 491.372 Da; putative annotation: N/A; putative formula: C28H49N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.599,"smiles":null,"spectrum_id":"CCMSLIB00017217652","spectrum_index":5751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 295.163 Da; putative annotation: N/A; putative formula: C12H25NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.39,"smiles":null,"spectrum_id":"CCMSLIB00017217653","spectrum_index":5752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 194.0578 Da; putative annotation: N/A; putative formula: C10H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.139,"smiles":null,"spectrum_id":"CCMSLIB00017217657","spectrum_index":5753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 204.0992 Da; putative annotation: N/A; putative formula: C9H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.17,"smiles":null,"spectrum_id":"CCMSLIB00017217658","spectrum_index":5754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 85.053 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.192,"smiles":null,"spectrum_id":"CCMSLIB00017217659","spectrum_index":5755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 153.1515 Da; putative annotation: N/A; putative formula: C10H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.284,"smiles":null,"spectrum_id":"CCMSLIB00017217660","spectrum_index":5756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexadecylmethylglycerol (delta mass: 17.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.347,"smiles":null,"spectrum_id":"CCMSLIB00017217663","spectrum_index":5757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 200.1407 Da; putative annotation: N/A; putative formula: C11H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.222,"smiles":null,"spectrum_id":"CCMSLIB00017217665","spectrum_index":5758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-methoxybenzoic acid (delta mass: 113.0247 Da; putative annotation: N/A; putative formula: C2H4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.09,"smiles":null,"spectrum_id":"CCMSLIB00017217666","spectrum_index":5759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 28.0141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017217667","spectrum_index":5760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline [M+H-H2O]+; AIF; CE0; CorrDec (delta mass: 139.1723 Da; putative annotation: N/A; putative formula: C10H21NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.269,"smiles":null,"spectrum_id":"CCMSLIB00017217668","spectrum_index":5761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 691.6131 Da; putative annotation: N/A; putative formula: C44H77N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1075.76,"smiles":null,"spectrum_id":"CCMSLIB00017217670","spectrum_index":5762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 40.0295 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.084,"smiles":null,"spectrum_id":"CCMSLIB00017217673","spectrum_index":5763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 29.0285 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.135,"smiles":null,"spectrum_id":"CCMSLIB00017217674","spectrum_index":5764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 214.0741 Da; putative annotation: N/A; putative formula: C12H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.155,"smiles":null,"spectrum_id":"CCMSLIB00017217675","spectrum_index":5765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 673.4557 Da; putative annotation: N/A; putative formula: C39H63NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":950.672,"smiles":null,"spectrum_id":"CCMSLIB00017217676","spectrum_index":5766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 382.1472 Da; putative annotation: N/A; putative formula: C13H22N10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.239,"smiles":null,"spectrum_id":"CCMSLIB00017217679","spectrum_index":5767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 45.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017217680","spectrum_index":5768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentisic acid (delta mass: 148.0161 Da; putative annotation: N/A; putative formula: C8H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.05,"smiles":null,"spectrum_id":"CCMSLIB00017217682","spectrum_index":5769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid (delta mass: 193.0581 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.301,"smiles":null,"spectrum_id":"CCMSLIB00017217683","spectrum_index":5770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminocaproic acid (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.186,"smiles":null,"spectrum_id":"CCMSLIB00017217684","spectrum_index":5771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(8-Hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)prop-2-enoic acid (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017217687","spectrum_index":5772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 106.079 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.28,"smiles":null,"spectrum_id":"CCMSLIB00017217689","spectrum_index":5773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Amino-2-chlorophenyl)-5-chloro-2-hydroxybenzamide (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.03,"smiles":null,"spectrum_id":"CCMSLIB00017217690","spectrum_index":5774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 74.0358 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.117,"smiles":null,"spectrum_id":"CCMSLIB00017217691","spectrum_index":5775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 165.0785 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.181,"smiles":null,"spectrum_id":"CCMSLIB00017217694","spectrum_index":5776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 16.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.129,"smiles":null,"spectrum_id":"CCMSLIB00017217695","spectrum_index":5777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLIC ACID (delta mass: 45.057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.096,"smiles":null,"spectrum_id":"CCMSLIB00017217697","spectrum_index":5778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 59.9063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.966,"smiles":null,"spectrum_id":"CCMSLIB00017217698","spectrum_index":5779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381166-01_C15H26O3_ (delta mass: 188.1589 Da; putative annotation: N/A; putative formula: C14H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.354,"smiles":null,"spectrum_id":"CCMSLIB00017217699","spectrum_index":5780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydro-11-deoxycorticosterone (delta mass: 104.0594 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.318,"smiles":null,"spectrum_id":"CCMSLIB00017217702","spectrum_index":5781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Acetyl-11-keto-.beta.-boswellic acid (delta mass: 104.0633 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.421,"smiles":null,"spectrum_id":"CCMSLIB00017217704","spectrum_index":5782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017217705","spectrum_index":5783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Acetyloxy)lanosta-8,24-dien-21-oic acid (delta mass: 106.0776 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.456,"smiles":null,"spectrum_id":"CCMSLIB00017217706","spectrum_index":5784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 71.0346 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.204,"smiles":null,"spectrum_id":"CCMSLIB00017217709","spectrum_index":5785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufalin (delta mass: 80.0634 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.316,"smiles":null,"spectrum_id":"CCMSLIB00017217711","spectrum_index":5786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 332.0754 Da; putative annotation: N/A; putative formula: C24H13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.157,"smiles":null,"spectrum_id":"CCMSLIB00017217712","spectrum_index":5787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 340.1374 Da; putative annotation: N/A; putative formula: C16H25N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.219,"smiles":null,"spectrum_id":"CCMSLIB00017217713","spectrum_index":5788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 163.0924 Da; putative annotation: N/A; putative formula: C10H14NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.19,"smiles":null,"spectrum_id":"CCMSLIB00017217714","spectrum_index":5789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 38.0162 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.066,"smiles":null,"spectrum_id":"CCMSLIB00017217716","spectrum_index":5790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 224.2107 Da; putative annotation: N/A; putative formula: C11H24N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.271,"smiles":null,"spectrum_id":"CCMSLIB00017217718","spectrum_index":5791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 10.0207 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.102,"smiles":null,"spectrum_id":"CCMSLIB00017217720","spectrum_index":5792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.19,"smiles":null,"spectrum_id":"CCMSLIB00017217721","spectrum_index":5793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 36.0364 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.201,"smiles":null,"spectrum_id":"CCMSLIB00017217723","spectrum_index":5794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 126.0681 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.144,"smiles":null,"spectrum_id":"CCMSLIB00017217724","spectrum_index":5795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 56.0454 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017217727","spectrum_index":5796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 129.0428 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.212,"smiles":null,"spectrum_id":"CCMSLIB00017217729","spectrum_index":5797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 156.0922 Da; putative annotation: N/A; putative formula: C7H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.168,"smiles":null,"spectrum_id":"CCMSLIB00017217730","spectrum_index":5798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 122.0797 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.145,"smiles":null,"spectrum_id":"CCMSLIB00017217731","spectrum_index":5799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 421.1405 Da; putative annotation: N/A; putative formula: C17H27NO9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.274,"smiles":null,"spectrum_id":"CCMSLIB00017217733","spectrum_index":5800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S)-4-Amino-5-hydroxypentanoic acid (delta mass: 115.0616 Da; putative annotation: (1S,2S,3R,4R)-4-Amino-1,2,3-cyclopentanetriol; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.143,"smiles":null,"spectrum_id":"CCMSLIB00017217736","spectrum_index":5801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-N-(3-pyridinyl)benzamide (delta mass: 101.0359 Da; putative annotation: 1H-Pyrazolo[3,4-b]pyridine; putative formula: C6H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.133,"smiles":null,"spectrum_id":"CCMSLIB00017217737","spectrum_index":5802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 296.2154 Da; putative annotation: 7,8-Dehydropregnenolone; putative formula: C21H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.344,"smiles":null,"spectrum_id":"CCMSLIB00017217738","spectrum_index":5803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [(2R,3S,4S,5R,6R)-6-[1,7-bis(4-hydroxyphenyl)-5-oxoheptan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate (delta mass: 128.0354 Da; putative annotation: 4(1H)-Cinnolinone; putative formula: C8H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":751.284,"smiles":null,"spectrum_id":"CCMSLIB00017217739","spectrum_index":5804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 350.2464 Da; putative annotation: Misoprostol (free acid); putative formula: C21H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.463,"smiles":null,"spectrum_id":"CCMSLIB00017217742","spectrum_index":5805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 156.0055 Da; putative annotation: ReSpect:PT206570 cis-Aconitic Acid|Achilleaic acid|cis-aconitate|cis-Oxaloacetic acid|cis-1,2,3-Propenetricarboxylic Acid|cis-Propene-1,2,3-tricarboxylic acid|(Z)-prop-1-ene-1,2,3-tricarboxylic acid; putative formula: C6H4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.076,"smiles":null,"spectrum_id":"CCMSLIB00017217744","spectrum_index":5806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 108.0939 Da; putative annotation: Bicyclo[2.2.1]heptane-2-methanol; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017217745","spectrum_index":5807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 344.2385 Da; putative annotation: 6-[(2,5,5,8a-Tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol; putative formula: C22H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.601,"smiles":null,"spectrum_id":"CCMSLIB00017217746","spectrum_index":5808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 330.1841 Da; putative annotation: Gibberellin A14; putative formula: C20H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.432,"smiles":null,"spectrum_id":"CCMSLIB00017217747","spectrum_index":5809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of Stearidonic acid (delta mass: 164.0826 Da; putative annotation: \"\"(1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid CollisionEnergy:205060\"\"; putative formula: C10H12O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.299,"smiles":null,"spectrum_id":"CCMSLIB00017217751","spectrum_index":5810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 274.1571 Da; putative annotation: Lasiodiplodin; putative formula: C17H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.254,"smiles":null,"spectrum_id":"CCMSLIB00017217752","spectrum_index":5811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 428.2032 Da; putative annotation: (Z)-2,6-dimethyl-7-(4-methyl-5-oxooxolan-2-yl)-3-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]hept-5-enoic acid; putative formula: C21H32O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.414,"smiles":null,"spectrum_id":"CCMSLIB00017217753","spectrum_index":5812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 150.1045 Da; putative annotation: (5S)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.18,"smiles":null,"spectrum_id":"CCMSLIB00017217754","spectrum_index":5813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 475.3137 Da; putative annotation: Tiamulin; putative formula: C28H45NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.551,"smiles":null,"spectrum_id":"CCMSLIB00017217756","spectrum_index":5814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 252.0999 Da; putative annotation: Phenylmethyl-glucopyranoside; putative formula: C13H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.16,"smiles":null,"spectrum_id":"CCMSLIB00017217759","spectrum_index":5815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 109.0737 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.123,"smiles":null,"spectrum_id":"CCMSLIB00017217760","spectrum_index":5816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 235.1416 Da; putative annotation: N/A; putative formula: C10H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.228,"smiles":null,"spectrum_id":"CCMSLIB00017217761","spectrum_index":5817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 288.2291 Da; putative annotation: N/A; putative formula: C16H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.477,"smiles":null,"spectrum_id":"CCMSLIB00017217762","spectrum_index":5818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Thiophen-2-yl)piperazin-2-one (delta mass: 43.0126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.071,"smiles":null,"spectrum_id":"CCMSLIB00017217764","spectrum_index":5819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 19.0409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.106,"smiles":null,"spectrum_id":"CCMSLIB00017217767","spectrum_index":5820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 339.1875 Da; putative annotation: N/A; putative formula: C18H31NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.404,"smiles":null,"spectrum_id":"CCMSLIB00017217768","spectrum_index":5821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 153.0788 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.155,"smiles":null,"spectrum_id":"CCMSLIB00017217769","spectrum_index":5822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385097-01_C20H22O9_beta-D-Glucopyranoside, 4-hydroxy-2-(hydroxymethyl)phenyl, 6-benzoate (delta mass: 121.0529 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.187,"smiles":null,"spectrum_id":"CCMSLIB00017217771","spectrum_index":5823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 53.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017217773","spectrum_index":5824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 41.1212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.187,"smiles":null,"spectrum_id":"CCMSLIB00017217774","spectrum_index":5825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 74.036 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.174,"smiles":null,"spectrum_id":"CCMSLIB00017217775","spectrum_index":5826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(8Z,11Z,14Z-Eicosatrienoyl)ethanolamine (delta mass: 64.0685 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.374,"smiles":null,"spectrum_id":"CCMSLIB00017217777","spectrum_index":5827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 289.1314 Da; putative annotation: N/A; putative formula: C16H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.233,"smiles":null,"spectrum_id":"CCMSLIB00017217779","spectrum_index":5828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydro-11-deoxycorticosterone (delta mass: 86.0519 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.31,"smiles":null,"spectrum_id":"CCMSLIB00017217781","spectrum_index":5829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 108.0937 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017217782","spectrum_index":5830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 56.026 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017217783","spectrum_index":5831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 10.0642 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.16,"smiles":null,"spectrum_id":"CCMSLIB00017217786","spectrum_index":5832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Coniine (delta mass: 213.2086 Da; putative annotation: N/A; putative formula: C13H27NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.352,"smiles":null,"spectrum_id":"CCMSLIB00017217787","spectrum_index":5833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 18.0513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.19,"smiles":null,"spectrum_id":"CCMSLIB00017217788","spectrum_index":5834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 139.0276 Da; putative annotation: N/A; putative formula: C6H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.098,"smiles":null,"spectrum_id":"CCMSLIB00017217790","spectrum_index":5835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol CollisionEnergy:205060 (delta mass: 180.0633 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.269,"smiles":null,"spectrum_id":"CCMSLIB00017217792","spectrum_index":5836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 228.1363 Da; putative annotation: N/A; putative formula: C12H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.202,"smiles":null,"spectrum_id":"CCMSLIB00017217794","spectrum_index":5837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 694.4011 Da; putative annotation: N/A; putative formula: C42H55N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1021.53,"smiles":null,"spectrum_id":"CCMSLIB00017217795","spectrum_index":5838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 474.2954 Da; putative annotation: N/A; putative formula: C24H38N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.387,"smiles":null,"spectrum_id":"CCMSLIB00017217797","spectrum_index":5839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 409.2012 Da; putative annotation: N/A; putative formula: C24H31N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.314,"smiles":null,"spectrum_id":"CCMSLIB00017217798","spectrum_index":5840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 409.3208 Da; putative annotation: N/A; putative formula: C25H39N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.594,"smiles":null,"spectrum_id":"CCMSLIB00017217801","spectrum_index":5841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 176.0377 Da; putative annotation: N/A; putative formula: C12H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.14,"smiles":null,"spectrum_id":"CCMSLIB00017217802","spectrum_index":5842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 199.084 Da; putative annotation: N/A; putative formula: C9H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.207,"smiles":null,"spectrum_id":"CCMSLIB00017217803","spectrum_index":5843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 16.7443 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.029,"smiles":null,"spectrum_id":"CCMSLIB00017217804","spectrum_index":5844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 68.0403 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017217805","spectrum_index":5845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 168.0384 Da; putative annotation: N/A; putative formula: C3H8N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.129,"smiles":null,"spectrum_id":"CCMSLIB00017217809","spectrum_index":5846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 196.2144 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.374,"smiles":null,"spectrum_id":"CCMSLIB00017217810","spectrum_index":5847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 238.1469 Da; putative annotation: N/A; putative formula: C16H18N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.228,"smiles":null,"spectrum_id":"CCMSLIB00017217811","spectrum_index":5848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.238,"smiles":null,"spectrum_id":"CCMSLIB00017217812","spectrum_index":5849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-hydroxybutyl)-3,5,5-trimethylcyclohex-3-en-1-ol (delta mass: 132.0423 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.227,"smiles":null,"spectrum_id":"CCMSLIB00017217814","spectrum_index":5850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 64.0308 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.2,"smiles":null,"spectrum_id":"CCMSLIB00017217817","spectrum_index":5851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 15.0091 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.288,"smiles":null,"spectrum_id":"CCMSLIB00017217818","spectrum_index":5852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 152.0937 Da; putative annotation: N/A; putative formula: C8H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.18,"smiles":null,"spectrum_id":"CCMSLIB00017217819","spectrum_index":5853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-trans-Chrysanthemic acid (delta mass: 193.0586 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.181,"smiles":null,"spectrum_id":"CCMSLIB00017217821","spectrum_index":5854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,9(11),12,24-tetraen-26-oic acid (delta mass: 130.0778 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.398,"smiles":null,"spectrum_id":"CCMSLIB00017217823","spectrum_index":5855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-3-carboxylic acid (delta mass: 9.9842 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.018,"smiles":null,"spectrum_id":"CCMSLIB00017217824","spectrum_index":5856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylpiperidine (delta mass: 116.0624 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.206,"smiles":null,"spectrum_id":"CCMSLIB00017217826","spectrum_index":5857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 311.2471 Da; putative annotation: N/A; putative formula: C19H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.531,"smiles":null,"spectrum_id":"CCMSLIB00017217827","spectrum_index":5858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 370.3066 Da; putative annotation: N/A; putative formula: C26H42O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.344,"smiles":null,"spectrum_id":"CCMSLIB00017217830","spectrum_index":5859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 107.0587 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.124,"smiles":null,"spectrum_id":"CCMSLIB00017217831","spectrum_index":5860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 156.0089 Da; putative annotation: N/A; putative formula: C5H5N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.178,"smiles":null,"spectrum_id":"CCMSLIB00017217833","spectrum_index":5861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 40.9962 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.076,"smiles":null,"spectrum_id":"CCMSLIB00017217834","spectrum_index":5862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 170.1674 Da; putative annotation: N/A; putative formula: C11H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.301,"smiles":null,"spectrum_id":"CCMSLIB00017217837","spectrum_index":5863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 19.0309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.107,"smiles":null,"spectrum_id":"CCMSLIB00017217838","spectrum_index":5864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 365.1943 Da; putative annotation: N/A; putative formula: C23H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.291,"smiles":null,"spectrum_id":"CCMSLIB00017217840","spectrum_index":5865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-((4R)-4-((5R,7R,8R,9S,10S,12S,13R,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid\"\" (delta mass: 673.1888 Da; putative annotation: N/A; putative formula: C31H31N9O5S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1187.47,"smiles":null,"spectrum_id":"CCMSLIB00017217841","spectrum_index":5866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 351.1546 Da; putative annotation: N/A; putative formula: C16H33NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.257,"smiles":null,"spectrum_id":"CCMSLIB00017217844","spectrum_index":5867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 106.0416 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.134,"smiles":null,"spectrum_id":"CCMSLIB00017217846","spectrum_index":5868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 42.0466 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.317,"smiles":null,"spectrum_id":"CCMSLIB00017217847","spectrum_index":5869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 186.1471 Da; putative annotation: N/A; putative formula: C8H18N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.499,"smiles":null,"spectrum_id":"CCMSLIB00017217848","spectrum_index":5870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 541.2189 Da; putative annotation: N/A; putative formula: C24H36N3O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.279,"smiles":null,"spectrum_id":"CCMSLIB00017217850","spectrum_index":5871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 377.1197 Da; putative annotation: N/A; putative formula: C21H19N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.161,"smiles":null,"spectrum_id":"CCMSLIB00017217852","spectrum_index":5872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 656.2111 Da; putative annotation: N/A; putative formula: C25H42N2O14P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.266,"smiles":null,"spectrum_id":"CCMSLIB00017217854","spectrum_index":5873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 355.3088 Da; putative annotation: N/A; putative formula: C21H41NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.556,"smiles":null,"spectrum_id":"CCMSLIB00017217855","spectrum_index":5874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 64.0302 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.315,"smiles":null,"spectrum_id":"CCMSLIB00017217857","spectrum_index":5875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epitestosterone (delta mass: 74.0373 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.254,"smiles":null,"spectrum_id":"CCMSLIB00017217859","spectrum_index":5876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 142.8862 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.973,"smiles":null,"spectrum_id":"CCMSLIB00017217861","spectrum_index":5877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-.beta.-D-ribofuranosyl-1H-imidazole-4-carboxamide (delta mass: 271.0912 Da; putative annotation: N/A; putative formula: C19H14NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.195,"smiles":null,"spectrum_id":"CCMSLIB00017217862","spectrum_index":5878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 643.5559 Da; putative annotation: N/A; putative formula: C42H69N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":920.772,"smiles":null,"spectrum_id":"CCMSLIB00017217864","spectrum_index":5879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 55.9884 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.06,"smiles":null,"spectrum_id":"CCMSLIB00017217866","spectrum_index":5880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 44.0252 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.143,"smiles":null,"spectrum_id":"CCMSLIB00017217867","spectrum_index":5881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 40.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.102,"smiles":null,"spectrum_id":"CCMSLIB00017217868","spectrum_index":5882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Acetyloxy)lanosta-8,24-dien-21-oic acid (delta mass: 56.0634 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.442,"smiles":null,"spectrum_id":"CCMSLIB00017217870","spectrum_index":5883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,20-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0,?.0?,?.0?,?]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaen-17-ol (delta mass: 180.1882 Da; putative annotation: N/A; putative formula: C13H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.322,"smiles":null,"spectrum_id":"CCMSLIB00017217873","spectrum_index":5884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 546.1801 Da; putative annotation: N/A; putative formula: C23H35N2O9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.24,"smiles":null,"spectrum_id":"CCMSLIB00017217874","spectrum_index":5885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 501.1811 Da; putative annotation: N/A; putative formula: C20H32N5O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.26,"smiles":null,"spectrum_id":"CCMSLIB00017217875","spectrum_index":5886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-(1,3-Dihydroxy-3-methylbutyl)-3a,6-dihydroxy-4-methoxy-3a,12a-dihydro-5H-furo[3',2':4,5]furo[3,2-b]xanthen-5-one (delta mass: 459.1536 Da; putative annotation: N/A; putative formula: C16H25N7O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.287,"smiles":null,"spectrum_id":"CCMSLIB00017217876","spectrum_index":5887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 436.1103 Da; putative annotation: N/A; putative formula: C24H24N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.151,"smiles":null,"spectrum_id":"CCMSLIB00017217878","spectrum_index":5888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4S,5R,9R,13S)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0\u0105,\u0105?.0?,?]hexadec-10-ene-5-carboxylic acid (delta mass: 60.0187 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.235,"smiles":null,"spectrum_id":"CCMSLIB00017217881","spectrum_index":5889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 314.2459 Da; putative annotation: N/A; putative formula: C18H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.478,"smiles":null,"spectrum_id":"CCMSLIB00017217882","spectrum_index":5890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Topotecan (delta mass: 200.0943 Da; putative annotation: N/A; putative formula: C6H13N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.265,"smiles":null,"spectrum_id":"CCMSLIB00017217883","spectrum_index":5891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 68.0472 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.295,"smiles":null,"spectrum_id":"CCMSLIB00017217885","spectrum_index":5892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 6.409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.5,"smiles":null,"spectrum_id":"CCMSLIB00017217887","spectrum_index":5893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentamethylene bisacetamide (delta mass: 136.0521 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.196,"smiles":null,"spectrum_id":"CCMSLIB00017217889","spectrum_index":5894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 52.031 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.07,"smiles":null,"spectrum_id":"CCMSLIB00017217890","spectrum_index":5895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 37.0603 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.103,"smiles":null,"spectrum_id":"CCMSLIB00017217892","spectrum_index":5896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 308.106 Da; putative annotation: N/A; putative formula: C20H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.211,"smiles":null,"spectrum_id":"CCMSLIB00017217893","spectrum_index":5897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 70.0416 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.133,"smiles":null,"spectrum_id":"CCMSLIB00017217896","spectrum_index":5898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Pro (delta mass: 147.068 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.198,"smiles":null,"spectrum_id":"CCMSLIB00017217897","spectrum_index":5899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 120.0989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.31,"smiles":null,"spectrum_id":"CCMSLIB00017217899","spectrum_index":5900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 235.2028 Da; putative annotation: N/A; putative formula: C14H25N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.32,"smiles":null,"spectrum_id":"CCMSLIB00017217900","spectrum_index":5901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 205.2 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.39,"smiles":null,"spectrum_id":"CCMSLIB00017217902","spectrum_index":5902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrotachysterol (delta mass: 47.0079 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.37,"smiles":null,"spectrum_id":"CCMSLIB00017217903","spectrum_index":5903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyisovanillic acid (delta mass: 33.0391 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.083,"smiles":null,"spectrum_id":"CCMSLIB00017217904","spectrum_index":5904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.053,"smiles":null,"spectrum_id":"CCMSLIB00017217906","spectrum_index":5905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 329.1334 Da; putative annotation: N/A; putative formula: C22H20NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.323,"smiles":null,"spectrum_id":"CCMSLIB00017217907","spectrum_index":5906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 137.0241 Da; putative annotation: N/A; putative formula: C3H8NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.293,"smiles":null,"spectrum_id":"CCMSLIB00017217910","spectrum_index":5907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Octanoyldihydrosphingosine (delta mass: 82.0783 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.488,"smiles":null,"spectrum_id":"CCMSLIB00017217912","spectrum_index":5908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.186,"smiles":null,"spectrum_id":"CCMSLIB00017217913","spectrum_index":5909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 103.0093 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.127,"smiles":null,"spectrum_id":"CCMSLIB00017217914","spectrum_index":5910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 83.048 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.12,"smiles":null,"spectrum_id":"CCMSLIB00017217916","spectrum_index":5911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-hydroxybenzo(a)pyrene (delta mass: 153.1939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.29,"smiles":null,"spectrum_id":"CCMSLIB00017217919","spectrum_index":5912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 398.1253 Da; putative annotation: N/A; putative formula: C18H27N2O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.166,"smiles":null,"spectrum_id":"CCMSLIB00017217920","spectrum_index":5913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 90.0302 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.09,"smiles":null,"spectrum_id":"CCMSLIB00017217921","spectrum_index":5914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 160.169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.271,"smiles":null,"spectrum_id":"CCMSLIB00017217922","spectrum_index":5915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 54.035 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.115,"smiles":null,"spectrum_id":"CCMSLIB00017217924","spectrum_index":5916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 19.0295 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.137,"smiles":null,"spectrum_id":"CCMSLIB00017217927","spectrum_index":5917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 100.0161 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017217928","spectrum_index":5918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,19-Dihydroxy-3-oxo-12-ursen-28-oic acid (delta mass: 154.1137 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.456,"smiles":null,"spectrum_id":"CCMSLIB00017217929","spectrum_index":5919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 205.1317 Da; putative annotation: N/A; putative formula: C9H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.379,"smiles":null,"spectrum_id":"CCMSLIB00017217930","spectrum_index":5920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bergenin (delta mass: 98.0732 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.16,"smiles":null,"spectrum_id":"CCMSLIB00017217934","spectrum_index":5921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-cis-Retinol (delta mass: 147.0431 Da; putative annotation: N/A; putative formula: C7H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.28,"smiles":null,"spectrum_id":"CCMSLIB00017217935","spectrum_index":5922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Piperazin-1-yl)ethanamine (delta mass: 280.1443 Da; putative annotation: N/A; putative formula: C12H25O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.278,"smiles":null,"spectrum_id":"CCMSLIB00017217936","spectrum_index":5923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 405.1363 Da; putative annotation: N/A; putative formula: C27H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.285,"smiles":null,"spectrum_id":"CCMSLIB00017217937","spectrum_index":5924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 116.0471 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.202,"smiles":null,"spectrum_id":"CCMSLIB00017217938","spectrum_index":5925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 170.1306 Da; putative annotation: N/A; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.175,"smiles":null,"spectrum_id":"CCMSLIB00017217941","spectrum_index":5926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid (delta mass: 112.0671 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.419,"smiles":null,"spectrum_id":"CCMSLIB00017217943","spectrum_index":5927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 15.0055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.066,"smiles":null,"spectrum_id":"CCMSLIB00017217944","spectrum_index":5928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 410.3237 Da; putative annotation: N/A; putative formula: C18H38N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.446,"smiles":null,"spectrum_id":"CCMSLIB00017217945","spectrum_index":5929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-methyl-4-methylidene-7-(propan-2-yl)-1,2,3,3a,4,5,6,8a-octahydroazulen-1-ol (delta mass: 59.0369 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.227,"smiles":null,"spectrum_id":"CCMSLIB00017217947","spectrum_index":5930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 52.0313 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.091,"smiles":null,"spectrum_id":"CCMSLIB00017217950","spectrum_index":5931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 823.5793 Da; putative annotation: N/A; putative formula: C50H81NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1045.68,"smiles":null,"spectrum_id":"CCMSLIB00017217951","spectrum_index":5932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Di-.gamma.-linolenin (6c,9c,12c) (delta mass: 279.2749 Da; putative annotation: N/A; putative formula: C16H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":892.758,"smiles":null,"spectrum_id":"CCMSLIB00017217952","spectrum_index":5933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 25.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017217953","spectrum_index":5934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 72.9838 Da; putative annotation: N/A; putative formula: N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.044,"smiles":null,"spectrum_id":"CCMSLIB00017217956","spectrum_index":5935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 145.1796 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.266,"smiles":null,"spectrum_id":"CCMSLIB00017217958","spectrum_index":5936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 84.0573 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017217959","spectrum_index":5937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 277.3109 Da; putative annotation: N/A; putative formula: C20H39NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.444,"smiles":null,"spectrum_id":"CCMSLIB00017217960","spectrum_index":5938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (((3a,7b)-3,7-trihydroxy-24-oxocholan-22-en-24-yl)amino)ethanesulfonic acid (delta mass: 128.101 Da; putative annotation: N/A; putative formula: C8H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.389,"smiles":null,"spectrum_id":"CCMSLIB00017217962","spectrum_index":5939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 299.2363 Da; putative annotation: N/A; putative formula: C19H29N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.598,"smiles":null,"spectrum_id":"CCMSLIB00017217964","spectrum_index":5940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 538.348 Da; putative annotation: N/A; putative formula: C34H50O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.434,"smiles":null,"spectrum_id":"CCMSLIB00017217966","spectrum_index":5941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Di-.gamma.-linolenin (6c,9c,12c) from NIST14 (delta mass: 128.104 Da; putative annotation: N/A; putative formula: C8H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.587,"smiles":null,"spectrum_id":"CCMSLIB00017217968","spectrum_index":5942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 129.0424 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.165,"smiles":null,"spectrum_id":"CCMSLIB00017217969","spectrum_index":5943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 88.052 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.154,"smiles":null,"spectrum_id":"CCMSLIB00017217971","spectrum_index":5944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 26.0041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.111,"smiles":null,"spectrum_id":"CCMSLIB00017217974","spectrum_index":5945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 125.1201 Da; putative annotation: N/A; putative formula: C8H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.259,"smiles":null,"spectrum_id":"CCMSLIB00017217975","spectrum_index":5946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Piperidinyl)morpholine (delta mass: 16.9108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.06,"smiles":null,"spectrum_id":"CCMSLIB00017217976","spectrum_index":5947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 397.235 Da; putative annotation: N/A; putative formula: C25H36NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.363,"smiles":null,"spectrum_id":"CCMSLIB00017217978","spectrum_index":5948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HOMOGENTISATE (delta mass: 80.0625 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017217981","spectrum_index":5949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 18.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017217982","spectrum_index":5950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 178.0759 Da; putative annotation: N/A; putative formula: C7H15O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.151,"smiles":null,"spectrum_id":"CCMSLIB00017217984","spectrum_index":5951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 82.1175 Da; putative annotation: N/A; putative formula: C7H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.182,"smiles":null,"spectrum_id":"CCMSLIB00017217985","spectrum_index":5952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 320.2932 Da; putative annotation: N/A; putative formula: C19H36N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.411,"smiles":null,"spectrum_id":"CCMSLIB00017217988","spectrum_index":5953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 84.021 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.118,"smiles":null,"spectrum_id":"CCMSLIB00017217989","spectrum_index":5954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 70.045 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.116,"smiles":null,"spectrum_id":"CCMSLIB00017217991","spectrum_index":5955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 150.0916 Da; putative annotation: N/A; putative formula: C7H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.183,"smiles":null,"spectrum_id":"CCMSLIB00017217992","spectrum_index":5956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 69.0414 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.393,"smiles":null,"spectrum_id":"CCMSLIB00017217995","spectrum_index":5957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 246.0735 Da; putative annotation: N/A; putative formula: C10H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.134,"smiles":null,"spectrum_id":"CCMSLIB00017217997","spectrum_index":5958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 277.2617 Da; putative annotation: N/A; putative formula: C16H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.514,"smiles":null,"spectrum_id":"CCMSLIB00017217998","spectrum_index":5959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 13.0043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.091,"smiles":null,"spectrum_id":"CCMSLIB00017217999","spectrum_index":5960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 341.1328 Da; putative annotation: N/A; putative formula: C15H24N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.214,"smiles":null,"spectrum_id":"CCMSLIB00017218001","spectrum_index":5961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 318.2201 Da; putative annotation: N/A; putative formula: C20H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.312,"smiles":null,"spectrum_id":"CCMSLIB00017218004","spectrum_index":5962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 175.0848 Da; putative annotation: N/A; putative formula: C7H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.145,"smiles":null,"spectrum_id":"CCMSLIB00017218005","spectrum_index":5963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dimethylaminopurine (delta mass: 1.9998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.093,"smiles":null,"spectrum_id":"CCMSLIB00017218006","spectrum_index":5964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 25.0453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.121,"smiles":null,"spectrum_id":"CCMSLIB00017218007","spectrum_index":5965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 33.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017218009","spectrum_index":5966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 41.8792 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.934,"smiles":null,"spectrum_id":"CCMSLIB00017218012","spectrum_index":5967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (not validated) (delta mass: 24.036 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.101,"smiles":null,"spectrum_id":"CCMSLIB00017218013","spectrum_index":5968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 618.257 Da; putative annotation: N/A; putative formula: C26H42N4O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.375,"smiles":null,"spectrum_id":"CCMSLIB00017218014","spectrum_index":5969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 478.4249 Da; putative annotation: N/A; putative formula: C28H54N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.501,"smiles":null,"spectrum_id":"CCMSLIB00017218015","spectrum_index":5970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 46.0131 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.1,"smiles":null,"spectrum_id":"CCMSLIB00017218019","spectrum_index":5971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347642-02! (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.186,"smiles":null,"spectrum_id":"CCMSLIB00017218020","spectrum_index":5972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 79.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.119,"smiles":null,"spectrum_id":"CCMSLIB00017218021","spectrum_index":5973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 14.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.138,"smiles":null,"spectrum_id":"CCMSLIB00017218022","spectrum_index":5974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 249.1574 Da; putative annotation: N/A; putative formula: C11H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.379,"smiles":null,"spectrum_id":"CCMSLIB00017218023","spectrum_index":5975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 261.1576 Da; putative annotation: N/A; putative formula: C12H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.379,"smiles":null,"spectrum_id":"CCMSLIB00017218027","spectrum_index":5976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 58.0405 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.127,"smiles":null,"spectrum_id":"CCMSLIB00017218028","spectrum_index":5977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 90.0419 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.133,"smiles":null,"spectrum_id":"CCMSLIB00017218029","spectrum_index":5978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310639 7-Hydroxymitragynine (delta mass: 79.9546 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.177,"smiles":null,"spectrum_id":"CCMSLIB00017218030","spectrum_index":5979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 174.0479 Da; putative annotation: N/A; putative formula: C6H12N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.171,"smiles":null,"spectrum_id":"CCMSLIB00017218033","spectrum_index":5980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.06,"smiles":null,"spectrum_id":"CCMSLIB00017218035","spectrum_index":5981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Formyl-L-tryptophan (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.108,"smiles":null,"spectrum_id":"CCMSLIB00017218036","spectrum_index":5982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 214.0478 Da; putative annotation: N/A; putative formula: C9H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017218037","spectrum_index":5983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 156.0533 Da; putative annotation: N/A; putative formula: C6H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.129,"smiles":null,"spectrum_id":"CCMSLIB00017218039","spectrum_index":5984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 220.1678 Da; putative annotation: N/A; putative formula: C12H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.344,"smiles":null,"spectrum_id":"CCMSLIB00017218042","spectrum_index":5985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine; AIF; CE0; MS2Dec (delta mass: 168.1507 Da; putative annotation: N/A; putative formula: C11H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.237,"smiles":null,"spectrum_id":"CCMSLIB00017218043","spectrum_index":5986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 42.0084 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.287,"smiles":null,"spectrum_id":"CCMSLIB00017218044","spectrum_index":5987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.331,"smiles":null,"spectrum_id":"CCMSLIB00017218045","spectrum_index":5988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 28.0983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.2,"smiles":null,"spectrum_id":"CCMSLIB00017218048","spectrum_index":5989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 44.0378 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.119,"smiles":null,"spectrum_id":"CCMSLIB00017218050","spectrum_index":5990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 170.094 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.201,"smiles":null,"spectrum_id":"CCMSLIB00017218051","spectrum_index":5991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Tetrahydro-2-furanylpropanoic acid (delta mass: 24.0002 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.086,"smiles":null,"spectrum_id":"CCMSLIB00017218052","spectrum_index":5992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 30.0106 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.086,"smiles":null,"spectrum_id":"CCMSLIB00017218055","spectrum_index":5993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentisic acid (delta mass: 28.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.086,"smiles":null,"spectrum_id":"CCMSLIB00017218057","spectrum_index":5994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 127.0269 Da; putative annotation: N/A; putative formula: C5H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.087,"smiles":null,"spectrum_id":"CCMSLIB00017218058","spectrum_index":5995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 369.3243 Da; putative annotation: N/A; putative formula: C22H43NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.395,"smiles":null,"spectrum_id":"CCMSLIB00017218059","spectrum_index":5996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-trans-Prostaglandin D2 (delta mass: 161.0703 Da; putative annotation: N/A; putative formula: C7H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.303,"smiles":null,"spectrum_id":"CCMSLIB00017218061","spectrum_index":5997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.113,"smiles":null,"spectrum_id":"CCMSLIB00017218064","spectrum_index":5998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palitantin (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017218065","spectrum_index":5999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 72.0361 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.279,"smiles":null,"spectrum_id":"CCMSLIB00017218066","spectrum_index":6000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 162.1039 Da; putative annotation: N/A; putative formula: C5H15N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.299,"smiles":null,"spectrum_id":"CCMSLIB00017218068","spectrum_index":6001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 237.1582 Da; putative annotation: N/A; putative formula: C11H19N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.291,"smiles":null,"spectrum_id":"CCMSLIB00017218070","spectrum_index":6002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 98.991 Da; putative annotation: N/A; putative formula: C2HN3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.238,"smiles":null,"spectrum_id":"CCMSLIB00017218071","spectrum_index":6003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 177.0619 Da; putative annotation: N/A; putative formula: C3H3N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.315,"smiles":null,"spectrum_id":"CCMSLIB00017218072","spectrum_index":6004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 54.0466 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.127,"smiles":null,"spectrum_id":"CCMSLIB00017218074","spectrum_index":6005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclopropylacetic acid (delta mass: 250.1778 Da; putative annotation: N/A; putative formula: C9H18N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.237,"smiles":null,"spectrum_id":"CCMSLIB00017218077","spectrum_index":6006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 266.2605 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.361,"smiles":null,"spectrum_id":"CCMSLIB00017218078","spectrum_index":6007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 73.0165 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.087,"smiles":null,"spectrum_id":"CCMSLIB00017218079","spectrum_index":6008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 1130.5527 Da; putative annotation: N/A; putative formula: C49H82N10O18S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1311.62,"smiles":null,"spectrum_id":"CCMSLIB00017218081","spectrum_index":6009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxy-7,9-dimethyl-1,3,4,4a,7,7a-hexahydrobenzo[e]naphthalene-2,8,11-trione (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.133,"smiles":null,"spectrum_id":"CCMSLIB00017218082","spectrum_index":6010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 977.5209 Da; putative annotation: N/A; putative formula: C48H75N5O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1140.58,"smiles":null,"spectrum_id":"CCMSLIB00017218085","spectrum_index":6011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clifednamide A putative (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.28,"smiles":null,"spectrum_id":"CCMSLIB00017218086","spectrum_index":6012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)acetamide (delta mass: 146.0039 Da; putative annotation: N/A; putative formula: C5H6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.122,"smiles":null,"spectrum_id":"CCMSLIB00017218088","spectrum_index":6013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Obeticholic_Acid_NCE45 (delta mass: 62.0528 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.384,"smiles":null,"spectrum_id":"CCMSLIB00017218090","spectrum_index":6014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.102,"smiles":null,"spectrum_id":"CCMSLIB00017218092","spectrum_index":6015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 32.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.248,"smiles":null,"spectrum_id":"CCMSLIB00017218094","spectrum_index":6016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 45.0214 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.144,"smiles":null,"spectrum_id":"CCMSLIB00017218095","spectrum_index":6017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 31.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.156,"smiles":null,"spectrum_id":"CCMSLIB00017218097","spectrum_index":6018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 116.0321 Da; putative annotation: N/A; putative formula: C5H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.124,"smiles":null,"spectrum_id":"CCMSLIB00017218098","spectrum_index":6019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Garcinoic acid (delta mass: 179.0814 Da; putative annotation: N/A; putative formula: C7H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.366,"smiles":null,"spectrum_id":"CCMSLIB00017218100","spectrum_index":6020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosahexaenoic acid - 40.0 eV (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.269,"smiles":null,"spectrum_id":"CCMSLIB00017218101","spectrum_index":6021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 37.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.134,"smiles":null,"spectrum_id":"CCMSLIB00017218102","spectrum_index":6022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norverapamil (delta mass: 264.11 Da; putative annotation: N/A; putative formula: C13H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.385,"smiles":null,"spectrum_id":"CCMSLIB00017218106","spectrum_index":6023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxycinnamic acid (delta mass: 246.1248 Da; putative annotation: N/A; putative formula: C9H19N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.19,"smiles":null,"spectrum_id":"CCMSLIB00017218107","spectrum_index":6024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 144.0942 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.139,"smiles":null,"spectrum_id":"CCMSLIB00017218108","spectrum_index":6025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-hydroxybenzyl alcohol CollisionEnergy:205060 (delta mass: 114.0677 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.127,"smiles":null,"spectrum_id":"CCMSLIB00017218111","spectrum_index":6026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 343.1413 Da; putative annotation: N/A; putative formula: C13H22N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.296,"smiles":null,"spectrum_id":"CCMSLIB00017218113","spectrum_index":6027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 155.0254 Da; putative annotation: N/A; putative formula: C5H6N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.195,"smiles":null,"spectrum_id":"CCMSLIB00017218114","spectrum_index":6028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 92.0017 Da; putative annotation: N/A; putative formula: C4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.181,"smiles":null,"spectrum_id":"CCMSLIB00017218115","spectrum_index":6029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-(2-Hydroxyethylazanediyl)diacetic acid (delta mass: 215.239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.31,"smiles":null,"spectrum_id":"CCMSLIB00017218117","spectrum_index":6030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 327.255 Da; putative annotation: N/A; putative formula: C22H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.769,"smiles":null,"spectrum_id":"CCMSLIB00017218119","spectrum_index":6031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N-methyl-4-piperidinamine (delta mass: 72.0463 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017218121","spectrum_index":6032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Deoxy-12-hydroxyandrographolide (delta mass: 112.0715 Da; putative annotation: N/A; putative formula: C7H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.288,"smiles":null,"spectrum_id":"CCMSLIB00017218122","spectrum_index":6033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 160.0738 Da; putative annotation: N/A; putative formula: C2H9N8O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.144,"smiles":null,"spectrum_id":"CCMSLIB00017218124","spectrum_index":6034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Thiophen-2-yl)piperazin-2-one (delta mass: 252.1216 Da; putative annotation: N/A; putative formula: C13H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.18,"smiles":null,"spectrum_id":"CCMSLIB00017218125","spectrum_index":6035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 526.6888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.812,"smiles":null,"spectrum_id":"CCMSLIB00017218127","spectrum_index":6036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 341.132 Da; putative annotation: N/A; putative formula: C12H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.308,"smiles":null,"spectrum_id":"CCMSLIB00017218128","spectrum_index":6037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 114.0163 Da; putative annotation: N/A; putative formula: C5H8O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.144,"smiles":null,"spectrum_id":"CCMSLIB00017218131","spectrum_index":6038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.-ol-17-one (delta mass: 88.0682 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.284,"smiles":null,"spectrum_id":"CCMSLIB00017218133","spectrum_index":6039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-6-methoxy-3-methyl-5-(propan-2-ylidene)furo[2,3,4-de]chromen-2(5H)-one (delta mass: 292.0927 Da; putative annotation: N/A; putative formula: C11H22N2OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.184,"smiles":null,"spectrum_id":"CCMSLIB00017218134","spectrum_index":6040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid, 4-(7,8,9,10-tetrahydro-5,7,7,10,10-pentamethyl-5H-benzo[e]naphtho[2,3-b][1,4]diazepin-13-yl)- (delta mass: 133.0597 Da; putative annotation: N/A; putative formula: C2H7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.298,"smiles":null,"spectrum_id":"CCMSLIB00017218135","spectrum_index":6041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexanone, 2-(ethylamino)-2-phenyl- (delta mass: 419.1718 Da; putative annotation: N/A; putative formula: C22H17N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.326,"smiles":null,"spectrum_id":"CCMSLIB00017218137","spectrum_index":6042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,9a,9b-octahydrobenzo[g][1]benzofuran-2-one (delta mass: 341.1324 Da; putative annotation: N/A; putative formula: C12H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.297,"smiles":null,"spectrum_id":"CCMSLIB00017218140","spectrum_index":6043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 254.1009 Da; putative annotation: N/A; putative formula: C12H19N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.182,"smiles":null,"spectrum_id":"CCMSLIB00017218141","spectrum_index":6044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 70.0416 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017218142","spectrum_index":6045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Ketofusidic acid (delta mass: 100.0667 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.403,"smiles":null,"spectrum_id":"CCMSLIB00017218143","spectrum_index":6046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 38.0526 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.284,"smiles":null,"spectrum_id":"CCMSLIB00017218145","spectrum_index":6047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 146.0368 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.143,"smiles":null,"spectrum_id":"CCMSLIB00017218148","spectrum_index":6048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,2,3,4-Tetrahydro-9H-carbazol-9-yl)propanohydrazide (delta mass: 55.0199 Da; putative annotation: N/A; putative formula: CHN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.18,"smiles":null,"spectrum_id":"CCMSLIB00017218149","spectrum_index":6049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 59.047 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.159,"smiles":null,"spectrum_id":"CCMSLIB00017218150","spectrum_index":6050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 162.0525 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.134,"smiles":null,"spectrum_id":"CCMSLIB00017218152","spectrum_index":6051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 229.0674 Da; putative annotation: N/A; putative formula: C12H11N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.108,"smiles":null,"spectrum_id":"CCMSLIB00017218153","spectrum_index":6052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 978.3332 Da; putative annotation: N/A; putative formula: C68H38N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1199.52,"smiles":null,"spectrum_id":"CCMSLIB00017218156","spectrum_index":6053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 92.0615 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.403,"smiles":null,"spectrum_id":"CCMSLIB00017218157","spectrum_index":6054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HOMOGENTISATE (delta mass: 92.0604 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.11,"smiles":null,"spectrum_id":"CCMSLIB00017218158","spectrum_index":6055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 88.0642 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.145,"smiles":null,"spectrum_id":"CCMSLIB00017218160","spectrum_index":6056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Arachidonoylglycerol (delta mass: 162.0537 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.338,"smiles":null,"spectrum_id":"CCMSLIB00017218163","spectrum_index":6057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 131.0471 Da; putative annotation: N/A; putative formula: C7H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017218164","spectrum_index":6058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 201.2 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.39,"smiles":null,"spectrum_id":"CCMSLIB00017218165","spectrum_index":6059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-4,10-Dimethylidene-7-propan-2-ylcyclodec-5-en-1-ol (delta mass: 23.0159 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.206,"smiles":null,"spectrum_id":"CCMSLIB00017218167","spectrum_index":6060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patulin (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.05,"smiles":null,"spectrum_id":"CCMSLIB00017218169","spectrum_index":6061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.06,"smiles":null,"spectrum_id":"CCMSLIB00017218171","spectrum_index":6062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid (delta mass: 226.1689 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.308,"smiles":null,"spectrum_id":"CCMSLIB00017218172","spectrum_index":6063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 298.2871 Da; putative annotation: N/A; putative formula: C19H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.324,"smiles":null,"spectrum_id":"CCMSLIB00017218174","spectrum_index":6064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 17.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.207,"smiles":null,"spectrum_id":"CCMSLIB00017218175","spectrum_index":6065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 156.1008 Da; putative annotation: N/A; putative formula: C6H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.235,"smiles":null,"spectrum_id":"CCMSLIB00017218177","spectrum_index":6066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 123.1404 Da; putative annotation: N/A; putative formula: C9H17NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.222,"smiles":null,"spectrum_id":"CCMSLIB00017218178","spectrum_index":6067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 73.9138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.13,"smiles":null,"spectrum_id":"CCMSLIB00017218180","spectrum_index":6068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 211.1063 Da; putative annotation: N/A; putative formula: C8H13N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.151,"smiles":null,"spectrum_id":"CCMSLIB00017218182","spectrum_index":6069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol (delta mass: 79.957 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.09,"smiles":null,"spectrum_id":"CCMSLIB00017218184","spectrum_index":6070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxycostic acid (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.217,"smiles":null,"spectrum_id":"CCMSLIB00017218185","spectrum_index":6071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 10.0547 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.13,"smiles":null,"spectrum_id":"CCMSLIB00017218186","spectrum_index":6072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid CollisionEnergy:205060 (delta mass: 41.0632 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.113,"smiles":null,"spectrum_id":"CCMSLIB00017218188","spectrum_index":6073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 520.4468 Da; putative annotation: N/A; putative formula: C37H60O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.71,"smiles":null,"spectrum_id":"CCMSLIB00017218191","spectrum_index":6074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002115 Coniine (delta mass: 237.1016 Da; putative annotation: N/A; putative formula: C13H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.245,"smiles":null,"spectrum_id":"CCMSLIB00017218192","spectrum_index":6075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 29.9893 Da; putative annotation: N/A; putative formula: C4H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.07,"smiles":null,"spectrum_id":"CCMSLIB00017218194","spectrum_index":6076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6,7,8-Tetrahydro-2(1H)-quinolinone (delta mass: 88.0174 Da; putative annotation: N/A; putative formula: C4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.109,"smiles":null,"spectrum_id":"CCMSLIB00017218195","spectrum_index":6077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Heptyl-4-hydroxyquinoline N-oxide (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.175,"smiles":null,"spectrum_id":"CCMSLIB00017218197","spectrum_index":6078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.144,"smiles":null,"spectrum_id":"CCMSLIB00017218198","spectrum_index":6079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 343.1999 Da; putative annotation: N/A; putative formula: C18H33NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.463,"smiles":null,"spectrum_id":"CCMSLIB00017218200","spectrum_index":6080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomopsidin (delta mass: 136.1255 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017218201","spectrum_index":6081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethylpiperazine (delta mass: 15.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":130.159,"smiles":null,"spectrum_id":"CCMSLIB00017218203","spectrum_index":6082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Hydroxy-4Z,7Z,10Z,14E,16Z,19Z-docosahexaenoic acid (delta mass: 421.2848 Da; putative annotation: N/A; putative formula: C25H35N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.527,"smiles":null,"spectrum_id":"CCMSLIB00017218204","spectrum_index":6083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 348.2553 Da; putative annotation: N/A; putative formula: C16H36N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.503,"smiles":null,"spectrum_id":"CCMSLIB00017218206","spectrum_index":6084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12-Ketodeoxycholic acid from NIST14 (delta mass: 57.0215 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.306,"smiles":null,"spectrum_id":"CCMSLIB00017218208","spectrum_index":6085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 120.021 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.123,"smiles":null,"spectrum_id":"CCMSLIB00017218210","spectrum_index":6086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 77.0627 Da; putative annotation: N/A; putative formula: C6H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.186,"smiles":null,"spectrum_id":"CCMSLIB00017218211","spectrum_index":6087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydroxy-2,6-farnesadien-1-oic acid (delta mass: 144.0421 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.233,"smiles":null,"spectrum_id":"CCMSLIB00017218212","spectrum_index":6088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 99.0898 Da; putative annotation: N/A; putative formula: C3H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.249,"smiles":null,"spectrum_id":"CCMSLIB00017218214","spectrum_index":6089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 169.1469 Da; putative annotation: N/A; putative formula: C10H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.218,"smiles":null,"spectrum_id":"CCMSLIB00017218217","spectrum_index":6090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-8-Methyl-6-nonenoic acid (delta mass: 253.0802 Da; putative annotation: N/A; putative formula: C11H16N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.218,"smiles":null,"spectrum_id":"CCMSLIB00017218218","spectrum_index":6091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 291.2055 Da; putative annotation: N/A; putative formula: C15H25N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.354,"smiles":null,"spectrum_id":"CCMSLIB00017218219","spectrum_index":6092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 35.0165 Da; putative annotation: N/A; putative formula: C3HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.082,"smiles":null,"spectrum_id":"CCMSLIB00017218221","spectrum_index":6093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D3 (delta mass: 150.0822 Da; putative annotation: N/A; putative formula: C13H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.424,"smiles":null,"spectrum_id":"CCMSLIB00017218223","spectrum_index":6094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Epoxydihydrogrindelic acid (delta mass: 72.035 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.272,"smiles":null,"spectrum_id":"CCMSLIB00017218225","spectrum_index":6095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 144.0051 Da; putative annotation: N/A; putative formula: C5H4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.055,"smiles":null,"spectrum_id":"CCMSLIB00017218227","spectrum_index":6096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.436,"smiles":null,"spectrum_id":"CCMSLIB00017218228","spectrum_index":6097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,6'-Dihydroxy-5,5'-dimethoxybiphenyl-3,3'-dicarboxylic acid (delta mass: 9.9771 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.053,"smiles":null,"spectrum_id":"CCMSLIB00017218230","spectrum_index":6098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 253.1522 Da; putative annotation: N/A; putative formula: C14H25NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.191,"smiles":null,"spectrum_id":"CCMSLIB00017218232","spectrum_index":6099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 118.0782 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.279,"smiles":null,"spectrum_id":"CCMSLIB00017218234","spectrum_index":6100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arthrobactin (delta mass: 952.4935 Da; putative annotation: N/A; putative formula: C51H72N2O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1429.75,"smiles":null,"spectrum_id":"CCMSLIB00017218235","spectrum_index":6101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Tyr (delta mass: 71.0735 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.207,"smiles":null,"spectrum_id":"CCMSLIB00017218237","spectrum_index":6102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 60.0355 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.262,"smiles":null,"spectrum_id":"CCMSLIB00017218239","spectrum_index":6103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Pro (delta mass: 285.1124 Da; putative annotation: N/A; putative formula: C16H11N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.242,"smiles":null,"spectrum_id":"CCMSLIB00017218241","spectrum_index":6104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 219.0734 Da; putative annotation: N/A; putative formula: C12H15NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.14,"smiles":null,"spectrum_id":"CCMSLIB00017218242","spectrum_index":6105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 194.0844 Da; putative annotation: N/A; putative formula: C13H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.29,"smiles":null,"spectrum_id":"CCMSLIB00017218243","spectrum_index":6106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169769-02_C15H22O2_2-Naphthaleneacetic acid, 1,2,3,5,6,7,8,8a-octahydro-8,8a-dimethyl-alpha-methylene-, (2R,8S,8aR)- (delta mass: 144.0422 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.211,"smiles":null,"spectrum_id":"CCMSLIB00017218245","spectrum_index":6107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7-Triazacyclononane (delta mass: 101.9735 Da; putative annotation: N/A; putative formula: H-1N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.107,"smiles":null,"spectrum_id":"CCMSLIB00017218248","spectrum_index":6108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 10.0383 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.065,"smiles":null,"spectrum_id":"CCMSLIB00017218249","spectrum_index":6109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 40.0 eV (delta mass: 499.4021 Da; putative annotation: N/A; putative formula: C32H53NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.489,"smiles":null,"spectrum_id":"CCMSLIB00017218250","spectrum_index":6110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 45.094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.159,"smiles":null,"spectrum_id":"CCMSLIB00017218252","spectrum_index":6111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 105.044 Da; putative annotation: N/A; putative formula: C4H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.273,"smiles":null,"spectrum_id":"CCMSLIB00017218254","spectrum_index":6112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 204.0744 Da; putative annotation: N/A; putative formula: C7H12N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.28,"smiles":null,"spectrum_id":"CCMSLIB00017218255","spectrum_index":6113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 78.0309 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.31,"smiles":null,"spectrum_id":"CCMSLIB00017218256","spectrum_index":6114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ricinoleic acid methyl ester (delta mass: 171.1254 Da; putative annotation: N/A; putative formula: C9H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.399,"smiles":null,"spectrum_id":"CCMSLIB00017218258","spectrum_index":6115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 67.0634 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.306,"smiles":null,"spectrum_id":"CCMSLIB00017218260","spectrum_index":6116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.134,"smiles":null,"spectrum_id":"CCMSLIB00017218262","spectrum_index":6117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid CollisionEnergy:102040 (delta mass: 34.9912 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.093,"smiles":null,"spectrum_id":"CCMSLIB00017218263","spectrum_index":6118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 105.0641 Da; putative annotation: N/A; putative formula: CH7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.128,"smiles":null,"spectrum_id":"CCMSLIB00017218265","spectrum_index":6119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.07,"smiles":null,"spectrum_id":"CCMSLIB00017218267","spectrum_index":6120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 108.032 Da; putative annotation: N/A; putative formula: C5H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.092,"smiles":null,"spectrum_id":"CCMSLIB00017218269","spectrum_index":6121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentanedioic acid, 3-(1E)-1-propen-1-yl- (delta mass: 75.0319 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017218271","spectrum_index":6122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 299.0822 Da; putative annotation: N/A; putative formula: C15H14N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.163,"smiles":null,"spectrum_id":"CCMSLIB00017218272","spectrum_index":6123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:102040 (delta mass: 334.059 Da; putative annotation: N/A; putative formula: C18H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.103,"smiles":null,"spectrum_id":"CCMSLIB00017218274","spectrum_index":6124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 535.2323 Da; putative annotation: N/A; putative formula: C22H33N9O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.304,"smiles":null,"spectrum_id":"CCMSLIB00017218277","spectrum_index":6125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 15.9807 Da; putative annotation: N/A; putative formula: O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.057,"smiles":null,"spectrum_id":"CCMSLIB00017218278","spectrum_index":6126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenoxy-N-(2-pyridinylmethyl)benzamide (delta mass: 198.0827 Da; putative annotation: N/A; putative formula: C9H14N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.211,"smiles":null,"spectrum_id":"CCMSLIB00017218279","spectrum_index":6127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 90.0384 Da; putative annotation: N/A; putative formula: CH6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.177,"smiles":null,"spectrum_id":"CCMSLIB00017218281","spectrum_index":6128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 548.3438 Da; putative annotation: N/A; putative formula: C27H56N4O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.56,"smiles":null,"spectrum_id":"CCMSLIB00017218283","spectrum_index":6129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 56.0252 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.184,"smiles":null,"spectrum_id":"CCMSLIB00017218284","spectrum_index":6130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 86.056 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.246,"smiles":null,"spectrum_id":"CCMSLIB00017218285","spectrum_index":6131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethylbenzoic acid (delta mass: 31.0056 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017218288","spectrum_index":6132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 189.9758 Da; putative annotation: N/A; putative formula: C6H6O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.053,"smiles":null,"spectrum_id":"CCMSLIB00017218290","spectrum_index":6133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 46.0058 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.076,"smiles":null,"spectrum_id":"CCMSLIB00017218291","spectrum_index":6134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 24.9948 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.097,"smiles":null,"spectrum_id":"CCMSLIB00017218292","spectrum_index":6135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 282.0053 Da; putative annotation: N/A; putative formula: C9H14O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.065,"smiles":null,"spectrum_id":"CCMSLIB00017218293","spectrum_index":6136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 63.9983 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.115,"smiles":null,"spectrum_id":"CCMSLIB00017218297","spectrum_index":6137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-tetrahydro-6-methoxy-1-oxo-beta-carboline (delta mass: 45.9876 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.085,"smiles":null,"spectrum_id":"CCMSLIB00017218298","spectrum_index":6138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 152.0998 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.176,"smiles":null,"spectrum_id":"CCMSLIB00017218299","spectrum_index":6139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 326.2241 Da; putative annotation: N/A; putative formula: C22H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.32,"smiles":null,"spectrum_id":"CCMSLIB00017218300","spectrum_index":6140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ergocalciferol CollisionEnergy:205060 (delta mass: 377.1527 Da; putative annotation: N/A; putative formula: C25H19N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.499,"smiles":null,"spectrum_id":"CCMSLIB00017218303","spectrum_index":6141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 56.0267 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.285,"smiles":null,"spectrum_id":"CCMSLIB00017218305","spectrum_index":6142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 36.037 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017218306","spectrum_index":6143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Limaprost (delta mass: 52.0683 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017218307","spectrum_index":6144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 332.0902 Da; putative annotation: N/A; putative formula: C9H22N2O7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.138,"smiles":null,"spectrum_id":"CCMSLIB00017218309","spectrum_index":6145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 180.0632 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.342,"smiles":null,"spectrum_id":"CCMSLIB00017218311","spectrum_index":6146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 198.0743 Da; putative annotation: N/A; putative formula: C9H15N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.337,"smiles":null,"spectrum_id":"CCMSLIB00017218312","spectrum_index":6147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenylacetic acid (delta mass: 120.0608 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.142,"smiles":null,"spectrum_id":"CCMSLIB00017218314","spectrum_index":6148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Keto-1-methyl-3H-imidazo[4,5-b]pyridin-6-yl)benzamide (delta mass: 43.9957 Da; putative annotation: N/A; putative formula: HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.099,"smiles":null,"spectrum_id":"CCMSLIB00017218316","spectrum_index":6149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Methyladenine (delta mass: 135.0583 Da; putative annotation: N/A; putative formula: C2H9N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.136,"smiles":null,"spectrum_id":"CCMSLIB00017218318","spectrum_index":6150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 132.0212 Da; putative annotation: N/A; putative formula: C8H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.108,"smiles":null,"spectrum_id":"CCMSLIB00017218319","spectrum_index":6151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 434.2409 Da; putative annotation: N/A; putative formula: C25H39O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.52,"smiles":null,"spectrum_id":"CCMSLIB00017218321","spectrum_index":6152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 17.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017218322","spectrum_index":6153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethylselegiline (delta mass: 84.0211 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.149,"smiles":null,"spectrum_id":"CCMSLIB00017218325","spectrum_index":6154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 26.9992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.091,"smiles":null,"spectrum_id":"CCMSLIB00017218326","spectrum_index":6155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 363.1326 Da; putative annotation: N/A; putative formula: C19H25NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.193,"smiles":null,"spectrum_id":"CCMSLIB00017218327","spectrum_index":6156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 262.231 Da; putative annotation: Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.4,"smiles":null,"spectrum_id":"CCMSLIB00017218329","spectrum_index":6157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 163.0633 Da; putative annotation: Massbank:CE000225 Tyrosine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.187,"smiles":null,"spectrum_id":"CCMSLIB00017218332","spectrum_index":6158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 310.2506 Da; putative annotation: Avocadene acetate; putative formula: C19H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.514,"smiles":null,"spectrum_id":"CCMSLIB00017218333","spectrum_index":6159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 103.0628 Da; putative annotation: Tris(hydroxymethyl)aminomethane; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.239,"smiles":null,"spectrum_id":"CCMSLIB00017218335","spectrum_index":6160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 30.0 eV (delta mass: 648.2112 Da; putative annotation: Maltotetraose; putative formula: C24H40O20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":991.335,"smiles":null,"spectrum_id":"CCMSLIB00017218337","spectrum_index":6161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 260.2139 Da; putative annotation: Massbank:RP014302 gamma-Linolenic acid|(6Z,9Z,12Z)-octadeca-6,9,12-trienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.456,"smiles":null,"spectrum_id":"CCMSLIB00017218339","spectrum_index":6162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 132.0416 Da; putative annotation: D-Lyxose; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.097,"smiles":null,"spectrum_id":"CCMSLIB00017218340","spectrum_index":6163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 132.0936 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.305,"smiles":null,"spectrum_id":"CCMSLIB00017218342","spectrum_index":6164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 286.1944 Da; putative annotation: 16-Oxoandrostenediol; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.437,"smiles":null,"spectrum_id":"CCMSLIB00017218344","spectrum_index":6165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 264.2455 Da; putative annotation: trans-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.493,"smiles":null,"spectrum_id":"CCMSLIB00017218346","spectrum_index":6166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 264.2474 Da; putative annotation: trans-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.5,"smiles":null,"spectrum_id":"CCMSLIB00017218347","spectrum_index":6167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Glu (delta mass: 67.078 Da; putative annotation: 2-Methylpyrrolidine; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.223,"smiles":null,"spectrum_id":"CCMSLIB00017218350","spectrum_index":6168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 350.2456 Da; putative annotation: Misoprostol (free acid); putative formula: C21H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.493,"smiles":null,"spectrum_id":"CCMSLIB00017218352","spectrum_index":6169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 276.2085 Da; putative annotation: 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid; putative formula: C18H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.451,"smiles":null,"spectrum_id":"CCMSLIB00017218353","spectrum_index":6170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 164.1572 Da; putative annotation: 1-(3,3-Dimethylbicyclo[2.2.1]hept-2-yl)-1-propanol; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.457,"smiles":null,"spectrum_id":"CCMSLIB00017218354","spectrum_index":6171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucose-1-phosphate (delta mass: 144.0401 Da; putative annotation: Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.077,"smiles":null,"spectrum_id":"CCMSLIB00017218356","spectrum_index":6172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimelic acid (delta mass: 114.0681 Da; putative annotation: 6-Hydroxycaproic acid; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.149,"smiles":null,"spectrum_id":"CCMSLIB00017218359","spectrum_index":6173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369609 Salicylic acid|2-hydroxybenzoic acid (delta mass: 93.0576 Da; putative annotation: 2-(2-Furyl)ethanamine; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.097,"smiles":null,"spectrum_id":"CCMSLIB00017218360","spectrum_index":6174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 309.267 Da; putative annotation: Gly-C17:0; putative formula: C19H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.53,"smiles":null,"spectrum_id":"CCMSLIB00017218361","spectrum_index":6175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 206.0483 Da; putative annotation: Phenanzine-1-carboxylic acid; putative formula: C13H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.129,"smiles":null,"spectrum_id":"CCMSLIB00017218363","spectrum_index":6176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 135.0685 Da; putative annotation: OCTOPAMINE; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.192,"smiles":null,"spectrum_id":"CCMSLIB00017218365","spectrum_index":6177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 195.0888 Da; putative annotation: (-)-.alpha.-Kainic acid; putative formula: C10H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.279,"smiles":null,"spectrum_id":"CCMSLIB00017218367","spectrum_index":6178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 197.089 Da; putative annotation: (+)-Camphorsultam; putative formula: C10H15NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.222,"smiles":null,"spectrum_id":"CCMSLIB00017218369","spectrum_index":6179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 293.0487 Da; putative annotation: N/A; putative formula: C10H16NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.14,"smiles":null,"spectrum_id":"CCMSLIB00017218370","spectrum_index":6180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 69.0421 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.379,"smiles":null,"spectrum_id":"CCMSLIB00017218371","spectrum_index":6181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP030401 ?-linolenic acid|linolenic acid|(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid (delta mass: 54.0317 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.264,"smiles":null,"spectrum_id":"CCMSLIB00017218374","spectrum_index":6182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 110.0516 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.175,"smiles":null,"spectrum_id":"CCMSLIB00017218376","spectrum_index":6183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arthrobactin (delta mass: 493.2737 Da; putative annotation: N/A; putative formula: C25H35N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":970.529,"smiles":null,"spectrum_id":"CCMSLIB00017218377","spectrum_index":6184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 55.0345 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.266,"smiles":null,"spectrum_id":"CCMSLIB00017218378","spectrum_index":6185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 35.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.404,"smiles":null,"spectrum_id":"CCMSLIB00017218381","spectrum_index":6186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 179.0793 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.203,"smiles":null,"spectrum_id":"CCMSLIB00017218383","spectrum_index":6187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 77.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.264,"smiles":null,"spectrum_id":"CCMSLIB00017218384","spectrum_index":6188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 9.9842 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.076,"smiles":null,"spectrum_id":"CCMSLIB00017218385","spectrum_index":6189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 23.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.122,"smiles":null,"spectrum_id":"CCMSLIB00017218388","spectrum_index":6190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chelidonin (delta mass: 132.0583 Da; putative annotation: N/A; putative formula: C2H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.192,"smiles":null,"spectrum_id":"CCMSLIB00017218390","spectrum_index":6191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 70.0784 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.18,"smiles":null,"spectrum_id":"CCMSLIB00017218391","spectrum_index":6192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 78.0831 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.326,"smiles":null,"spectrum_id":"CCMSLIB00017218392","spectrum_index":6193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyadamantan-1-carboxylic acid (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.144,"smiles":null,"spectrum_id":"CCMSLIB00017218394","spectrum_index":6194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine, 2-(diphenylmethyl)-, (2S)- (delta mass: 557.2239 Da; putative annotation: N/A; putative formula: C22H40NO13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.383,"smiles":null,"spectrum_id":"CCMSLIB00017218397","spectrum_index":6195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.-Hydroxyetiocholanolone (delta mass: 60.0368 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.264,"smiles":null,"spectrum_id":"CCMSLIB00017218398","spectrum_index":6196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[3-(2-(3-pyridyl)piperidyl)prop-1-ynyl]cycloheptan-1-ol CollisionEnergy:102040 (delta mass: 17.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.264,"smiles":null,"spectrum_id":"CCMSLIB00017218399","spectrum_index":6197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 13.0306 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.133,"smiles":null,"spectrum_id":"CCMSLIB00017218400","spectrum_index":6198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dioleoyl-sn-glycerol (delta mass: 171.1252 Da; putative annotation: N/A; putative formula: C9H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.67,"smiles":null,"spectrum_id":"CCMSLIB00017218402","spectrum_index":6199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 24.0005 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017218405","spectrum_index":6200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 101.0476 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.123,"smiles":null,"spectrum_id":"CCMSLIB00017218406","spectrum_index":6201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocorticosterone (delta mass: 238.171 Da; putative annotation: N/A; putative formula: C12H23N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.424,"smiles":null,"spectrum_id":"CCMSLIB00017218407","spectrum_index":6202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 84.0579 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.238,"smiles":null,"spectrum_id":"CCMSLIB00017218408","spectrum_index":6203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 95.0471 Da; putative annotation: N/A; putative formula: C4H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.144,"smiles":null,"spectrum_id":"CCMSLIB00017218410","spectrum_index":6204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 191.1519 Da; putative annotation: N/A; putative formula: C10H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.212,"smiles":null,"spectrum_id":"CCMSLIB00017218413","spectrum_index":6205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hautriwaic acid (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.222,"smiles":null,"spectrum_id":"CCMSLIB00017218414","spectrum_index":6206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apomorphine (delta mass: 292.173 Da; putative annotation: N/A; putative formula: C15H24N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.306,"smiles":null,"spectrum_id":"CCMSLIB00017218415","spectrum_index":6207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 49.0534 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.264,"smiles":null,"spectrum_id":"CCMSLIB00017218417","spectrum_index":6208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 99.0453 Da; putative annotation: N/A; putative formula: C8H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.256,"smiles":null,"spectrum_id":"CCMSLIB00017218420","spectrum_index":6209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cortisol 21-sulfate (delta mass: 94.0881 Da; putative annotation: N/A; putative formula: C6H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.261,"smiles":null,"spectrum_id":"CCMSLIB00017218421","spectrum_index":6210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 102.0792 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.306,"smiles":null,"spectrum_id":"CCMSLIB00017218423","spectrum_index":6211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 222.2348 Da; putative annotation: N/A; putative formula: C16H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.352,"smiles":null,"spectrum_id":"CCMSLIB00017218424","spectrum_index":6212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylcyclohexanol (delta mass: 175.0326 Da; putative annotation: N/A; putative formula: C5H10N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.16,"smiles":null,"spectrum_id":"CCMSLIB00017218426","spectrum_index":6213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 962.3324 Da; putative annotation: N/A; putative formula: C48H54N2O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1272.45,"smiles":null,"spectrum_id":"CCMSLIB00017218428","spectrum_index":6214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Heptynoic acid (delta mass: 273.2668 Da; putative annotation: N/A; putative formula: C12H31N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.342,"smiles":null,"spectrum_id":"CCMSLIB00017218430","spectrum_index":6215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanoic acid, 5-carboxy-1,2,3,4,4a,7,8,8a-octahydro-7-hydroxy-.beta.,1,2,4a-tetramethyl- (delta mass: 240.0595 Da; putative annotation: N/A; putative formula: C6H12N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.292,"smiles":null,"spectrum_id":"CCMSLIB00017218431","spectrum_index":6216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 328.2993 Da; putative annotation: N/A; putative formula: C21H36N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.39,"smiles":null,"spectrum_id":"CCMSLIB00017218433","spectrum_index":6217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180494-03_C42H66O14_1-O-[(3beta,5xi,9xi,18xi)-3-(beta-D-Glucopyranuronosyloxy)-28-oxoolean-12-en-28-yl]-beta-D-glucopyranose (delta mass: 78.0119 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":873.464,"smiles":null,"spectrum_id":"CCMSLIB00017218435","spectrum_index":6218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 204.0627 Da; putative annotation: N/A; putative formula: C12H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.191,"smiles":null,"spectrum_id":"CCMSLIB00017218436","spectrum_index":6219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 276.217 Da; putative annotation: N/A; putative formula: C13H24N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.47,"smiles":null,"spectrum_id":"CCMSLIB00017218437","spectrum_index":6220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 18.0051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.077,"smiles":null,"spectrum_id":"CCMSLIB00017218440","spectrum_index":6221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 128.0587 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.171,"smiles":null,"spectrum_id":"CCMSLIB00017218442","spectrum_index":6222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxohexanedioic acid (delta mass: 11.9956 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.04,"smiles":null,"spectrum_id":"CCMSLIB00017218443","spectrum_index":6223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)propanamide (delta mass: 17.8679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.001,"smiles":null,"spectrum_id":"CCMSLIB00017218444","spectrum_index":6224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 370.1628 Da; putative annotation: N/A; putative formula: C18H26O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.228,"smiles":null,"spectrum_id":"CCMSLIB00017218447","spectrum_index":6225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 392.3081 Da; putative annotation: N/A; putative formula: C28H40O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.421,"smiles":null,"spectrum_id":"CCMSLIB00017218449","spectrum_index":6226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 586.2282 Da; putative annotation: N/A; putative formula: C39H39O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":851.383,"smiles":null,"spectrum_id":"CCMSLIB00017218450","spectrum_index":6227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381317-01!(E)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-methyldec-8-ene-1,3-dione [IIN-based on: CCMSLIB00000846613] (delta mass: 42.0098 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.216,"smiles":null,"spectrum_id":"CCMSLIB00017218451","spectrum_index":6228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)propane-1,2-diol (delta mass: 355.1284 Da; putative annotation: N/A; putative formula: C17H17N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.23,"smiles":null,"spectrum_id":"CCMSLIB00017218453","spectrum_index":6229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cori ester (alpha-anomer) - 30.0 eV (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.063,"smiles":null,"spectrum_id":"CCMSLIB00017218456","spectrum_index":6230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 53.0009 Da; putative annotation: N/A; putative formula: CH-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.243,"smiles":null,"spectrum_id":"CCMSLIB00017218457","spectrum_index":6231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (delta mass: 94.0798 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.634,"smiles":null,"spectrum_id":"CCMSLIB00017218458","spectrum_index":6232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 54.0466 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.258,"smiles":null,"spectrum_id":"CCMSLIB00017218460","spectrum_index":6233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 162.7737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.86,"smiles":null,"spectrum_id":"CCMSLIB00017218463","spectrum_index":6234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Fluoro-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 11.0458 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.144,"smiles":null,"spectrum_id":"CCMSLIB00017218464","spectrum_index":6235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-methoxybenzyl)ethanamine (delta mass: 180.0586 Da; putative annotation: N/A; putative formula: C6H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.203,"smiles":null,"spectrum_id":"CCMSLIB00017218465","spectrum_index":6236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 314.0037 Da; putative annotation: N/A; putative formula: C8H11O11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.09,"smiles":null,"spectrum_id":"CCMSLIB00017218466","spectrum_index":6237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 300.2648 Da; putative annotation: N/A; putative formula: C14H32N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.33,"smiles":null,"spectrum_id":"CCMSLIB00017218469","spectrum_index":6238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 77.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.15,"smiles":null,"spectrum_id":"CCMSLIB00017218471","spectrum_index":6239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 43.0765 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.131,"smiles":null,"spectrum_id":"CCMSLIB00017218472","spectrum_index":6240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 98.0441 Da; putative annotation: N/A; putative formula: H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.109,"smiles":null,"spectrum_id":"CCMSLIB00017218473","spectrum_index":6241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 602.416 Da; putative annotation: N/A; putative formula: C40H58O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.476,"smiles":null,"spectrum_id":"CCMSLIB00017218475","spectrum_index":6242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 294.1468 Da; putative annotation: N/A; putative formula: C16H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.207,"smiles":null,"spectrum_id":"CCMSLIB00017218478","spectrum_index":6243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Trifluoromethyl)-1H-indole-2-carboxylic acid (delta mass: 194.0969 Da; putative annotation: N/A; putative formula: C10H15N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.139,"smiles":null,"spectrum_id":"CCMSLIB00017218479","spectrum_index":6244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 177.0999 Da; putative annotation: N/A; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.354,"smiles":null,"spectrum_id":"CCMSLIB00017218480","spectrum_index":6245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-(2-hydroxypropan-2-yl)oxan-3-ol (delta mass: 78.0462 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.424,"smiles":null,"spectrum_id":"CCMSLIB00017218482","spectrum_index":6246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000516 Indole-3-carbinol|H-indol-3-ylmethanol (delta mass: 46.9243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017218485","spectrum_index":6247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 31.0307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017218486","spectrum_index":6248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 35.008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.36,"smiles":null,"spectrum_id":"CCMSLIB00017218488","spectrum_index":6249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetinic acid (delta mass: 138.0836 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.43,"smiles":null,"spectrum_id":"CCMSLIB00017218490","spectrum_index":6250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 231.0351 Da; putative annotation: N/A; putative formula: C4H5N7O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.137,"smiles":null,"spectrum_id":"CCMSLIB00017218492","spectrum_index":6251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Trp (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.203,"smiles":null,"spectrum_id":"CCMSLIB00017218494","spectrum_index":6252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-formyl-1H-indole-2-carboxylate (delta mass: 48.8569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.938,"smiles":null,"spectrum_id":"CCMSLIB00017218495","spectrum_index":6253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 545.1958 Da; putative annotation: N/A; putative formula: C26H27N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.256,"smiles":null,"spectrum_id":"CCMSLIB00017218497","spectrum_index":6254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 836.4119 Da; putative annotation: N/A; putative formula: C47H60N6O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1163.54,"smiles":null,"spectrum_id":"CCMSLIB00017218500","spectrum_index":6255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR302130 isosakuranetin-7-O-neohesperidoside (delta mass: 611.2126 Da; putative annotation: N/A; putative formula: C31H37N3O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1206.41,"smiles":null,"spectrum_id":"CCMSLIB00017218501","spectrum_index":6256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 359.1431 Da; putative annotation: N/A; putative formula: C15H26N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.267,"smiles":null,"spectrum_id":"CCMSLIB00017218502","spectrum_index":6257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 567.2258 Da; putative annotation: N/A; putative formula: C34H33NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.321,"smiles":null,"spectrum_id":"CCMSLIB00017218505","spectrum_index":6258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .alpha.-Bisabolol from NIST14 (delta mass: 105.0273 Da; putative annotation: N/A; putative formula: C3H9NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.233,"smiles":null,"spectrum_id":"CCMSLIB00017218507","spectrum_index":6259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 74.0364 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017218508","spectrum_index":6260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[4-(Diethylamino)-2-hydroxybenzoyl]benzoic acid (delta mass: 112.1244 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.263,"smiles":null,"spectrum_id":"CCMSLIB00017218509","spectrum_index":6261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 149.1137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.175,"smiles":null,"spectrum_id":"CCMSLIB00017218511","spectrum_index":6262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 242.1523 Da; putative annotation: N/A; putative formula: C14H26O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.249,"smiles":null,"spectrum_id":"CCMSLIB00017218514","spectrum_index":6263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 288.85 Da; putative annotation: N/A; putative formula: C3H4N3O-1PS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.04,"smiles":null,"spectrum_id":"CCMSLIB00017218515","spectrum_index":6264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 278.1281 Da; putative annotation: N/A; putative formula: C19H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.282,"smiles":null,"spectrum_id":"CCMSLIB00017218516","spectrum_index":6265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 123.0491 Da; putative annotation: N/A; putative formula: C7H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.203,"smiles":null,"spectrum_id":"CCMSLIB00017218518","spectrum_index":6266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 113.0118 Da; putative annotation: N/A; putative formula: C4H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.181,"smiles":null,"spectrum_id":"CCMSLIB00017218521","spectrum_index":6267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 428.3152 Da; putative annotation: N/A; putative formula: C25H40N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.563,"smiles":null,"spectrum_id":"CCMSLIB00017218522","spectrum_index":6268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol oxide A (delta mass: 63.9982 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.199,"smiles":null,"spectrum_id":"CCMSLIB00017218523","spectrum_index":6269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 622.3562 Da; putative annotation: N/A; putative formula: C30H54O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.393,"smiles":null,"spectrum_id":"CCMSLIB00017218525","spectrum_index":6270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 42.0468 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.164,"smiles":null,"spectrum_id":"CCMSLIB00017218528","spectrum_index":6271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,8,11,14-Eicosatetraenoic acid, 16-hydroxy-, (5Z,8Z,11Z,14Z,16S)- (delta mass: 383.302 Da; putative annotation: N/A; putative formula: C26H41NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.544,"smiles":null,"spectrum_id":"CCMSLIB00017218529","spectrum_index":6272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Secalonic acid D (SAD)_130002 (delta mass: 638.1593 Da; putative annotation: N/A; putative formula: C33H30N6O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1277.33,"smiles":null,"spectrum_id":"CCMSLIB00017218530","spectrum_index":6273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 147.0693 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.193,"smiles":null,"spectrum_id":"CCMSLIB00017218531","spectrum_index":6274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (Vitamin B7) (delta mass: 50.0336 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.129,"smiles":null,"spectrum_id":"CCMSLIB00017218533","spectrum_index":6275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301340 Ethylbeta-carboline (delta mass: 25.9576 Da; putative annotation: N/A; putative formula: C6H10N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.065,"smiles":null,"spectrum_id":"CCMSLIB00017218536","spectrum_index":6276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 241.2769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.531,"smiles":null,"spectrum_id":"CCMSLIB00017218537","spectrum_index":6277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Saponarin (delta mass: 104.0262 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.192,"smiles":null,"spectrum_id":"CCMSLIB00017218538","spectrum_index":6278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 50.0 eV (delta mass: 58.9893 Da; putative annotation: N/A; putative formula: CH2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.076,"smiles":null,"spectrum_id":"CCMSLIB00017218539","spectrum_index":6279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 100.0742 Da; putative annotation: N/A; putative formula: C3H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.311,"smiles":null,"spectrum_id":"CCMSLIB00017218543","spectrum_index":6280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 135.0532 Da; putative annotation: N/A; putative formula: C4H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.118,"smiles":null,"spectrum_id":"CCMSLIB00017218544","spectrum_index":6281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 275.1011 Da; putative annotation: N/A; putative formula: C14H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.182,"smiles":null,"spectrum_id":"CCMSLIB00017218545","spectrum_index":6282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 54.036 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.331,"smiles":null,"spectrum_id":"CCMSLIB00017218547","spectrum_index":6283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 51.0763 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.152,"smiles":null,"spectrum_id":"CCMSLIB00017218549","spectrum_index":6284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methylphenyl)azepane (delta mass: 104.06 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.219,"smiles":null,"spectrum_id":"CCMSLIB00017218551","spectrum_index":6285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Genipin (delta mass: 435.3194 Da; putative annotation: N/A; putative formula: C22H45NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.411,"smiles":null,"spectrum_id":"CCMSLIB00017218552","spectrum_index":6286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Sitosterol (delta mass: 558.4673 Da; putative annotation: N/A; putative formula: C33H66O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.861,"smiles":null,"spectrum_id":"CCMSLIB00017218553","spectrum_index":6287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 720.734 Da; putative annotation: N/A; putative formula: C44H92N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1225.91,"smiles":null,"spectrum_id":"CCMSLIB00017218555","spectrum_index":6288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anemosapogenin (delta mass: 120.023 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.385,"smiles":null,"spectrum_id":"CCMSLIB00017218557","spectrum_index":6289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Docosenoic acid (delta mass: 94.0776 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.403,"smiles":null,"spectrum_id":"CCMSLIB00017218558","spectrum_index":6290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 96.9677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.07,"smiles":null,"spectrum_id":"CCMSLIB00017218560","spectrum_index":6291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentobarbital (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.17,"smiles":null,"spectrum_id":"CCMSLIB00017218561","spectrum_index":6292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 325.298 Da; putative annotation: N/A; putative formula: C20H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.561,"smiles":null,"spectrum_id":"CCMSLIB00017218564","spectrum_index":6293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017218565","spectrum_index":6294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 64.0676 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.191,"smiles":null,"spectrum_id":"CCMSLIB00017218567","spectrum_index":6295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 163.0848 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.339,"smiles":null,"spectrum_id":"CCMSLIB00017218569","spectrum_index":6296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of haplamine (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017218571","spectrum_index":6297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 60.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017218572","spectrum_index":6298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 525.3737 Da; putative annotation: N/A; putative formula: C33H52NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":978.71,"smiles":null,"spectrum_id":"CCMSLIB00017218574","spectrum_index":6299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 146.1669 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.242,"smiles":null,"spectrum_id":"CCMSLIB00017218577","spectrum_index":6300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385097-01_C20H22O9_beta-D-Glucopyranoside, 4-hydroxy-2-(hydroxymethyl)phenyl, 6-benzoate (delta mass: 261.0999 Da; putative annotation: N/A; putative formula: C14H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.234,"smiles":null,"spectrum_id":"CCMSLIB00017218578","spectrum_index":6301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 40.0309 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017218580","spectrum_index":6302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 195.1627 Da; putative annotation: N/A; putative formula: C12H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.447,"smiles":null,"spectrum_id":"CCMSLIB00017218582","spectrum_index":6303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 61.9903 Da; putative annotation: N/A; putative formula: C3H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.118,"smiles":null,"spectrum_id":"CCMSLIB00017218584","spectrum_index":6304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Pro (delta mass: 97.0534 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.167,"smiles":null,"spectrum_id":"CCMSLIB00017218586","spectrum_index":6305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 46.924 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017218587","spectrum_index":6306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 13.9427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017218589","spectrum_index":6307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 30.9946 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.102,"smiles":null,"spectrum_id":"CCMSLIB00017218590","spectrum_index":6308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 232.0695 Da; putative annotation: N/A; putative formula: C8H12N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.171,"smiles":null,"spectrum_id":"CCMSLIB00017218592","spectrum_index":6309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4a-Dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 26.0157 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.222,"smiles":null,"spectrum_id":"CCMSLIB00017218593","spectrum_index":6310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.144,"smiles":null,"spectrum_id":"CCMSLIB00017218595","spectrum_index":6311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 157.0372 Da; putative annotation: N/A; putative formula: C6H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.124,"smiles":null,"spectrum_id":"CCMSLIB00017218597","spectrum_index":6312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 147.0178 Da; putative annotation: N/A; putative formula: C5H9NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.12,"smiles":null,"spectrum_id":"CCMSLIB00017218599","spectrum_index":6313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(2-Nitrophenyl)-1,4-butanediamine (delta mass: 77.0544 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.178,"smiles":null,"spectrum_id":"CCMSLIB00017218601","spectrum_index":6314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 18.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.15,"smiles":null,"spectrum_id":"CCMSLIB00017218602","spectrum_index":6315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 588.2386 Da; putative annotation: N/A; putative formula: C36H28N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.361,"smiles":null,"spectrum_id":"CCMSLIB00017218604","spectrum_index":6316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 153.0428 Da; putative annotation: N/A; putative formula: C7H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.098,"smiles":null,"spectrum_id":"CCMSLIB00017218607","spectrum_index":6317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 918.3982 Da; putative annotation: N/A; putative formula: C57H58O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1177.52,"smiles":null,"spectrum_id":"CCMSLIB00017218608","spectrum_index":6318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-myo-Inositol-1-phosphate (delta mass: 326.3186 Da; putative annotation: N/A; putative formula: C21H42O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.356,"smiles":null,"spectrum_id":"CCMSLIB00017218610","spectrum_index":6319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 69.0092 Da; putative annotation: N/A; putative formula: H-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.085,"smiles":null,"spectrum_id":"CCMSLIB00017218611","spectrum_index":6320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 34.0549 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.135,"smiles":null,"spectrum_id":"CCMSLIB00017218614","spectrum_index":6321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.044,"smiles":null,"spectrum_id":"CCMSLIB00017218615","spectrum_index":6322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 174.0297 Da; putative annotation: N/A; putative formula: C6H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.09,"smiles":null,"spectrum_id":"CCMSLIB00017218617","spectrum_index":6323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 104.0658 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.272,"smiles":null,"spectrum_id":"CCMSLIB00017218618","spectrum_index":6324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 162.1009 Da; putative annotation: N/A; putative formula: C6H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.182,"smiles":null,"spectrum_id":"CCMSLIB00017218621","spectrum_index":6325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 56.0269 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.264,"smiles":null,"spectrum_id":"CCMSLIB00017218623","spectrum_index":6326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 60.0733 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.121,"smiles":null,"spectrum_id":"CCMSLIB00017218624","spectrum_index":6327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 338.176 Da; putative annotation: N/A; putative formula: C17H27N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.294,"smiles":null,"spectrum_id":"CCMSLIB00017218625","spectrum_index":6328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 440.2446 Da; putative annotation: N/A; putative formula: C24H44O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.362,"smiles":null,"spectrum_id":"CCMSLIB00017218628","spectrum_index":6329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 74.056 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.142,"smiles":null,"spectrum_id":"CCMSLIB00017218629","spectrum_index":6330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 97.0381 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.254,"smiles":null,"spectrum_id":"CCMSLIB00017218630","spectrum_index":6331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 296.2332 Da; putative annotation: N/A; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.465,"smiles":null,"spectrum_id":"CCMSLIB00017218631","spectrum_index":6332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroquinone (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.055,"smiles":null,"spectrum_id":"CCMSLIB00017218635","spectrum_index":6333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine (delta mass: 81.9725 Da; putative annotation: N/A; putative formula: C2H-1N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.236,"smiles":null,"spectrum_id":"CCMSLIB00017218636","spectrum_index":6334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 180.0789 Da; putative annotation: N/A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.176,"smiles":null,"spectrum_id":"CCMSLIB00017218637","spectrum_index":6335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Acetyl-L-serine (delta mass: 57.0213 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.082,"smiles":null,"spectrum_id":"CCMSLIB00017218638","spectrum_index":6336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 121.0892 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.186,"smiles":null,"spectrum_id":"CCMSLIB00017218639","spectrum_index":6337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 265.3137 Da; putative annotation: N/A; putative formula: C19H39NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.426,"smiles":null,"spectrum_id":"CCMSLIB00017218643","spectrum_index":6338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-.beta.,2,5,5,8a-pentamethyl-3-oxo-, (8aS)- (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017218644","spectrum_index":6339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 154.0029 Da; putative annotation: N/A; putative formula: C6H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.517,"smiles":null,"spectrum_id":"CCMSLIB00017218645","spectrum_index":6340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-C10:0 (delta mass: 52.0676 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.248,"smiles":null,"spectrum_id":"CCMSLIB00017218646","spectrum_index":6341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 848.3929 Da; putative annotation: N/A; putative formula: C39H52N12O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1127.49,"smiles":null,"spectrum_id":"CCMSLIB00017218649","spectrum_index":6342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 508.2705 Da; putative annotation: N/A; putative formula: C24H44O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.544,"smiles":null,"spectrum_id":"CCMSLIB00017218650","spectrum_index":6343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.07,"smiles":null,"spectrum_id":"CCMSLIB00017218652","spectrum_index":6344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 38.0527 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.134,"smiles":null,"spectrum_id":"CCMSLIB00017218653","spectrum_index":6345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 113.0844 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.186,"smiles":null,"spectrum_id":"CCMSLIB00017218655","spectrum_index":6346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.05,"smiles":null,"spectrum_id":"CCMSLIB00017218656","spectrum_index":6347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.062,"smiles":null,"spectrum_id":"CCMSLIB00017218659","spectrum_index":6348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300024 Voacristine (delta mass: 141.0802 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.292,"smiles":null,"spectrum_id":"CCMSLIB00017218661","spectrum_index":6349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 133.028 Da; putative annotation: N/A; putative formula: C6H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.13,"smiles":null,"spectrum_id":"CCMSLIB00017218662","spectrum_index":6350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 511.3152 Da; putative annotation: N/A; putative formula: C28H49NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.375,"smiles":null,"spectrum_id":"CCMSLIB00017218663","spectrum_index":6351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 42.0099 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017218664","spectrum_index":6352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 457.1668 Da; putative annotation: N/A; putative formula: C25H24N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.208,"smiles":null,"spectrum_id":"CCMSLIB00017218668","spectrum_index":6353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 30.0 eV (delta mass: 448.245 Da; putative annotation: N/A; putative formula: C19H37N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.369,"smiles":null,"spectrum_id":"CCMSLIB00017218669","spectrum_index":6354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-Gentiobiose (delta mass: 448.2419 Da; putative annotation: N/A; putative formula: C18H24N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.365,"smiles":null,"spectrum_id":"CCMSLIB00017218670","spectrum_index":6355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 41.9087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017218671","spectrum_index":6356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 113.0958 Da; putative annotation: N/A; putative formula: C5H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.198,"smiles":null,"spectrum_id":"CCMSLIB00017218672","spectrum_index":6357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 268.0355 Da; putative annotation: N/A; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.122,"smiles":null,"spectrum_id":"CCMSLIB00017218676","spectrum_index":6358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 320.2707 Da; putative annotation: N/A; putative formula: C21H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.311,"smiles":null,"spectrum_id":"CCMSLIB00017218677","spectrum_index":6359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 92.0637 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.243,"smiles":null,"spectrum_id":"CCMSLIB00017218678","spectrum_index":6360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid (delta mass: 40.0314 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017218679","spectrum_index":6361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM836501 Morpholine|Morpholin (delta mass: 86.037 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.113,"smiles":null,"spectrum_id":"CCMSLIB00017218681","spectrum_index":6362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 46.2056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.286,"smiles":null,"spectrum_id":"CCMSLIB00017218684","spectrum_index":6363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 74.0766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.173,"smiles":null,"spectrum_id":"CCMSLIB00017218685","spectrum_index":6364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 94.0088 Da; putative annotation: N/A; putative formula: C4H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.079,"smiles":null,"spectrum_id":"CCMSLIB00017218686","spectrum_index":6365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 357.1424 Da; putative annotation: N/A; putative formula: C16H23NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.223,"smiles":null,"spectrum_id":"CCMSLIB00017218688","spectrum_index":6366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Butyl-3,5-dinitrobenzamide (delta mass: 91.0531 Da; putative annotation: N/A; putative formula: C5H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.146,"smiles":null,"spectrum_id":"CCMSLIB00017218691","spectrum_index":6367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 77.0477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017218692","spectrum_index":6368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 164.0478 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.181,"smiles":null,"spectrum_id":"CCMSLIB00017218693","spectrum_index":6369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Dec-9-enylpentanedioic acid (delta mass: 74.056 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.246,"smiles":null,"spectrum_id":"CCMSLIB00017218695","spectrum_index":6370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 82.0262 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017218698","spectrum_index":6371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 130.1017 Da; putative annotation: N/A; putative formula: C6H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.24,"smiles":null,"spectrum_id":"CCMSLIB00017218699","spectrum_index":6372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 17.3429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.857,"smiles":null,"spectrum_id":"CCMSLIB00017218701","spectrum_index":6373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thuggacin A (delta mass: 482.8733 Da; putative annotation: N/A; putative formula: C17H9NO2S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1115.23,"smiles":null,"spectrum_id":"CCMSLIB00017218702","spectrum_index":6374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 27.9956 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017218703","spectrum_index":6375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 591.2165 Da; putative annotation: N/A; putative formula: C31H29N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.297,"smiles":null,"spectrum_id":"CCMSLIB00017218706","spectrum_index":6376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Minoxidil from NIST14 (delta mass: 27.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.208,"smiles":null,"spectrum_id":"CCMSLIB00017218708","spectrum_index":6377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 44.0264 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017218709","spectrum_index":6378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 27.0004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.17,"smiles":null,"spectrum_id":"CCMSLIB00017218711","spectrum_index":6379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Pro (delta mass: 43.0054 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.144,"smiles":null,"spectrum_id":"CCMSLIB00017218713","spectrum_index":6380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 56.9935 Da; putative annotation: N/A; putative formula: H-1N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.116,"smiles":null,"spectrum_id":"CCMSLIB00017218715","spectrum_index":6381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 391.1758 Da; putative annotation: N/A; putative formula: C28H25NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.293,"smiles":null,"spectrum_id":"CCMSLIB00017218716","spectrum_index":6382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 354.3515 Da; putative annotation: N/A; putative formula: C23H46O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.464,"smiles":null,"spectrum_id":"CCMSLIB00017218717","spectrum_index":6383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Butenoic acid, 2-ethyl-, (Z)- (delta mass: 615.4557 Da; putative annotation: N/A; putative formula: C43H57N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.531,"smiles":null,"spectrum_id":"CCMSLIB00017218719","spectrum_index":6384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 164.1924 Da; putative annotation: N/A; putative formula: C13H24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.268,"smiles":null,"spectrum_id":"CCMSLIB00017218722","spectrum_index":6385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 192.1149 Da; putative annotation: N/A; putative formula: C12H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.179,"smiles":null,"spectrum_id":"CCMSLIB00017218723","spectrum_index":6386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 657.3923 Da; putative annotation: N/A; putative formula: C35H55N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.463,"smiles":null,"spectrum_id":"CCMSLIB00017218725","spectrum_index":6387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 76.0674 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017218726","spectrum_index":6388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 669.3928 Da; putative annotation: N/A; putative formula: C44H51N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.432,"smiles":null,"spectrum_id":"CCMSLIB00017218727","spectrum_index":6389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.alpha.,9.Xi.)-3-Hydroxyolean-12-en-24-oic acid (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.394,"smiles":null,"spectrum_id":"CCMSLIB00017218730","spectrum_index":6390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Allylphenoxy)acetic acid (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017218732","spectrum_index":6391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 496.0522 Da; putative annotation: N/A; putative formula: C17H20O15S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.143,"smiles":null,"spectrum_id":"CCMSLIB00017218733","spectrum_index":6392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 98.0728 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.127,"smiles":null,"spectrum_id":"CCMSLIB00017218735","spectrum_index":6393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 87.0273 Da; putative annotation: N/A; putative formula: C2H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.103,"smiles":null,"spectrum_id":"CCMSLIB00017218736","spectrum_index":6394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 102.0432 Da; putative annotation: N/A; putative formula: C3H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.145,"smiles":null,"spectrum_id":"CCMSLIB00017218739","spectrum_index":6395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.195,"smiles":null,"spectrum_id":"CCMSLIB00017218740","spectrum_index":6396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 133.0159 Da; putative annotation: N/A; putative formula: C7H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.092,"smiles":null,"spectrum_id":"CCMSLIB00017218741","spectrum_index":6397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 335.1662 Da; putative annotation: N/A; putative formula: C19H22N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.207,"smiles":null,"spectrum_id":"CCMSLIB00017218743","spectrum_index":6398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 425.1547 Da; putative annotation: N/A; putative formula: C17H23N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.241,"smiles":null,"spectrum_id":"CCMSLIB00017218746","spectrum_index":6399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Picrinine (delta mass: 259.2145 Da; putative annotation: N/A; putative formula: C14H29NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.385,"smiles":null,"spectrum_id":"CCMSLIB00017218747","spectrum_index":6400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Hydroxy-4Z,7Z,10Z,14E,16Z,19Z-docosahexaenoic acid (delta mass: 53.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.29,"smiles":null,"spectrum_id":"CCMSLIB00017218748","spectrum_index":6401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydodecanoic acid (delta mass: 212.2145 Da; putative annotation: N/A; putative formula: C14H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.394,"smiles":null,"spectrum_id":"CCMSLIB00017218750","spectrum_index":6402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 498.1737 Da; putative annotation: N/A; putative formula: C23H30O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.244,"smiles":null,"spectrum_id":"CCMSLIB00017218752","spectrum_index":6403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluorotryptamine (delta mass: 62.0195 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.117,"smiles":null,"spectrum_id":"CCMSLIB00017218753","spectrum_index":6404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 61.0133 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017218754","spectrum_index":6405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 123.0891 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.154,"smiles":null,"spectrum_id":"CCMSLIB00017218756","spectrum_index":6406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 196.1612 Da; putative annotation: N/A; putative formula: C16H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.514,"smiles":null,"spectrum_id":"CCMSLIB00017218758","spectrum_index":6407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 98.0372 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.118,"smiles":null,"spectrum_id":"CCMSLIB00017218760","spectrum_index":6408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 1026.4304 Da; putative annotation: N/A; putative formula: C47H66N10O12S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1287.47,"smiles":null,"spectrum_id":"CCMSLIB00017218761","spectrum_index":6409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 78.0466 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017218763","spectrum_index":6410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 66.0462 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.309,"smiles":null,"spectrum_id":"CCMSLIB00017218765","spectrum_index":6411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetradecanedioic acid (delta mass: 76.0669 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.257,"smiles":null,"spectrum_id":"CCMSLIB00017218767","spectrum_index":6412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 38.0152 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017218768","spectrum_index":6413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 94.0486 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.109,"smiles":null,"spectrum_id":"CCMSLIB00017218770","spectrum_index":6414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.097,"smiles":null,"spectrum_id":"CCMSLIB00017218772","spectrum_index":6415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxymethylimidazole (delta mass: 18.0447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":117.1,"smiles":null,"spectrum_id":"CCMSLIB00017218774","spectrum_index":6416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 144.0417 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.17,"smiles":null,"spectrum_id":"CCMSLIB00017218776","spectrum_index":6417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)ethanol (delta mass: 74.0401 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.174,"smiles":null,"spectrum_id":"CCMSLIB00017218778","spectrum_index":6418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 302.0858 Da; putative annotation: N/A; putative formula: C20H15OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.354,"smiles":null,"spectrum_id":"CCMSLIB00017218779","spectrum_index":6419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 649.2409 Da; putative annotation: N/A; putative formula: C22H46N5O11P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1008.56,"smiles":null,"spectrum_id":"CCMSLIB00017218780","spectrum_index":6420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 140.1181 Da; putative annotation: N/A; putative formula: C5H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.246,"smiles":null,"spectrum_id":"CCMSLIB00017218782","spectrum_index":6421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 43.0219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.15,"smiles":null,"spectrum_id":"CCMSLIB00017218783","spectrum_index":6422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 103.0997 Da; putative annotation: N/A; putative formula: CH9N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.316,"smiles":null,"spectrum_id":"CCMSLIB00017218786","spectrum_index":6423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 143.1193 Da; putative annotation: N/A; putative formula: C5H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.226,"smiles":null,"spectrum_id":"CCMSLIB00017218788","spectrum_index":6424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-4-(methoxymethyl)coumarin (delta mass: 160.0548 Da; putative annotation: N/A; putative formula: C9H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.12,"smiles":null,"spectrum_id":"CCMSLIB00017218789","spectrum_index":6425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 145.0935 Da; putative annotation: N/A; putative formula: H7N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.174,"smiles":null,"spectrum_id":"CCMSLIB00017218790","spectrum_index":6426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 119.0758 Da; putative annotation: N/A; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.118,"smiles":null,"spectrum_id":"CCMSLIB00017218793","spectrum_index":6427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylazepane (delta mass: 194.1306 Da; putative annotation: N/A; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.274,"smiles":null,"spectrum_id":"CCMSLIB00017218795","spectrum_index":6428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 183.1621 Da; putative annotation: N/A; putative formula: C11H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.275,"smiles":null,"spectrum_id":"CCMSLIB00017218796","spectrum_index":6429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ358401 2-Phenylpiperidine-2-acetamide|2-phenyl-2-piperidin-2-ylacetamide|2-Phenyl-2-(2-piperidinyl)acetamide (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.16,"smiles":null,"spectrum_id":"CCMSLIB00017218797","spectrum_index":6430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 749.258 Da; putative annotation: N/A; putative formula: C54H31N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.329,"smiles":null,"spectrum_id":"CCMSLIB00017218800","spectrum_index":6431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 78.0198 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.116,"smiles":null,"spectrum_id":"CCMSLIB00017218802","spectrum_index":6432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 88.0719 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.33,"smiles":null,"spectrum_id":"CCMSLIB00017218803","spectrum_index":6433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 130.1148 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.383,"smiles":null,"spectrum_id":"CCMSLIB00017218805","spectrum_index":6434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 99.9833 Da; putative annotation: N/A; putative formula: C2HN2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.09,"smiles":null,"spectrum_id":"CCMSLIB00017218807","spectrum_index":6435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 40.0036 Da; putative annotation: N/A; putative formula: CN2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.116,"smiles":null,"spectrum_id":"CCMSLIB00017218808","spectrum_index":6436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 129.0424 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.149,"smiles":null,"spectrum_id":"CCMSLIB00017218809","spectrum_index":6437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 547.9966 Da; putative annotation: N/A; putative formula: C30H16N2O-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.094,"smiles":null,"spectrum_id":"CCMSLIB00017218811","spectrum_index":6438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 54.0103 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017218813","spectrum_index":6439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 174.0536 Da; putative annotation: N/A; putative formula: C8H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.156,"smiles":null,"spectrum_id":"CCMSLIB00017218814","spectrum_index":6440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 69.0539 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.151,"smiles":null,"spectrum_id":"CCMSLIB00017218816","spectrum_index":6441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 198.0605 Da; putative annotation: N/A; putative formula: C13H11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.11,"smiles":null,"spectrum_id":"CCMSLIB00017218817","spectrum_index":6442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyageraphorone (delta mass: 248.0495 Da; putative annotation: N/A; putative formula: C7H13N4O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.234,"smiles":null,"spectrum_id":"CCMSLIB00017218819","spectrum_index":6443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.17,"smiles":null,"spectrum_id":"CCMSLIB00017218821","spectrum_index":6444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 36.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.331,"smiles":null,"spectrum_id":"CCMSLIB00017218823","spectrum_index":6445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 321.1423 Da; putative annotation: N/A; putative formula: C13H23NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.214,"smiles":null,"spectrum_id":"CCMSLIB00017218824","spectrum_index":6446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 82.0634 Da; putative annotation: N/A; putative formula: C3H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.275,"smiles":null,"spectrum_id":"CCMSLIB00017218826","spectrum_index":6447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 342.055 Da; putative annotation: N/A; putative formula: C11H21O6P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.126,"smiles":null,"spectrum_id":"CCMSLIB00017218828","spectrum_index":6448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 361.1894 Da; putative annotation: N/A; putative formula: C21H31NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.313,"smiles":null,"spectrum_id":"CCMSLIB00017218830","spectrum_index":6449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 102.0466 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.206,"smiles":null,"spectrum_id":"CCMSLIB00017218832","spectrum_index":6450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 827.8018 Da; putative annotation: N/A; putative formula: C31H24O-1S14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.852,"smiles":null,"spectrum_id":"CCMSLIB00017218834","spectrum_index":6451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 301.1244 Da; putative annotation: N/A; putative formula: C8H15N9O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.167,"smiles":null,"spectrum_id":"CCMSLIB00017218835","spectrum_index":6452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 1088.5449 Da; putative annotation: N/A; putative formula: C53H84O23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1269.62,"smiles":null,"spectrum_id":"CCMSLIB00017218837","spectrum_index":6453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 163.0638 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.176,"smiles":null,"spectrum_id":"CCMSLIB00017218839","spectrum_index":6454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Methoxy-5H-dibenzo[b,f]azepine (delta mass: 101.053 Da; putative annotation: N/A; putative formula: C3H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.16,"smiles":null,"spectrum_id":"CCMSLIB00017218841","spectrum_index":6455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 57.0217 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.139,"smiles":null,"spectrum_id":"CCMSLIB00017218842","spectrum_index":6456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 64.0166 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.259,"smiles":null,"spectrum_id":"CCMSLIB00017218844","spectrum_index":6457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 199.0843 Da; putative annotation: N/A; putative formula: C9H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.175,"smiles":null,"spectrum_id":"CCMSLIB00017218847","spectrum_index":6458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-hydroxy-3-(hydroxymethyl)pentyl]-8a-(hydroxymethyl)-5,6-dimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid (delta mass: 106.0771 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.325,"smiles":null,"spectrum_id":"CCMSLIB00017218848","spectrum_index":6459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclopropyl-3-pyridinemethanol (delta mass: 9.0006 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.092,"smiles":null,"spectrum_id":"CCMSLIB00017218850","spectrum_index":6460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 205.0949 Da; putative annotation: N/A; putative formula: C8H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.165,"smiles":null,"spectrum_id":"CCMSLIB00017218852","spectrum_index":6461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Chlorophenyl)-2-(2,3-dihydroxy-3H-indol-3-yl)ethanone (delta mass: 146.065 Da; putative annotation: N/A; putative formula: C10H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.123,"smiles":null,"spectrum_id":"CCMSLIB00017218854","spectrum_index":6462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 95.9857 Da; putative annotation: N/A; putative formula: C4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.035,"smiles":null,"spectrum_id":"CCMSLIB00017218855","spectrum_index":6463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 440.1372 Da; putative annotation: N/A; putative formula: C26H20N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.234,"smiles":null,"spectrum_id":"CCMSLIB00017218856","spectrum_index":6464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5_methoxy_tryptophol (delta mass: 147.0325 Da; putative annotation: N/A; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.134,"smiles":null,"spectrum_id":"CCMSLIB00017218857","spectrum_index":6465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 592.1791 Da; putative annotation: N/A; putative formula: C28H32O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.218,"smiles":null,"spectrum_id":"CCMSLIB00017218860","spectrum_index":6466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholesterol (delta mass: 318.0986 Da; putative annotation: N/A; putative formula: C13H23N2OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.461,"smiles":null,"spectrum_id":"CCMSLIB00017218861","spectrum_index":6467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000003 Mellein|Ochracin|8-hydroxy-3-methyl-3,4-dihydroisochromen-1-one (delta mass: 42.011 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.081,"smiles":null,"spectrum_id":"CCMSLIB00017218863","spectrum_index":6468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol oxide A (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.211,"smiles":null,"spectrum_id":"CCMSLIB00017218864","spectrum_index":6469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 145.0736 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.154,"smiles":null,"spectrum_id":"CCMSLIB00017218866","spectrum_index":6470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Chloroacetyl)-3-piperidinecarboxamide (delta mass: 57.0545 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017218867","spectrum_index":6471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 223.2028 Da; putative annotation: N/A; putative formula: C13H25N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.32,"smiles":null,"spectrum_id":"CCMSLIB00017218868","spectrum_index":6472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 152.1013 Da; putative annotation: N/A; putative formula: C10H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.276,"smiles":null,"spectrum_id":"CCMSLIB00017218870","spectrum_index":6473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOATE (delta mass: 8.0413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.091,"smiles":null,"spectrum_id":"CCMSLIB00017218873","spectrum_index":6474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monolaurin (delta mass: 345.2483 Da; putative annotation: N/A; putative formula: C14H31N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.47,"smiles":null,"spectrum_id":"CCMSLIB00017218874","spectrum_index":6475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L_DOPA (delta mass: 27.0837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.16,"smiles":null,"spectrum_id":"CCMSLIB00017218875","spectrum_index":6476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid (delta mass: 47.061 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.126,"smiles":null,"spectrum_id":"CCMSLIB00017218877","spectrum_index":6477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 92.0473 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.128,"smiles":null,"spectrum_id":"CCMSLIB00017218880","spectrum_index":6478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 242.1269 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.175,"smiles":null,"spectrum_id":"CCMSLIB00017218881","spectrum_index":6479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 25.9791 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.216,"smiles":null,"spectrum_id":"CCMSLIB00017218882","spectrum_index":6480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-4(3H)-quinazolinone (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.097,"smiles":null,"spectrum_id":"CCMSLIB00017218884","spectrum_index":6481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 307.1637 Da; putative annotation: N/A; putative formula: C16H26N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.385,"smiles":null,"spectrum_id":"CCMSLIB00017218886","spectrum_index":6482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 246.0533 Da; putative annotation: N/A; putative formula: C8H7N8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.155,"smiles":null,"spectrum_id":"CCMSLIB00017218887","spectrum_index":6483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(9H-Carbazol-9-yl)-3-(4-chlorophenoxy)-2-propanol (delta mass: 325.1002 Da; putative annotation: N/A; putative formula: C24H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.21,"smiles":null,"spectrum_id":"CCMSLIB00017218889","spectrum_index":6484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 188.0798 Da; putative annotation: N/A; putative formula: C7H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.234,"smiles":null,"spectrum_id":"CCMSLIB00017218891","spectrum_index":6485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 103.063 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.154,"smiles":null,"spectrum_id":"CCMSLIB00017218893","spectrum_index":6486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LysoPC(0:0/18:0) (delta mass: 2.8101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.181,"smiles":null,"spectrum_id":"CCMSLIB00017218894","spectrum_index":6487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 342.1296 Da; putative annotation: N/A; putative formula: C13H22N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":935.644,"smiles":null,"spectrum_id":"CCMSLIB00017218895","spectrum_index":6488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017218896","spectrum_index":6489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-(3,4-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 103.0316 Da; putative annotation: N/A; putative formula: CH5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.155,"smiles":null,"spectrum_id":"CCMSLIB00017218900","spectrum_index":6490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 193.0678 Da; putative annotation: N/A; putative formula: C9H11N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.139,"smiles":null,"spectrum_id":"CCMSLIB00017218901","spectrum_index":6491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 176.0279 Da; putative annotation: N/A; putative formula: C4H9N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.14,"smiles":null,"spectrum_id":"CCMSLIB00017218902","spectrum_index":6492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 496.3038 Da; putative annotation: N/A; putative formula: C27H44O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.52,"smiles":null,"spectrum_id":"CCMSLIB00017218903","spectrum_index":6493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one (delta mass: 99.5138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.584,"smiles":null,"spectrum_id":"CCMSLIB00017218904","spectrum_index":6494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 682.2263 Da; putative annotation: N/A; putative formula: C30H35N8O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.307,"smiles":null,"spectrum_id":"CCMSLIB00017218908","spectrum_index":6495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 531.1787 Da; putative annotation: N/A; putative formula: C23H35NO9P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.27,"smiles":null,"spectrum_id":"CCMSLIB00017218909","spectrum_index":6496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycoursodeoxycholic acid (delta mass: 164.1086 Da; putative annotation: N/A; putative formula: C8H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.43,"smiles":null,"spectrum_id":"CCMSLIB00017218910","spectrum_index":6497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-(3-Hydroxy-2,2,5a-trimethyl-7-methylidenedecahydro-1-benzoxepin-6-yl)ethyl)-2,2,5a,7-tetramethyldecahydro-1-benzoxepine-3,4,6-triol (delta mass: 76.0676 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.451,"smiles":null,"spectrum_id":"CCMSLIB00017218911","spectrum_index":6498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 66.0476 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.29,"smiles":null,"spectrum_id":"CCMSLIB00017218912","spectrum_index":6499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 225.1003 Da; putative annotation: N/A; putative formula: C11H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.171,"smiles":null,"spectrum_id":"CCMSLIB00017218916","spectrum_index":6500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 203.1538 Da; putative annotation: N/A; putative formula: C11H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.354,"smiles":null,"spectrum_id":"CCMSLIB00017218917","spectrum_index":6501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-trans-Chrysanthemic acid (delta mass: 95.9822 Da; putative annotation: N/A; putative formula: C4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.104,"smiles":null,"spectrum_id":"CCMSLIB00017218918","spectrum_index":6502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylputrescine; AIF; CE0; CorrDec (delta mass: 268.2038 Da; putative annotation: N/A; putative formula: C16H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.322,"smiles":null,"spectrum_id":"CCMSLIB00017218919","spectrum_index":6503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 126.0891 Da; putative annotation: N/A; putative formula: C5H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.457,"smiles":null,"spectrum_id":"CCMSLIB00017218922","spectrum_index":6504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 156.1346 Da; putative annotation: N/A; putative formula: C10H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.487,"smiles":null,"spectrum_id":"CCMSLIB00017218924","spectrum_index":6505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 39.9951 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.06,"smiles":null,"spectrum_id":"CCMSLIB00017218925","spectrum_index":6506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurane-17,18-dioic acid (delta mass: 112.0628 Da; putative annotation: N/A; putative formula: C5H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.284,"smiles":null,"spectrum_id":"CCMSLIB00017218926","spectrum_index":6507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 114.0835 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.315,"smiles":null,"spectrum_id":"CCMSLIB00017218928","spectrum_index":6508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 84.0322 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.13,"smiles":null,"spectrum_id":"CCMSLIB00017218931","spectrum_index":6509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 281.2687 Da; putative annotation: N/A; putative formula: C14H31N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.36,"smiles":null,"spectrum_id":"CCMSLIB00017218932","spectrum_index":6510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 104.1197 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.232,"smiles":null,"spectrum_id":"CCMSLIB00017218933","spectrum_index":6511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 391.1868 Da; putative annotation: N/A; putative formula: C19H21N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.284,"smiles":null,"spectrum_id":"CCMSLIB00017218934","spectrum_index":6512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Uvaol from NIST14 (delta mass: 136.1188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.507,"smiles":null,"spectrum_id":"CCMSLIB00017218937","spectrum_index":6513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 77.9958 Da; putative annotation: N/A; putative formula: CH2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.066,"smiles":null,"spectrum_id":"CCMSLIB00017218939","spectrum_index":6514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 45.021 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.107,"smiles":null,"spectrum_id":"CCMSLIB00017218940","spectrum_index":6515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydiethyltryptamine (delta mass: 117.0422 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.207,"smiles":null,"spectrum_id":"CCMSLIB00017218941","spectrum_index":6516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 153.8996 Da; putative annotation: N/A; putative formula: CH-2O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.991,"smiles":null,"spectrum_id":"CCMSLIB00017218944","spectrum_index":6517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 46.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.289,"smiles":null,"spectrum_id":"CCMSLIB00017218945","spectrum_index":6518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Muricholic acid (delta mass: 244.1602 Da; putative annotation: N/A; putative formula: C12H24N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.455,"smiles":null,"spectrum_id":"CCMSLIB00017218947","spectrum_index":6519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 191.1074 Da; putative annotation: N/A; putative formula: C8H18NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.188,"smiles":null,"spectrum_id":"CCMSLIB00017218948","spectrum_index":6520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 160.0373 Da; putative annotation: N/A; putative formula: C6H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.202,"smiles":null,"spectrum_id":"CCMSLIB00017218950","spectrum_index":6521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 267.1317 Da; putative annotation: N/A; putative formula: C10H21NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.212,"smiles":null,"spectrum_id":"CCMSLIB00017218952","spectrum_index":6522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 343.1198 Da; putative annotation: N/A; putative formula: C16H18N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.168,"smiles":null,"spectrum_id":"CCMSLIB00017218953","spectrum_index":6523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; LC-tDDA; CE40 (delta mass: 73.0297 Da; putative annotation: N/A; putative formula: C6H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.096,"smiles":null,"spectrum_id":"CCMSLIB00017218954","spectrum_index":6524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9H-Xanthene-4-acetic acid, 5,6-dimethyl-9-oxo- (delta mass: 32.9709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.067,"smiles":null,"spectrum_id":"CCMSLIB00017218956","spectrum_index":6525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 36.9974 Da; putative annotation: N/A; putative formula: C2H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.094,"smiles":null,"spectrum_id":"CCMSLIB00017218959","spectrum_index":6526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 29.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.128,"smiles":null,"spectrum_id":"CCMSLIB00017218960","spectrum_index":6527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 295.1622 Da; putative annotation: N/A; putative formula: C12H25NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.378,"smiles":null,"spectrum_id":"CCMSLIB00017218961","spectrum_index":6528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 312.2406 Da; putative annotation: N/A; putative formula: C19H37O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.332,"smiles":null,"spectrum_id":"CCMSLIB00017218962","spectrum_index":6529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 425.3765 Da; putative annotation: N/A; putative formula: C28H47N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.468,"smiles":null,"spectrum_id":"CCMSLIB00017218966","spectrum_index":6530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Corey lactone diol (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017218967","spectrum_index":6531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-RIBOSE 5-PHOSPHATE (delta mass: 94.017 Da; putative annotation: N/A; putative formula: C4H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.043,"smiles":null,"spectrum_id":"CCMSLIB00017218968","spectrum_index":6532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-6-Hydroxy-3-(1H-imidazol-5-ylmethylidene)-12-methoxy-7a-(2-methylbut-3-en-2-yl)-7a,12-dihydro-1H,5H-imidazo[1',2':1,2]pyrido[2,3-b]indole-2,5(3H)-dione (delta mass: 14.0139 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.196,"smiles":null,"spectrum_id":"CCMSLIB00017218969","spectrum_index":6533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 478.2717 Da; putative annotation: N/A; putative formula: C30H38O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.332,"smiles":null,"spectrum_id":"CCMSLIB00017218970","spectrum_index":6534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.341,"smiles":null,"spectrum_id":"CCMSLIB00017218974","spectrum_index":6535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 292.1275 Da; putative annotation: N/A; putative formula: C13H27OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.188,"smiles":null,"spectrum_id":"CCMSLIB00017218975","spectrum_index":6536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 391.1305 Da; putative annotation: N/A; putative formula: C19H26N3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.264,"smiles":null,"spectrum_id":"CCMSLIB00017218976","spectrum_index":6537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 418.1776 Da; putative annotation: N/A; putative formula: C18H30N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.311,"smiles":null,"spectrum_id":"CCMSLIB00017218977","spectrum_index":6538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 196.0732 Da; putative annotation: N/A; putative formula: C10H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.17,"smiles":null,"spectrum_id":"CCMSLIB00017218980","spectrum_index":6539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 302.2247 Da; putative annotation: 16,17-Dihydroxy-7-kauranone; putative formula: C20H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.353,"smiles":null,"spectrum_id":"CCMSLIB00017218982","spectrum_index":6540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Gly-Phe from NIST14 (delta mass: 147.0691 Da; putative annotation: L-Phenylalanine; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.177,"smiles":null,"spectrum_id":"CCMSLIB00017218983","spectrum_index":6541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 324.1062 Da; putative annotation: .beta.-Gentiobiose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.23,"smiles":null,"spectrum_id":"CCMSLIB00017218984","spectrum_index":6542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Lys from NIST14 (delta mass: 128.095 Da; putative annotation: Massbank:RP001101 L-Lysine; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.292,"smiles":null,"spectrum_id":"CCMSLIB00017218985","spectrum_index":6543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 278.2249 Da; putative annotation: (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.483,"smiles":null,"spectrum_id":"CCMSLIB00017218989","spectrum_index":6544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 324.0883 Da; putative annotation: Caffeic acid 4-O-beta-D-glucopyranoside; putative formula: C15H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.129,"smiles":null,"spectrum_id":"CCMSLIB00017218990","spectrum_index":6545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 294.2562 Da; putative annotation: Ricinoleic acid methyl ester; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.472,"smiles":null,"spectrum_id":"CCMSLIB00017218991","spectrum_index":6546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 125.0477 Da; putative annotation: (2-Oxo-1-pyrrolidinyl)acetic acid; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.186,"smiles":null,"spectrum_id":"CCMSLIB00017218992","spectrum_index":6547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 360.2667 Da; putative annotation: 1-Arachidonoylglycerol; putative formula: C23H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.499,"smiles":null,"spectrum_id":"CCMSLIB00017218995","spectrum_index":6548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 336.2269 Da; putative annotation: NCGC00384809-01!5-[5-hydroxy-3-(hydroxymethyl)pentyl]-8a-(hydroxymethyl)-5,6-dimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid; putative formula: C20H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.454,"smiles":null,"spectrum_id":"CCMSLIB00017218997","spectrum_index":6549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 135.0678 Da; putative annotation: Norphenylephrine; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.102,"smiles":null,"spectrum_id":"CCMSLIB00017218998","spectrum_index":6550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chaulmoogric Acid (delta mass: 334.2127 Da; putative annotation: Prostaglandin K1; putative formula: C20H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.46,"smiles":null,"spectrum_id":"CCMSLIB00017219001","spectrum_index":6551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 346.2507 Da; putative annotation: Acetylimbricatolic acid; putative formula: C22H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.613,"smiles":null,"spectrum_id":"CCMSLIB00017219003","spectrum_index":6552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 162.0314 Da; putative annotation: 6-Ethylthiopurine; putative formula: C7H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.06,"smiles":null,"spectrum_id":"CCMSLIB00017219004","spectrum_index":6553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP012803 Benzoic acid (delta mass: 205.0736 Da; putative annotation: dioxacarb; putative formula: C11H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.118,"smiles":null,"spectrum_id":"CCMSLIB00017219005","spectrum_index":6554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 94.078 Da; putative annotation: 1,2,3,6-Tetrahydrobenzylalcohol; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.221,"smiles":null,"spectrum_id":"CCMSLIB00017219007","spectrum_index":6555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 331.2711 Da; putative annotation: Arachidonoyl-2'-fluoroethylamide; putative formula: C22H34FN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.493,"smiles":null,"spectrum_id":"CCMSLIB00017219010","spectrum_index":6556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 378.2784 Da; putative annotation: (2Z)-2-[(E)-6-(hydroxymethyl)-2,4,8,10-tetramethyldodec-2-enylidene]-4-methylpentanedioic acid; putative formula: C23H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.339,"smiles":null,"spectrum_id":"CCMSLIB00017219011","spectrum_index":6557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 102.0314 Da; putative annotation: L-(+)-Threose; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.091,"smiles":null,"spectrum_id":"CCMSLIB00017219013","spectrum_index":6558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Dilinolenin (9c,12c,15c) from NIST14 (delta mass: 293.2359 Da; putative annotation: Gly-C16:1; putative formula: C18H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.719,"smiles":null,"spectrum_id":"CCMSLIB00017219016","spectrum_index":6559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of azelaic acid CollisionEnergy:205060 (delta mass: 198.1246 Da; putative annotation: (2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic acid; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.237,"smiles":null,"spectrum_id":"CCMSLIB00017219017","spectrum_index":6560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 164.0805 Da; putative annotation: Dihydroconiferyl alcohol; putative formula: C10H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.152,"smiles":null,"spectrum_id":"CCMSLIB00017219019","spectrum_index":6561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 192.0781 Da; putative annotation: Methylxanthoxylin; putative formula: C11H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.117,"smiles":null,"spectrum_id":"CCMSLIB00017219020","spectrum_index":6562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 323.2833 Da; putative annotation: Gly-C18:0; putative formula: C20H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.541,"smiles":null,"spectrum_id":"CCMSLIB00017219022","spectrum_index":6563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitamide (delta mass: 221.2138 Da; putative annotation: N/A; putative formula: C15H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.477,"smiles":null,"spectrum_id":"CCMSLIB00017219025","spectrum_index":6564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 38.0155 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.175,"smiles":null,"spectrum_id":"CCMSLIB00017219026","spectrum_index":6565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 207.0566 Da; putative annotation: N/A; putative formula: C7H13NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.132,"smiles":null,"spectrum_id":"CCMSLIB00017219027","spectrum_index":6566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 82.0418 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017219029","spectrum_index":6567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hexyldecanoic acid (delta mass: 38.0524 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.3,"smiles":null,"spectrum_id":"CCMSLIB00017219031","spectrum_index":6568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 507.3884 Da; putative annotation: N/A; putative formula: C25H53N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.615,"smiles":null,"spectrum_id":"CCMSLIB00017219033","spectrum_index":6569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grandiflorenic acid (delta mass: 112.0883 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017219034","spectrum_index":6570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 149.0729 Da; putative annotation: N/A; putative formula: C4H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.15,"smiles":null,"spectrum_id":"CCMSLIB00017219036","spectrum_index":6571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 270.0846 Da; putative annotation: N/A; putative formula: C7H22N4O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.166,"smiles":null,"spectrum_id":"CCMSLIB00017219037","spectrum_index":6572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 28.0316 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.232,"smiles":null,"spectrum_id":"CCMSLIB00017219038","spectrum_index":6573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 285.1053 Da; putative annotation: N/A; putative formula: C14H15N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.342,"smiles":null,"spectrum_id":"CCMSLIB00017219040","spectrum_index":6574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 147.1614 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.263,"smiles":null,"spectrum_id":"CCMSLIB00017219043","spectrum_index":6575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 102.0284 Da; putative annotation: N/A; putative formula: H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.124,"smiles":null,"spectrum_id":"CCMSLIB00017219044","spectrum_index":6576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 85.0161 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.087,"smiles":null,"spectrum_id":"CCMSLIB00017219046","spectrum_index":6577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 375.2629 Da; putative annotation: N/A; putative formula: C20H41NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.334,"smiles":null,"spectrum_id":"CCMSLIB00017219047","spectrum_index":6578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 409.2471 Da; putative annotation: N/A; putative formula: C23H39NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.531,"smiles":null,"spectrum_id":"CCMSLIB00017219050","spectrum_index":6579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 256.2038 Da; putative annotation: N/A; putative formula: C15H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.509,"smiles":null,"spectrum_id":"CCMSLIB00017219052","spectrum_index":6580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2Z)-2-[(E)-6-(hydroxymethyl)-2,4,8,10-tetramethyldodec-2-enylidene]-4-methylpentanedioic acid (delta mass: 38.0522 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.347,"smiles":null,"spectrum_id":"CCMSLIB00017219053","spectrum_index":6581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 66.0832 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.294,"smiles":null,"spectrum_id":"CCMSLIB00017219054","spectrum_index":6582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 50.0509 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.319,"smiles":null,"spectrum_id":"CCMSLIB00017219057","spectrum_index":6583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxytestosterone (delta mass: 72.0314 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.242,"smiles":null,"spectrum_id":"CCMSLIB00017219059","spectrum_index":6584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16(17)-Epoxy-4Z,7Z,10Z,13Z,19Z-docosapentaenoic acid (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.269,"smiles":null,"spectrum_id":"CCMSLIB00017219060","spectrum_index":6585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003182 Hordenine|4-[2-(dimethylamino)ethyl]phenol (delta mass: 104.0455 Da; putative annotation: N/A; putative formula: H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.168,"smiles":null,"spectrum_id":"CCMSLIB00017219061","spectrum_index":6586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxydodecanoic acid (delta mass: 82.0768 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.257,"smiles":null,"spectrum_id":"CCMSLIB00017219063","spectrum_index":6587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169194-02_C25H28N4O4_3-[(2-Benzyl-9-hydroxy-3-oxo-2,3,9,9a-tetrahydro-1H-imidazo[1,2-a]indol-9-yl)methyl]-6-isopropyl-2,5-piperazinedione (delta mass: 404.2781 Da; putative annotation: N/A; putative formula: C22H44O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.496,"smiles":null,"spectrum_id":"CCMSLIB00017219066","spectrum_index":6588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anemosapogenin (delta mass: 126.0813 Da; putative annotation: N/A; putative formula: C6H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.444,"smiles":null,"spectrum_id":"CCMSLIB00017219067","spectrum_index":6589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 175.1198 Da; putative annotation: N/A; putative formula: C8H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.336,"smiles":null,"spectrum_id":"CCMSLIB00017219068","spectrum_index":6590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 335.0998 Da; putative annotation: N/A; putative formula: C10H18N5O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.255,"smiles":null,"spectrum_id":"CCMSLIB00017219070","spectrum_index":6591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 351.0953 Da; putative annotation: N/A; putative formula: C16H17NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.25,"smiles":null,"spectrum_id":"CCMSLIB00017219072","spectrum_index":6592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 311.1006 Da; putative annotation: N/A; putative formula: C14H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.171,"smiles":null,"spectrum_id":"CCMSLIB00017219074","spectrum_index":6593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 163.0481 Da; putative annotation: N/A; putative formula: C5H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.145,"smiles":null,"spectrum_id":"CCMSLIB00017219076","spectrum_index":6594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 344.2083 Da; putative annotation: N/A; putative formula: C14H29N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.43,"smiles":null,"spectrum_id":"CCMSLIB00017219077","spectrum_index":6595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 67.0634 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017219080","spectrum_index":6596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 62.0 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.06,"smiles":null,"spectrum_id":"CCMSLIB00017219081","spectrum_index":6597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.128,"smiles":null,"spectrum_id":"CCMSLIB00017219082","spectrum_index":6598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 486.319 Da; putative annotation: N/A; putative formula: C26H46O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.394,"smiles":null,"spectrum_id":"CCMSLIB00017219083","spectrum_index":6599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 89.9773 Da; putative annotation: N/A; putative formula: C4H-1N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.162,"smiles":null,"spectrum_id":"CCMSLIB00017219087","spectrum_index":6600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 201.1114 Da; putative annotation: N/A; putative formula: C8H15N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.182,"smiles":null,"spectrum_id":"CCMSLIB00017219088","spectrum_index":6601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 9.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.149,"smiles":null,"spectrum_id":"CCMSLIB00017219089","spectrum_index":6602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 254.1634 Da; putative annotation: N/A; putative formula: C13H22N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.302,"smiles":null,"spectrum_id":"CCMSLIB00017219090","spectrum_index":6603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 122.1091 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.341,"smiles":null,"spectrum_id":"CCMSLIB00017219093","spectrum_index":6604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 118.0782 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017219094","spectrum_index":6605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 42.9816 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.009,"smiles":null,"spectrum_id":"CCMSLIB00017219095","spectrum_index":6606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11-Eicosatrienoic acid (delta mass: 17.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.289,"smiles":null,"spectrum_id":"CCMSLIB00017219097","spectrum_index":6607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000190 Meleagrin|Meleagrine (delta mass: 410.3183 Da; putative annotation: N/A; putative formula: C28H42O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":844.501,"smiles":null,"spectrum_id":"CCMSLIB00017219099","spectrum_index":6608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 399.2363 Da; putative annotation: N/A; putative formula: C21H38NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.302,"smiles":null,"spectrum_id":"CCMSLIB00017219101","spectrum_index":6609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 537.2685 Da; putative annotation: N/A; putative formula: C26H39N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.334,"smiles":null,"spectrum_id":"CCMSLIB00017219102","spectrum_index":6610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300401 Cyclo-prolylglycine (delta mass: 63.0027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.084,"smiles":null,"spectrum_id":"CCMSLIB00017219104","spectrum_index":6611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Thr (delta mass: 311.0101 Da; putative annotation: N/A; putative formula: C12H9NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.177,"smiles":null,"spectrum_id":"CCMSLIB00017219107","spectrum_index":6612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 73.0519 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.154,"smiles":null,"spectrum_id":"CCMSLIB00017219108","spectrum_index":6613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 374.1594 Da; putative annotation: N/A; putative formula: C19H34O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.246,"smiles":null,"spectrum_id":"CCMSLIB00017219110","spectrum_index":6614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S-Hydroxy-4Z,6E,10Z-hexadecatrienoic acid (delta mass: 230.2403 Da; putative annotation: N/A; putative formula: C18H30O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.436,"smiles":null,"spectrum_id":"CCMSLIB00017219112","spectrum_index":6615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitelaidic acid (delta mass: 259.2281 Da; putative annotation: N/A; putative formula: C12H30N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.46,"smiles":null,"spectrum_id":"CCMSLIB00017219114","spectrum_index":6616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 887.3473 Da; putative annotation: N/A; putative formula: C59H45N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1014.39,"smiles":null,"spectrum_id":"CCMSLIB00017219115","spectrum_index":6617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 59.0505 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.121,"smiles":null,"spectrum_id":"CCMSLIB00017219116","spectrum_index":6618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 156.1354 Da; putative annotation: N/A; putative formula: C10H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.482,"smiles":null,"spectrum_id":"CCMSLIB00017219119","spectrum_index":6619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 373.9577 Da; putative annotation: N/A; putative formula: C10H2N10OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.017,"smiles":null,"spectrum_id":"CCMSLIB00017219121","spectrum_index":6620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-4,10-Dimethylidene-7-propan-2-ylcyclodec-5-en-1-ol (delta mass: 363.2774 Da; putative annotation: N/A; putative formula: C22H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.467,"smiles":null,"spectrum_id":"CCMSLIB00017219122","spectrum_index":6621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 27.9659 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.094,"smiles":null,"spectrum_id":"CCMSLIB00017219123","spectrum_index":6622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 151.0638 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.192,"smiles":null,"spectrum_id":"CCMSLIB00017219126","spectrum_index":6623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 48.0075 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.059,"smiles":null,"spectrum_id":"CCMSLIB00017219128","spectrum_index":6624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxyeurycomalactone (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.186,"smiles":null,"spectrum_id":"CCMSLIB00017219129","spectrum_index":6625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 304.2 Da; putative annotation: N/A; putative formula: C14H28N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.307,"smiles":null,"spectrum_id":"CCMSLIB00017219130","spectrum_index":6626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 157.073 Da; putative annotation: N/A; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.164,"smiles":null,"spectrum_id":"CCMSLIB00017219134","spectrum_index":6627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 72.9036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017219135","spectrum_index":6628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Protopanaxadiol (delta mass: 80.0629 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.462,"smiles":null,"spectrum_id":"CCMSLIB00017219136","spectrum_index":6629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbocyclic thromboxane A2 (delta mass: 260.2482 Da; putative annotation: N/A; putative formula: C19H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.522,"smiles":null,"spectrum_id":"CCMSLIB00017219137","spectrum_index":6630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cortisone (delta mass: 176.0308 Da; putative annotation: N/A; putative formula: C10H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.232,"smiles":null,"spectrum_id":"CCMSLIB00017219140","spectrum_index":6631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381059-01!5-[5-(3,5-dihydroxydecanoyloxy)-3-hydroxydecanoyl]oxy-3-hydroxydecanoic acid (delta mass: 200.1393 Da; putative annotation: N/A; putative formula: C7H16N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":777.534,"smiles":null,"spectrum_id":"CCMSLIB00017219141","spectrum_index":6632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 107.9868 Da; putative annotation: N/A; putative formula: C4HN2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.099,"smiles":null,"spectrum_id":"CCMSLIB00017219142","spectrum_index":6633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 17.0325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.128,"smiles":null,"spectrum_id":"CCMSLIB00017219144","spectrum_index":6634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 125.0199 Da; putative annotation: N/A; putative formula: H-1N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.215,"smiles":null,"spectrum_id":"CCMSLIB00017219147","spectrum_index":6635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 91.0999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.238,"smiles":null,"spectrum_id":"CCMSLIB00017219148","spectrum_index":6636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 64.0149 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.19,"smiles":null,"spectrum_id":"CCMSLIB00017219149","spectrum_index":6637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 23.1504 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.315,"smiles":null,"spectrum_id":"CCMSLIB00017219150","spectrum_index":6638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 133.0737 Da; putative annotation: N/A; putative formula: C5H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.149,"smiles":null,"spectrum_id":"CCMSLIB00017219154","spectrum_index":6639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 76.016 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017219155","spectrum_index":6640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyisovanillic acid (delta mass: 44.0256 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.07,"smiles":null,"spectrum_id":"CCMSLIB00017219156","spectrum_index":6641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 36.0193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.23,"smiles":null,"spectrum_id":"CCMSLIB00017219157","spectrum_index":6642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 120.0059 Da; putative annotation: N/A; putative formula: C3H4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.211,"smiles":null,"spectrum_id":"CCMSLIB00017219159","spectrum_index":6643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 432.0927 Da; putative annotation: N/A; putative formula: C19H20N4O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.153,"smiles":null,"spectrum_id":"CCMSLIB00017219161","spectrum_index":6644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 296.2368 Da; putative annotation: N/A; putative formula: C19H28N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.274,"smiles":null,"spectrum_id":"CCMSLIB00017219163","spectrum_index":6645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyoleylcarnitine (delta mass: 176.0309 Da; putative annotation: N/A; putative formula: C10H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.384,"smiles":null,"spectrum_id":"CCMSLIB00017219164","spectrum_index":6646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 243.2554 Da; putative annotation: N/A; putative formula: C11H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.509,"smiles":null,"spectrum_id":"CCMSLIB00017219165","spectrum_index":6647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 107.0589 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.139,"smiles":null,"spectrum_id":"CCMSLIB00017219169","spectrum_index":6648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 212.0528 Da; putative annotation: N/A; putative formula: C3H14N6O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.285,"smiles":null,"spectrum_id":"CCMSLIB00017219170","spectrum_index":6649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.113,"smiles":null,"spectrum_id":"CCMSLIB00017219171","spectrum_index":6650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 385.3546 Da; putative annotation: N/A; putative formula: C23H47NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.661,"smiles":null,"spectrum_id":"CCMSLIB00017219172","spectrum_index":6651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 4-bromo-2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 242.2368 Da; putative annotation: N/A; putative formula: C14H30N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.322,"smiles":null,"spectrum_id":"CCMSLIB00017219175","spectrum_index":6652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinolcarboxylic acid (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.081,"smiles":null,"spectrum_id":"CCMSLIB00017219177","spectrum_index":6653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 869.5462 Da; putative annotation: N/A; putative formula: C54H71N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1163.83,"smiles":null,"spectrum_id":"CCMSLIB00017219178","spectrum_index":6654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 919.5184 Da; putative annotation: N/A; putative formula: C64H65N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1100.59,"smiles":null,"spectrum_id":"CCMSLIB00017219179","spectrum_index":6655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dodecanoylhomoserine (delta mass: 301.2266 Da; putative annotation: N/A; putative formula: C17H27N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.459,"smiles":null,"spectrum_id":"CCMSLIB00017219181","spectrum_index":6656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 360.1929 Da; putative annotation: N/A; putative formula: C15H29N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.274,"smiles":null,"spectrum_id":"CCMSLIB00017219184","spectrum_index":6657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 42.0134 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.11,"smiles":null,"spectrum_id":"CCMSLIB00017219185","spectrum_index":6658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.-Hydroxyetiocholanolone (delta mass: 35.0375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.264,"smiles":null,"spectrum_id":"CCMSLIB00017219186","spectrum_index":6659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-methoxybenzoic acid (delta mass: 28.0791 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.129,"smiles":null,"spectrum_id":"CCMSLIB00017219187","spectrum_index":6660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100091 3,4-Dihydroxy-L-phenylalanine|L-DOPA|L-3-Hydroxytyrosine|Levodopa|3-(3,4-Dihydroxyphenyl)-L-alanine|DOPA (delta mass: 103.0092 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.085,"smiles":null,"spectrum_id":"CCMSLIB00017219191","spectrum_index":6661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 163.0632 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.197,"smiles":null,"spectrum_id":"CCMSLIB00017219192","spectrum_index":6662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Guanosine (delta mass: 132.0425 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.141,"smiles":null,"spectrum_id":"CCMSLIB00017219193","spectrum_index":6663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 22.0199 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.304,"smiles":null,"spectrum_id":"CCMSLIB00017219194","spectrum_index":6664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 11.0044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.111,"smiles":null,"spectrum_id":"CCMSLIB00017219197","spectrum_index":6665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 68.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.117,"smiles":null,"spectrum_id":"CCMSLIB00017219199","spectrum_index":6666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 175.0455 Da; putative annotation: N/A; putative formula: C2H5N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.173,"smiles":null,"spectrum_id":"CCMSLIB00017219200","spectrum_index":6667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 180.0631 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.128,"smiles":null,"spectrum_id":"CCMSLIB00017219201","spectrum_index":6668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 13.0188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.121,"smiles":null,"spectrum_id":"CCMSLIB00017219205","spectrum_index":6669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 798.9243 Da; putative annotation: N/A; putative formula: C41H21NO-1S9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1304.1,"smiles":null,"spectrum_id":"CCMSLIB00017219206","spectrum_index":6670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Thr (delta mass: 298.0843 Da; putative annotation: N/A; putative formula: C10H22N2O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.251,"smiles":null,"spectrum_id":"CCMSLIB00017219207","spectrum_index":6671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.-Hydroxy-4-cholesten-3-one (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.393,"smiles":null,"spectrum_id":"CCMSLIB00017219208","spectrum_index":6672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 62.0502 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.34,"smiles":null,"spectrum_id":"CCMSLIB00017219211","spectrum_index":6673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 610.2846 Da; putative annotation: N/A; putative formula: C41H34N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":994.435,"smiles":null,"spectrum_id":"CCMSLIB00017219213","spectrum_index":6674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 292.2758 Da; putative annotation: N/A; putative formula: C20H36O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.547,"smiles":null,"spectrum_id":"CCMSLIB00017219214","spectrum_index":6675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 150.3817 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.5,"smiles":null,"spectrum_id":"CCMSLIB00017219216","spectrum_index":6676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-((4R)-4-((5R,7R,8R,9S,10S,12S,13R,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid\"\" (delta mass: 17.0279 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.311,"smiles":null,"spectrum_id":"CCMSLIB00017219218","spectrum_index":6677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 38.0505 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.142,"smiles":null,"spectrum_id":"CCMSLIB00017219220","spectrum_index":6678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 240.1471 Da; putative annotation: N/A; putative formula: C12H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.238,"smiles":null,"spectrum_id":"CCMSLIB00017219222","spectrum_index":6679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 98.0522 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.284,"smiles":null,"spectrum_id":"CCMSLIB00017219223","spectrum_index":6680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 849.3611 Da; putative annotation: N/A; putative formula: C56H55N3O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1108.48,"smiles":null,"spectrum_id":"CCMSLIB00017219225","spectrum_index":6681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 159.0305 Da; putative annotation: N/A; putative formula: C3H6N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.127,"smiles":null,"spectrum_id":"CCMSLIB00017219226","spectrum_index":6682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-oxo-5beta-cholanic acid (delta mass: 90.0686 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.358,"smiles":null,"spectrum_id":"CCMSLIB00017219228","spectrum_index":6683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.149,"smiles":null,"spectrum_id":"CCMSLIB00017219230","spectrum_index":6684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycoursodeoxycholic acid (delta mass: 126.0888 Da; putative annotation: N/A; putative formula: C5H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.41,"smiles":null,"spectrum_id":"CCMSLIB00017219232","spectrum_index":6685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 165.0905 Da; putative annotation: N/A; putative formula: C8H11N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.193,"smiles":null,"spectrum_id":"CCMSLIB00017219234","spectrum_index":6686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 63.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.165,"smiles":null,"spectrum_id":"CCMSLIB00017219235","spectrum_index":6687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentazocine (delta mass: 16.9786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.195,"smiles":null,"spectrum_id":"CCMSLIB00017219237","spectrum_index":6688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 139.1822 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.269,"smiles":null,"spectrum_id":"CCMSLIB00017219239","spectrum_index":6689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 36.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.252,"smiles":null,"spectrum_id":"CCMSLIB00017219241","spectrum_index":6690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 58.0162 Da; putative annotation: N/A; putative formula: CH2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.098,"smiles":null,"spectrum_id":"CCMSLIB00017219243","spectrum_index":6691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 10.0564 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.111,"smiles":null,"spectrum_id":"CCMSLIB00017219244","spectrum_index":6692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 50.8978 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017219246","spectrum_index":6693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetylamino-6-formylamino-3-methyluracil (delta mass: 36.0135 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017219249","spectrum_index":6694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 242.0546 Da; putative annotation: N/A; putative formula: C10H14N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.119,"smiles":null,"spectrum_id":"CCMSLIB00017219250","spectrum_index":6695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 92.0622 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.294,"smiles":null,"spectrum_id":"CCMSLIB00017219251","spectrum_index":6696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxycapric acid (delta mass: 77.9782 Da; putative annotation: N/A; putative formula: CH2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.127,"smiles":null,"spectrum_id":"CCMSLIB00017219252","spectrum_index":6697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 176.0321 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.275,"smiles":null,"spectrum_id":"CCMSLIB00017219255","spectrum_index":6698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 122.0366 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.117,"smiles":null,"spectrum_id":"CCMSLIB00017219257","spectrum_index":6699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 54.0724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.153,"smiles":null,"spectrum_id":"CCMSLIB00017219258","spectrum_index":6700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 10.02 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.091,"smiles":null,"spectrum_id":"CCMSLIB00017219259","spectrum_index":6701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 150.0857 Da; putative annotation: N/A; putative formula: C2H10N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.161,"smiles":null,"spectrum_id":"CCMSLIB00017219261","spectrum_index":6702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 96.0568 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.096,"smiles":null,"spectrum_id":"CCMSLIB00017219264","spectrum_index":6703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.279,"smiles":null,"spectrum_id":"CCMSLIB00017219265","spectrum_index":6704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 81.8995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.971,"smiles":null,"spectrum_id":"CCMSLIB00017219266","spectrum_index":6705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 99.0674 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.118,"smiles":null,"spectrum_id":"CCMSLIB00017219268","spectrum_index":6706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 177.1156 Da; putative annotation: N/A; putative formula: C11H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.233,"smiles":null,"spectrum_id":"CCMSLIB00017219270","spectrum_index":6707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 79.0644 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.276,"smiles":null,"spectrum_id":"CCMSLIB00017219271","spectrum_index":6708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 71.9847 Da; putative annotation: N/A; putative formula: C2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017219273","spectrum_index":6709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 56.0631 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017219274","spectrum_index":6710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYLXANTHINE (delta mass: 70.0412 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.098,"smiles":null,"spectrum_id":"CCMSLIB00017219277","spectrum_index":6711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-(1Z-Octadecenyl)-sn-glycero-3-phosphocholine from NIST14 (delta mass: 521.3499 Da; putative annotation: N/A; putative formula: C25H51N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1029.73,"smiles":null,"spectrum_id":"CCMSLIB00017219278","spectrum_index":6712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 17.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.201,"smiles":null,"spectrum_id":"CCMSLIB00017219280","spectrum_index":6713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.091,"smiles":null,"spectrum_id":"CCMSLIB00017219281","spectrum_index":6714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 68.0644 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.333,"smiles":null,"spectrum_id":"CCMSLIB00017219283","spectrum_index":6715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 280.2411 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.312,"smiles":null,"spectrum_id":"CCMSLIB00017219284","spectrum_index":6716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-C13:1 (delta mass: 71.0819 Da; putative annotation: N/A; putative formula: C3H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.335,"smiles":null,"spectrum_id":"CCMSLIB00017219287","spectrum_index":6717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 76.0237 Da; putative annotation: N/A; putative formula: H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.09,"smiles":null,"spectrum_id":"CCMSLIB00017219288","spectrum_index":6718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 668.4752 Da; putative annotation: N/A; putative formula: C42H69O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.556,"smiles":null,"spectrum_id":"CCMSLIB00017219290","spectrum_index":6719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 207.2535 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.301,"smiles":null,"spectrum_id":"CCMSLIB00017219292","spectrum_index":6720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6-quinolinesulfonamide (delta mass: 45.0432 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.112,"smiles":null,"spectrum_id":"CCMSLIB00017219293","spectrum_index":6721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOATE - 50.0 eV (delta mass: 86.0003 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.055,"smiles":null,"spectrum_id":"CCMSLIB00017219294","spectrum_index":6722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 72.0577 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017219295","spectrum_index":6723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 77.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.207,"smiles":null,"spectrum_id":"CCMSLIB00017219298","spectrum_index":6724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 263.6056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.677,"smiles":null,"spectrum_id":"CCMSLIB00017219300","spectrum_index":6725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 72.0216 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.124,"smiles":null,"spectrum_id":"CCMSLIB00017219301","spectrum_index":6726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 38.9736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.985,"smiles":null,"spectrum_id":"CCMSLIB00017219302","spectrum_index":6727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 136.0733 Da; putative annotation: N/A; putative formula: C6H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.16,"smiles":null,"spectrum_id":"CCMSLIB00017219304","spectrum_index":6728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 33.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.279,"smiles":null,"spectrum_id":"CCMSLIB00017219307","spectrum_index":6729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 74.0686 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.118,"smiles":null,"spectrum_id":"CCMSLIB00017219308","spectrum_index":6730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 517.363 Da; putative annotation: N/A; putative formula: C28H47N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.434,"smiles":null,"spectrum_id":"CCMSLIB00017219309","spectrum_index":6731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 240.1875 Da; putative annotation: N/A; putative formula: C18H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.487,"smiles":null,"spectrum_id":"CCMSLIB00017219311","spectrum_index":6732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1H-Benzimidazol-2-ylsulfanyl)furan--2-carbaldehyde (delta mass: 164.0886 Da; putative annotation: N/A; putative formula: C9H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.126,"smiles":null,"spectrum_id":"CCMSLIB00017219314","spectrum_index":6733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl tyramine (delta mass: 254.2604 Da; putative annotation: N/A; putative formula: C17H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.362,"smiles":null,"spectrum_id":"CCMSLIB00017219315","spectrum_index":6734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 167.1202 Da; putative annotation: N/A; putative formula: C10H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.202,"smiles":null,"spectrum_id":"CCMSLIB00017219316","spectrum_index":6735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.086,"smiles":null,"spectrum_id":"CCMSLIB00017219318","spectrum_index":6736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 157.0522 Da; putative annotation: N/A; putative formula: C4H8N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.295,"smiles":null,"spectrum_id":"CCMSLIB00017219321","spectrum_index":6737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butaprost (free acid) (delta mass: 102.0814 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.361,"smiles":null,"spectrum_id":"CCMSLIB00017219322","spectrum_index":6738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 127.0268 Da; putative annotation: N/A; putative formula: C5H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.092,"smiles":null,"spectrum_id":"CCMSLIB00017219324","spectrum_index":6739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1H-Benzimidazol-2-ylsulfanyl)furan--2-carbaldehyde (delta mass: 18.0171 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.055,"smiles":null,"spectrum_id":"CCMSLIB00017219325","spectrum_index":6740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 531.5463 Da; putative annotation: N/A; putative formula: C35H69N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.627,"smiles":null,"spectrum_id":"CCMSLIB00017219328","spectrum_index":6741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 29.0262 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.086,"smiles":null,"spectrum_id":"CCMSLIB00017219329","spectrum_index":6742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 530.3118 Da; putative annotation: N/A; putative formula: C29H38N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.414,"smiles":null,"spectrum_id":"CCMSLIB00017219330","spectrum_index":6743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 387.2156 Da; putative annotation: N/A; putative formula: C21H29N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.318,"smiles":null,"spectrum_id":"CCMSLIB00017219331","spectrum_index":6744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 44.0738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.16,"smiles":null,"spectrum_id":"CCMSLIB00017219335","spectrum_index":6745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 102.0771 Da; putative annotation: N/A; putative formula: H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017219336","spectrum_index":6746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arsubin (delta mass: 311.1213 Da; putative annotation: N/A; putative formula: C9H9N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.27,"smiles":null,"spectrum_id":"CCMSLIB00017219337","spectrum_index":6747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 355.1483 Da; putative annotation: N/A; putative formula: C16H26N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.307,"smiles":null,"spectrum_id":"CCMSLIB00017219338","spectrum_index":6748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.alpha.-Glycyrrhetinic acid (delta mass: 86.0554 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.402,"smiles":null,"spectrum_id":"CCMSLIB00017219340","spectrum_index":6749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Cyclopentylpropyl)methylamine (delta mass: 438.4188 Da; putative annotation: N/A; putative formula: C27H54N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.578,"smiles":null,"spectrum_id":"CCMSLIB00017219343","spectrum_index":6750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 260.0527 Da; putative annotation: N/A; putative formula: C10H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.092,"smiles":null,"spectrum_id":"CCMSLIB00017219344","spectrum_index":6751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 34.9402 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.162,"smiles":null,"spectrum_id":"CCMSLIB00017219345","spectrum_index":6752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentianose (delta mass: 100.0428 Da; putative annotation: N/A; putative formula: C7H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.219,"smiles":null,"spectrum_id":"CCMSLIB00017219347","spectrum_index":6753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 194.0934 Da; putative annotation: N/A; putative formula: C5H15N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017219350","spectrum_index":6754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desferrioxamine H (delta mass: 114.0795 Da; putative annotation: N/A; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.34,"smiles":null,"spectrum_id":"CCMSLIB00017219351","spectrum_index":6755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 136.0705 Da; putative annotation: N/A; putative formula: CH8N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.204,"smiles":null,"spectrum_id":"CCMSLIB00017219353","spectrum_index":6756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 18.0083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.23,"smiles":null,"spectrum_id":"CCMSLIB00017219354","spectrum_index":6757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 97.9677 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.142,"smiles":null,"spectrum_id":"CCMSLIB00017219357","spectrum_index":6758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 114.0317 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017219358","spectrum_index":6759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 778.4502 Da; putative annotation: N/A; putative formula: C40H54N14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1105.58,"smiles":null,"spectrum_id":"CCMSLIB00017219360","spectrum_index":6760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 96.0577 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017219361","spectrum_index":6761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Castanospermine (delta mass: 44.0261 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.133,"smiles":null,"spectrum_id":"CCMSLIB00017219364","spectrum_index":6762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 93.0472 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.107,"smiles":null,"spectrum_id":"CCMSLIB00017219365","spectrum_index":6763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 75.0313 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.129,"smiles":null,"spectrum_id":"CCMSLIB00017219367","spectrum_index":6764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 147.1253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.362,"smiles":null,"spectrum_id":"CCMSLIB00017219368","spectrum_index":6765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 310.2873 Da; putative annotation: N/A; putative formula: C20H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.41,"smiles":null,"spectrum_id":"CCMSLIB00017219371","spectrum_index":6766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 52.0167 Da; putative annotation: N/A; putative formula: CN4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.275,"smiles":null,"spectrum_id":"CCMSLIB00017219373","spectrum_index":6767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 453.0689 Da; putative annotation: N/A; putative formula: C14H19N3O12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.096,"smiles":null,"spectrum_id":"CCMSLIB00017219374","spectrum_index":6768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C9:0 (delta mass: 90.0571 Da; putative annotation: N/A; putative formula: C6H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.264,"smiles":null,"spectrum_id":"CCMSLIB00017219375","spectrum_index":6769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10-Nonadecenoic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.289,"smiles":null,"spectrum_id":"CCMSLIB00017219377","spectrum_index":6770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 914.3687 Da; putative annotation: N/A; putative formula: C51H50N10O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1173.49,"smiles":null,"spectrum_id":"CCMSLIB00017219380","spectrum_index":6771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 111.1969 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.356,"smiles":null,"spectrum_id":"CCMSLIB00017219381","spectrum_index":6772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one (delta mass: 135.07 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.163,"smiles":null,"spectrum_id":"CCMSLIB00017219382","spectrum_index":6773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3'-Hydroxycotinine (delta mass: 40.8128 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.91,"smiles":null,"spectrum_id":"CCMSLIB00017219384","spectrum_index":6774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.102,"smiles":null,"spectrum_id":"CCMSLIB00017219387","spectrum_index":6775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 620.1923 Da; putative annotation: N/A; putative formula: C43H28N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.252,"smiles":null,"spectrum_id":"CCMSLIB00017219388","spectrum_index":6776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 73.0368 Da; putative annotation: N/A; putative formula: C3H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.269,"smiles":null,"spectrum_id":"CCMSLIB00017219390","spectrum_index":6777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 492.1154 Da; putative annotation: N/A; putative formula: C22H12N12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.156,"smiles":null,"spectrum_id":"CCMSLIB00017219391","spectrum_index":6778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meridinol (delta mass: 311.1215 Da; putative annotation: N/A; putative formula: C9H9N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.234,"smiles":null,"spectrum_id":"CCMSLIB00017219394","spectrum_index":6779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 100.0158 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.133,"smiles":null,"spectrum_id":"CCMSLIB00017219396","spectrum_index":6780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 309.2666 Da; putative annotation: N/A; putative formula: C19H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.478,"smiles":null,"spectrum_id":"CCMSLIB00017219397","spectrum_index":6781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 404.1448 Da; putative annotation: N/A; putative formula: C14H29O11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1071.37,"smiles":null,"spectrum_id":"CCMSLIB00017219398","spectrum_index":6782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 17.9739 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.31,"smiles":null,"spectrum_id":"CCMSLIB00017219401","spectrum_index":6783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 70.0376 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.129,"smiles":null,"spectrum_id":"CCMSLIB00017219403","spectrum_index":6784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 132.0852 Da; putative annotation: N/A; putative formula: C4H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.234,"smiles":null,"spectrum_id":"CCMSLIB00017219404","spectrum_index":6785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-5-hydroxybenzoic acid (delta mass: 9.8905 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.94,"smiles":null,"spectrum_id":"CCMSLIB00017219405","spectrum_index":6786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 114.0317 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.092,"smiles":null,"spectrum_id":"CCMSLIB00017219408","spectrum_index":6787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 420.1268 Da; putative annotation: N/A; putative formula: C17H24O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.187,"smiles":null,"spectrum_id":"CCMSLIB00017219410","spectrum_index":6788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 105.056 Da; putative annotation: N/A; putative formula: CH8N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.136,"smiles":null,"spectrum_id":"CCMSLIB00017219411","spectrum_index":6789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycerol (delta mass: 329.2516 Da; putative annotation: N/A; putative formula: C25H31NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":950.797,"smiles":null,"spectrum_id":"CCMSLIB00017219412","spectrum_index":6790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyporusterone A (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.42,"smiles":null,"spectrum_id":"CCMSLIB00017219414","spectrum_index":6791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-His (delta mass: 113.084 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.182,"smiles":null,"spectrum_id":"CCMSLIB00017219417","spectrum_index":6792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 119.0578 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.285,"smiles":null,"spectrum_id":"CCMSLIB00017219418","spectrum_index":6793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-8-(phenacylthio)-3,7-dihydropurin-6-one (delta mass: 132.0457 Da; putative annotation: N/A; putative formula: C4H9N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.116,"smiles":null,"spectrum_id":"CCMSLIB00017219419","spectrum_index":6794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Ketodeoxycholic acid (delta mass: 48.0363 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.321,"smiles":null,"spectrum_id":"CCMSLIB00017219420","spectrum_index":6795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 100.0737 Da; putative annotation: N/A; putative formula: C3H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.353,"smiles":null,"spectrum_id":"CCMSLIB00017219424","spectrum_index":6796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 260.2704 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.518,"smiles":null,"spectrum_id":"CCMSLIB00017219425","spectrum_index":6797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 42.8476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.934,"smiles":null,"spectrum_id":"CCMSLIB00017219426","spectrum_index":6798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 14.0511 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.299,"smiles":null,"spectrum_id":"CCMSLIB00017219427","spectrum_index":6799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 190.12 Da; putative annotation: N/A; putative formula: C9H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.196,"smiles":null,"spectrum_id":"CCMSLIB00017219431","spectrum_index":6800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 191.91 Da; putative annotation: N/A; putative formula: C4HO3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.001,"smiles":null,"spectrum_id":"CCMSLIB00017219432","spectrum_index":6801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Carbazole-1-carboxamide, 6-chloro-2,3,4,9-tetrahydro- (delta mass: 204.11 Da; putative annotation: N/A; putative formula: C10H21PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.189,"smiles":null,"spectrum_id":"CCMSLIB00017219433","spectrum_index":6802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 353.132 Da; putative annotation: N/A; putative formula: C13H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.265,"smiles":null,"spectrum_id":"CCMSLIB00017219435","spectrum_index":6803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(4-oxopentyl)-3,4-dihydroisochromen-1-one (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017219437","spectrum_index":6804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1-Pyrrolidinylcarbonyl)piperidine (delta mass: 45.0214 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.171,"smiles":null,"spectrum_id":"CCMSLIB00017219439","spectrum_index":6805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 657.2872 Da; putative annotation: N/A; putative formula: C29H39N9O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.378,"smiles":null,"spectrum_id":"CCMSLIB00017219440","spectrum_index":6806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 88.5289 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.62,"smiles":null,"spectrum_id":"CCMSLIB00017219442","spectrum_index":6807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylimbricatolic acid (delta mass: 106.0783 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.347,"smiles":null,"spectrum_id":"CCMSLIB00017219444","spectrum_index":6808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 29.9165 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.164,"smiles":null,"spectrum_id":"CCMSLIB00017219446","spectrum_index":6809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 1043.3682 Da; putative annotation: N/A; putative formula: C40H65N7O21S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1386.49,"smiles":null,"spectrum_id":"CCMSLIB00017219448","spectrum_index":6810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisucaberin (delta mass: 149.0482 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.288,"smiles":null,"spectrum_id":"CCMSLIB00017219449","spectrum_index":6811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 197.0898 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.16,"smiles":null,"spectrum_id":"CCMSLIB00017219451","spectrum_index":6812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 99.0668 Da; putative annotation: N/A; putative formula: CH5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.144,"smiles":null,"spectrum_id":"CCMSLIB00017219453","spectrum_index":6813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 352.2594 Da; putative annotation: N/A; putative formula: C25H36O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.486,"smiles":null,"spectrum_id":"CCMSLIB00017219455","spectrum_index":6814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 60.0112 Da; putative annotation: N/A; putative formula: C4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.092,"smiles":null,"spectrum_id":"CCMSLIB00017219457","spectrum_index":6815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis,cis-9,12-Octadecadien-1-ol from NIST14 (delta mass: 80.0633 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.332,"smiles":null,"spectrum_id":"CCMSLIB00017219459","spectrum_index":6816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 241.0819 Da; putative annotation: N/A; putative formula: C9H15N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.163,"smiles":null,"spectrum_id":"CCMSLIB00017219461","spectrum_index":6817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 82.0772 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.309,"smiles":null,"spectrum_id":"CCMSLIB00017219462","spectrum_index":6818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 92.0741 Da; putative annotation: N/A; putative formula: C6H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017219464","spectrum_index":6819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Linoleoylglycerol from NIST14 (delta mass: 173.1774 Da; putative annotation: N/A; putative formula: C6H19N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.462,"smiles":null,"spectrum_id":"CCMSLIB00017219465","spectrum_index":6820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 347.2664 Da; putative annotation: N/A; putative formula: C15H29N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.399,"smiles":null,"spectrum_id":"CCMSLIB00017219466","spectrum_index":6821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 126.0214 Da; putative annotation: N/A; putative formula: C8H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.113,"smiles":null,"spectrum_id":"CCMSLIB00017219468","spectrum_index":6822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 118.0761 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.392,"smiles":null,"spectrum_id":"CCMSLIB00017219470","spectrum_index":6823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 630.6357 Da; putative annotation: N/A; putative formula: C43H82O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":852.733,"smiles":null,"spectrum_id":"CCMSLIB00017219472","spectrum_index":6824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 587.3599 Da; putative annotation: N/A; putative formula: C34H41N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.42,"smiles":null,"spectrum_id":"CCMSLIB00017219474","spectrum_index":6825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 74.0371 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.092,"smiles":null,"spectrum_id":"CCMSLIB00017219476","spectrum_index":6826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.269,"smiles":null,"spectrum_id":"CCMSLIB00017219478","spectrum_index":6827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 128.0884 Da; putative annotation: N/A; putative formula: C6H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.44,"smiles":null,"spectrum_id":"CCMSLIB00017219480","spectrum_index":6828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 828.2597 Da; putative annotation: N/A; putative formula: C40H48N2O13S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":989.319,"smiles":null,"spectrum_id":"CCMSLIB00017219481","spectrum_index":6829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 82.0053 Da; putative annotation: N/A; putative formula: C4H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.092,"smiles":null,"spectrum_id":"CCMSLIB00017219483","spectrum_index":6830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 70.0527 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.139,"smiles":null,"spectrum_id":"CCMSLIB00017219484","spectrum_index":6831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 285.2672 Da; putative annotation: N/A; putative formula: C17H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.515,"smiles":null,"spectrum_id":"CCMSLIB00017219486","spectrum_index":6832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 574.3397 Da; putative annotation: N/A; putative formula: C27H50N4O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.457,"smiles":null,"spectrum_id":"CCMSLIB00017219487","spectrum_index":6833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 74.0431 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.148,"smiles":null,"spectrum_id":"CCMSLIB00017219489","spectrum_index":6834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 790.6481 Da; putative annotation: N/A; putative formula: C44H92N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":968.734,"smiles":null,"spectrum_id":"CCMSLIB00017219491","spectrum_index":6835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 298.1904 Da; putative annotation: N/A; putative formula: C16H22N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.287,"smiles":null,"spectrum_id":"CCMSLIB00017219492","spectrum_index":6836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Deoxyprostaglandin E2 (delta mass: 35.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017219493","spectrum_index":6837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 31.0424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.264,"smiles":null,"spectrum_id":"CCMSLIB00017219494","spectrum_index":6838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Hydroxy-5Z,7E,11Z,14Z,17Z-eicosapentaenoic acid (delta mass: 63.0686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.295,"smiles":null,"spectrum_id":"CCMSLIB00017219497","spectrum_index":6839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 487.3514 Da; putative annotation: N/A; putative formula: C27H53NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.422,"smiles":null,"spectrum_id":"CCMSLIB00017219499","spectrum_index":6840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 167.0679 Da; putative annotation: N/A; putative formula: C3H5N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.201,"smiles":null,"spectrum_id":"CCMSLIB00017219500","spectrum_index":6841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 52.068 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.295,"smiles":null,"spectrum_id":"CCMSLIB00017219501","spectrum_index":6842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 60.0205 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.075,"smiles":null,"spectrum_id":"CCMSLIB00017219503","spectrum_index":6843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxyphenylacetic acid (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017219506","spectrum_index":6844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 37.9792 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.055,"smiles":null,"spectrum_id":"CCMSLIB00017219507","spectrum_index":6845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 246.1891 Da; putative annotation: N/A; putative formula: C4H18N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.271,"smiles":null,"spectrum_id":"CCMSLIB00017219508","spectrum_index":6846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 35.0356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.267,"smiles":null,"spectrum_id":"CCMSLIB00017219510","spectrum_index":6847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 95.0735 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.16,"smiles":null,"spectrum_id":"CCMSLIB00017219513","spectrum_index":6848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactose 1-phosphate - 30.0 eV (delta mass: 864.2954 Da; putative annotation: N/A; putative formula: C43H48N2O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1125.33,"smiles":null,"spectrum_id":"CCMSLIB00017219514","spectrum_index":6849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 186.1628 Da; putative annotation: N/A; putative formula: C11H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.208,"smiles":null,"spectrum_id":"CCMSLIB00017219515","spectrum_index":6850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087701 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 396.1685 Da; putative annotation: N/A; putative formula: C22H24N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.233,"smiles":null,"spectrum_id":"CCMSLIB00017219517","spectrum_index":6851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 1-piperazinecarboxylate (delta mass: 142.0665 Da; putative annotation: N/A; putative formula: C6H11N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.164,"smiles":null,"spectrum_id":"CCMSLIB00017219519","spectrum_index":6852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 112.0191 Da; putative annotation: N/A; putative formula: C4H5N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.074,"smiles":null,"spectrum_id":"CCMSLIB00017219520","spectrum_index":6853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Pro from NIST14 (delta mass: 21.0003 Da; putative annotation: N/A; putative formula: C2H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.139,"smiles":null,"spectrum_id":"CCMSLIB00017219522","spectrum_index":6854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 386.7832 Da; putative annotation: N/A; putative formula: C4H5NO2S9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.854,"smiles":null,"spectrum_id":"CCMSLIB00017219524","spectrum_index":6855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 1057.2046 Da; putative annotation: N/A; putative formula: C46H43N9O15S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1441.35,"smiles":null,"spectrum_id":"CCMSLIB00017219526","spectrum_index":6856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 358.2713 Da; putative annotation: N/A; putative formula: C20H38O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.479,"smiles":null,"spectrum_id":"CCMSLIB00017219527","spectrum_index":6857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactose 1-phosphate - 30.0 eV (delta mass: 620.1531 Da; putative annotation: N/A; putative formula: C38H20N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.19,"smiles":null,"spectrum_id":"CCMSLIB00017219529","spectrum_index":6858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyphenethyl alcohol (delta mass: 83.0492 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.125,"smiles":null,"spectrum_id":"CCMSLIB00017219531","spectrum_index":6859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 84.0709 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.142,"smiles":null,"spectrum_id":"CCMSLIB00017219533","spectrum_index":6860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 179.1329 Da; putative annotation: N/A; putative formula: C11H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.172,"smiles":null,"spectrum_id":"CCMSLIB00017219534","spectrum_index":6861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180712-02!(3R,5R)-1-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4,5-trihydroxycyclohexane-1-carboxylic acid (delta mass: 163.0347 Da; putative annotation: N/A; putative formula: C3H9N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.137,"smiles":null,"spectrum_id":"CCMSLIB00017219537","spectrum_index":6862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 61.0624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.097,"smiles":null,"spectrum_id":"CCMSLIB00017219538","spectrum_index":6863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 475.3238 Da; putative annotation: N/A; putative formula: C35H41N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.54,"smiles":null,"spectrum_id":"CCMSLIB00017219540","spectrum_index":6864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 215.0832 Da; putative annotation: N/A; putative formula: C7H13N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.201,"smiles":null,"spectrum_id":"CCMSLIB00017219541","spectrum_index":6865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 46.0045 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.106,"smiles":null,"spectrum_id":"CCMSLIB00017219544","spectrum_index":6866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 600.2101 Da; putative annotation: N/A; putative formula: C24H42O13P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.289,"smiles":null,"spectrum_id":"CCMSLIB00017219546","spectrum_index":6867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 53.0268 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.093,"smiles":null,"spectrum_id":"CCMSLIB00017219547","spectrum_index":6868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Cyclodextrin (delta mass: 35.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1332.47,"smiles":null,"spectrum_id":"CCMSLIB00017219548","spectrum_index":6869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,3-Dimethylacrylic acid (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.055,"smiles":null,"spectrum_id":"CCMSLIB00017219550","spectrum_index":6870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 42.011 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.087,"smiles":null,"spectrum_id":"CCMSLIB00017219551","spectrum_index":6871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 72.9806 Da; putative annotation: N/A; putative formula: CH-1NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.14,"smiles":null,"spectrum_id":"CCMSLIB00017219554","spectrum_index":6872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 120.0539 Da; putative annotation: N/A; putative formula: C3H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.265,"smiles":null,"spectrum_id":"CCMSLIB00017219556","spectrum_index":6873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 334.1621 Da; putative annotation: N/A; putative formula: C20H22N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.228,"smiles":null,"spectrum_id":"CCMSLIB00017219557","spectrum_index":6874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 114.0681 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.159,"smiles":null,"spectrum_id":"CCMSLIB00017219558","spectrum_index":6875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 72.0576 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017219561","spectrum_index":6876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381166-01_C15H26O3_ (delta mass: 170.1464 Da; putative annotation: N/A; putative formula: C14H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.342,"smiles":null,"spectrum_id":"CCMSLIB00017219563","spectrum_index":6877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzoic acid (delta mass: 123.0319 Da; putative annotation: N/A; putative formula: C6H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.071,"smiles":null,"spectrum_id":"CCMSLIB00017219564","spectrum_index":6878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Phenylpropyl)piperidine (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.196,"smiles":null,"spectrum_id":"CCMSLIB00017219565","spectrum_index":6879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-20-one (delta mass: 106.0736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.332,"smiles":null,"spectrum_id":"CCMSLIB00017219567","spectrum_index":6880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 133.1104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.223,"smiles":null,"spectrum_id":"CCMSLIB00017219570","spectrum_index":6881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017219571","spectrum_index":6882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,8,11,14-Eicosatetraenoic acid, 16-hydroxy-, (5Z,8Z,11Z,14Z,16S)- (delta mass: 281.2715 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.514,"smiles":null,"spectrum_id":"CCMSLIB00017219572","spectrum_index":6883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 22.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.17,"smiles":null,"spectrum_id":"CCMSLIB00017219574","spectrum_index":6884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-5-(1-piperidinylcarbonyl)aniline (delta mass: 51.0443 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.139,"smiles":null,"spectrum_id":"CCMSLIB00017219577","spectrum_index":6885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 278.1305 Da; putative annotation: N/A; putative formula: C19H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.243,"smiles":null,"spectrum_id":"CCMSLIB00017219578","spectrum_index":6886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 8.0087 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.1,"smiles":null,"spectrum_id":"CCMSLIB00017219579","spectrum_index":6887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 225.1311 Da; putative annotation: N/A; putative formula: C11H19N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.228,"smiles":null,"spectrum_id":"CCMSLIB00017219581","spectrum_index":6888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 264.1213 Da; putative annotation: N/A; putative formula: C14H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.202,"smiles":null,"spectrum_id":"CCMSLIB00017219584","spectrum_index":6889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 115.0272 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017219585","spectrum_index":6890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 107.0584 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.097,"smiles":null,"spectrum_id":"CCMSLIB00017219586","spectrum_index":6891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 120.041 Da; putative annotation: N/A; putative formula: C8H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.138,"smiles":null,"spectrum_id":"CCMSLIB00017219588","spectrum_index":6892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of rac-all-trans-4-Hydroxyretinal (delta mass: 74.052 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.268,"smiles":null,"spectrum_id":"CCMSLIB00017219590","spectrum_index":6893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 63.0298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.189,"smiles":null,"spectrum_id":"CCMSLIB00017219592","spectrum_index":6894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 104.012 Da; putative annotation: N/A; putative formula: C4H8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.275,"smiles":null,"spectrum_id":"CCMSLIB00017219594","spectrum_index":6895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 125.0477 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.17,"smiles":null,"spectrum_id":"CCMSLIB00017219595","spectrum_index":6896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 61.9458 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.096,"smiles":null,"spectrum_id":"CCMSLIB00017219597","spectrum_index":6897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 175.9621 Da; putative annotation: N/A; putative formula: C6N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.138,"smiles":null,"spectrum_id":"CCMSLIB00017219599","spectrum_index":6898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-TRIHYDROXYBENZOIC ACID\"\" (delta mass: 270.0523 Da; putative annotation: 2',5,6',7-Tetrahydroxyflavanone; putative formula: C15H10O5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.081,"smiles":null,"spectrum_id":"CCMSLIB00017219601","spectrum_index":6899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 306.2548 Da; putative annotation: 13[(2R,3S)-3-Pentyloxiranyl]-8Z-tridecenoic acid; putative formula: C20H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.497,"smiles":null,"spectrum_id":"CCMSLIB00017219602","spectrum_index":6900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 294.2192 Da; putative annotation: (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid; putative formula: C18H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.462,"smiles":null,"spectrum_id":"CCMSLIB00017219604","spectrum_index":6901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 292.2064 Da; putative annotation: Spectral Match to 9(S)-HpOTrE from NIST14; putative formula: C18H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.417,"smiles":null,"spectrum_id":"CCMSLIB00017219607","spectrum_index":6902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of chenodeoxycholic acid CollisionEnergy:205060 (delta mass: 334.2536 Da; putative annotation: 1-Monolinolenin; putative formula: C21H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.554,"smiles":null,"spectrum_id":"CCMSLIB00017219608","spectrum_index":6903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 280.2743 Da; putative annotation: Pristanic acid; putative formula: C19H36O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.485,"smiles":null,"spectrum_id":"CCMSLIB00017219610","spectrum_index":6904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 262.1548 Da; putative annotation: Brefeldin A; putative formula: C16H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.278,"smiles":null,"spectrum_id":"CCMSLIB00017219612","spectrum_index":6905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 218.12 Da; putative annotation: 5',6',7',8'-Tetrahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione; putative formula: C13H18N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.31,"smiles":null,"spectrum_id":"CCMSLIB00017219613","spectrum_index":6906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 307.288 Da; putative annotation: MLS002153155-01!N-Oleoylethanolamine111-58-0; putative formula: C20H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.536,"smiles":null,"spectrum_id":"CCMSLIB00017219614","spectrum_index":6907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 371.2886 Da; putative annotation: N-Arachidonoyl-.gamma.-aminobutyric acid; putative formula: C24H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.369,"smiles":null,"spectrum_id":"CCMSLIB00017219616","spectrum_index":6908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurane-17,18-dioic acid (delta mass: 282.2537 Da; putative annotation: Spectral Match to 3-Hydroxyoctadecanoic Acid from NIST14; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.475,"smiles":null,"spectrum_id":"CCMSLIB00017219617","spectrum_index":6909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 156.1144 Da; putative annotation: 9-Hydroxynonanoic acid; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.221,"smiles":null,"spectrum_id":"CCMSLIB00017219620","spectrum_index":6910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 196.2191 Da; putative annotation: N/A; putative formula: C14H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.29,"smiles":null,"spectrum_id":"CCMSLIB00017219621","spectrum_index":6911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-methoxybenzenemethanol (delta mass: 122.1095 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017219623","spectrum_index":6912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jasmonic acid (delta mass: 80.0623 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017219624","spectrum_index":6913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 16.9691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.217,"smiles":null,"spectrum_id":"CCMSLIB00017219627","spectrum_index":6914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 116.0985 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.33,"smiles":null,"spectrum_id":"CCMSLIB00017219629","spectrum_index":6915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 86.0513 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.309,"smiles":null,"spectrum_id":"CCMSLIB00017219630","spectrum_index":6916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 53.0501 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.261,"smiles":null,"spectrum_id":"CCMSLIB00017219631","spectrum_index":6917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 284.147 Da; putative annotation: N/A; putative formula: C14H25N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.27,"smiles":null,"spectrum_id":"CCMSLIB00017219633","spectrum_index":6918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 450.2132 Da; putative annotation: N/A; putative formula: C19H35N2O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":744.331,"smiles":null,"spectrum_id":"CCMSLIB00017219635","spectrum_index":6919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 207.0664 Da; putative annotation: N/A; putative formula: C7H14NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.163,"smiles":null,"spectrum_id":"CCMSLIB00017219637","spectrum_index":6920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid CollisionEnergy:205060 (delta mass: 176.0655 Da; putative annotation: N/A; putative formula: C3H8N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.115,"smiles":null,"spectrum_id":"CCMSLIB00017219638","spectrum_index":6921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 341.7976 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.858,"smiles":null,"spectrum_id":"CCMSLIB00017219641","spectrum_index":6922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 345.6985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.79,"smiles":null,"spectrum_id":"CCMSLIB00017219642","spectrum_index":6923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 224.0686 Da; putative annotation: N/A; putative formula: C11H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.118,"smiles":null,"spectrum_id":"CCMSLIB00017219644","spectrum_index":6924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 110.0727 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.325,"smiles":null,"spectrum_id":"CCMSLIB00017219645","spectrum_index":6925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 230.1594 Da; putative annotation: N/A; putative formula: C16H23O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.214,"smiles":null,"spectrum_id":"CCMSLIB00017219647","spectrum_index":6926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 28.0319 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.227,"smiles":null,"spectrum_id":"CCMSLIB00017219648","spectrum_index":6927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Hydroxy-L-proline (delta mass: 27.011 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.077,"smiles":null,"spectrum_id":"CCMSLIB00017219650","spectrum_index":6928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 6.3661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.5,"smiles":null,"spectrum_id":"CCMSLIB00017219652","spectrum_index":6929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.091,"smiles":null,"spectrum_id":"CCMSLIB00017219654","spectrum_index":6930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 173.0689 Da; putative annotation: N/A; putative formula: C7H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.207,"smiles":null,"spectrum_id":"CCMSLIB00017219655","spectrum_index":6931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CINNAMIC ACID (delta mass: 166.0627 Da; putative annotation: N/A; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.122,"smiles":null,"spectrum_id":"CCMSLIB00017219657","spectrum_index":6932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.,24(S)-Dihydroxycholesterol (delta mass: 116.0993 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.451,"smiles":null,"spectrum_id":"CCMSLIB00017219659","spectrum_index":6933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 58.9525 Da; putative annotation: N/A; putative formula: H-2NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.091,"smiles":null,"spectrum_id":"CCMSLIB00017219661","spectrum_index":6934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 399.2618 Da; putative annotation: N/A; putative formula: C21H37NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.333,"smiles":null,"spectrum_id":"CCMSLIB00017219662","spectrum_index":6935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 398.1433 Da; putative annotation: N/A; putative formula: C16H30O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.359,"smiles":null,"spectrum_id":"CCMSLIB00017219665","spectrum_index":6936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxy-4Z,7Z,9E,13Z,16Z,19Z-docosahexaenoic acid (delta mass: 32.0276 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.27,"smiles":null,"spectrum_id":"CCMSLIB00017219667","spectrum_index":6937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 212.1206 Da; putative annotation: N/A; putative formula: C8H16N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017219668","spectrum_index":6938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-8,11,14-Eicosatrienoic acid from NIST14 (delta mass: 108.094 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.357,"smiles":null,"spectrum_id":"CCMSLIB00017219669","spectrum_index":6939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroluciferin (delta mass: 27.0433 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.033,"smiles":null,"spectrum_id":"CCMSLIB00017219671","spectrum_index":6940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 76.0661 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.341,"smiles":null,"spectrum_id":"CCMSLIB00017219674","spectrum_index":6941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 311.282 Da; putative annotation: N/A; putative formula: C19H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.54,"smiles":null,"spectrum_id":"CCMSLIB00017219675","spectrum_index":6942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 48.0206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.268,"smiles":null,"spectrum_id":"CCMSLIB00017219676","spectrum_index":6943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sumaresinolic acid (delta mass: 186.1472 Da; putative annotation: N/A; putative formula: C8H18N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.51,"smiles":null,"spectrum_id":"CCMSLIB00017219678","spectrum_index":6944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 397.1736 Da; putative annotation: N/A; putative formula: C19H27NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.244,"smiles":null,"spectrum_id":"CCMSLIB00017219681","spectrum_index":6945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-(-)-Nopol CollisionEnergy:102040 (delta mass: 100.0169 Da; putative annotation: N/A; putative formula: C5N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.16,"smiles":null,"spectrum_id":"CCMSLIB00017219682","spectrum_index":6946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 142.109 Da; putative annotation: N/A; putative formula: C3H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.357,"smiles":null,"spectrum_id":"CCMSLIB00017219683","spectrum_index":6947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-hydroxy-9,12,13-trimethyl-14-(2-methylpropyl)-2H,5H,6H,7H,8H,13H,13aH,14H,15H,16H,16bH-oxacyclododeca[3,2-e]isoindole-2,16-dione (delta mass: 78.0146 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.279,"smiles":null,"spectrum_id":"CCMSLIB00017219684","spectrum_index":6948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 124.0969 Da; putative annotation: N/A; putative formula: C7H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.219,"smiles":null,"spectrum_id":"CCMSLIB00017219687","spectrum_index":6949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 80.0991 Da; putative annotation: N/A; putative formula: C7H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.242,"smiles":null,"spectrum_id":"CCMSLIB00017219689","spectrum_index":6950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLIC ACID (delta mass: 145.0528 Da; putative annotation: N/A; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.092,"smiles":null,"spectrum_id":"CCMSLIB00017219690","spectrum_index":6951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 514.3346 Da; putative annotation: N/A; putative formula: C37H42N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.426,"smiles":null,"spectrum_id":"CCMSLIB00017219691","spectrum_index":6952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 102.0823 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.293,"smiles":null,"spectrum_id":"CCMSLIB00017219693","spectrum_index":6953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 343.2383 Da; putative annotation: N/A; putative formula: C17H34N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.46,"smiles":null,"spectrum_id":"CCMSLIB00017219696","spectrum_index":6954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 218.1896 Da; putative annotation: N/A; putative formula: C13H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.26,"smiles":null,"spectrum_id":"CCMSLIB00017219697","spectrum_index":6955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 91.0419 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.081,"smiles":null,"spectrum_id":"CCMSLIB00017219698","spectrum_index":6956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 325.3001 Da; putative annotation: N/A; putative formula: C19H40N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.527,"smiles":null,"spectrum_id":"CCMSLIB00017219700","spectrum_index":6957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Oxoandrostenediol (delta mass: 66.0479 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.259,"smiles":null,"spectrum_id":"CCMSLIB00017219703","spectrum_index":6958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 397.0271 Da; putative annotation: N/A; putative formula: C20H15NO2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.087,"smiles":null,"spectrum_id":"CCMSLIB00017219704","spectrum_index":6959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 241.1595 Da; putative annotation: N/A; putative formula: C13H24NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.272,"smiles":null,"spectrum_id":"CCMSLIB00017219705","spectrum_index":6960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 70.0419 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017219707","spectrum_index":6961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 52.0678 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.149,"smiles":null,"spectrum_id":"CCMSLIB00017219710","spectrum_index":6962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 50.0136 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.209,"smiles":null,"spectrum_id":"CCMSLIB00017219711","spectrum_index":6963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 143.0269 Da; putative annotation: N/A; putative formula: C3H5N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.098,"smiles":null,"spectrum_id":"CCMSLIB00017219712","spectrum_index":6964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,3-Difluoroazetidin-1-yl)piperidine (delta mass: 40.0348 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.155,"smiles":null,"spectrum_id":"CCMSLIB00017219713","spectrum_index":6965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oleoyl-1-palmitoyl-sn-glycero-3-phosphoserine (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":818.591,"smiles":null,"spectrum_id":"CCMSLIB00017219715","spectrum_index":6966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.alpha.-estrane-3.alpha.,17.beta.-diol (delta mass: 74.0515 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.315,"smiles":null,"spectrum_id":"CCMSLIB00017219718","spectrum_index":6967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Piperidin-3-yl)methanesulfonamide (delta mass: 69.0647 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.15,"smiles":null,"spectrum_id":"CCMSLIB00017219719","spectrum_index":6968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380958-01!2-[[2-[2-[2-[2-[[2-[2-(2-hydroxypropanoylamino)-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoyl]oxypropanoylamino]-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoic acid (delta mass: 370.2101 Da; putative annotation: N/A; putative formula: C18H30N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1129.65,"smiles":null,"spectrum_id":"CCMSLIB00017219720","spectrum_index":6969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Cyclohexanecarbonylpentadecylamine from NIST14 (delta mass: 44.8238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.165,"smiles":null,"spectrum_id":"CCMSLIB00017219722","spectrum_index":6970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 236.0949 Da; putative annotation: N/A; putative formula: C15H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.222,"smiles":null,"spectrum_id":"CCMSLIB00017219725","spectrum_index":6971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 13.9916 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.218,"smiles":null,"spectrum_id":"CCMSLIB00017219726","spectrum_index":6972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethyl-1,3,5-triazin-2-ylamine (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.093,"smiles":null,"spectrum_id":"CCMSLIB00017219727","spectrum_index":6973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 404.4007 Da; putative annotation: N/A; putative formula: C28H52O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.492,"smiles":null,"spectrum_id":"CCMSLIB00017219729","spectrum_index":6974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidine (delta mass: 127.0642 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.244,"smiles":null,"spectrum_id":"CCMSLIB00017219732","spectrum_index":6975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 152.0907 Da; putative annotation: N/A; putative formula: C4H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.338,"smiles":null,"spectrum_id":"CCMSLIB00017219733","spectrum_index":6976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nordeprenyl (delta mass: 144.0698 Da; putative annotation: N/A; putative formula: C7H13OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.198,"smiles":null,"spectrum_id":"CCMSLIB00017219734","spectrum_index":6977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 296.0499 Da; putative annotation: N/A; putative formula: C9H16N2O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.11,"smiles":null,"spectrum_id":"CCMSLIB00017219735","spectrum_index":6978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 99.8056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.87,"smiles":null,"spectrum_id":"CCMSLIB00017219738","spectrum_index":6979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 14.0509 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.116,"smiles":null,"spectrum_id":"CCMSLIB00017219740","spectrum_index":6980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 38.0846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.129,"smiles":null,"spectrum_id":"CCMSLIB00017219741","spectrum_index":6981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 215.1002 Da; putative annotation: N/A; putative formula: C9H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.165,"smiles":null,"spectrum_id":"CCMSLIB00017219743","spectrum_index":6982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdesmethoxycurcumin (delta mass: 324.1118 Da; putative annotation: N/A; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.224,"smiles":null,"spectrum_id":"CCMSLIB00017219745","spectrum_index":6983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 268.0369 Da; putative annotation: N/A; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.213,"smiles":null,"spectrum_id":"CCMSLIB00017219747","spectrum_index":6984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 267.2205 Da; putative annotation: N/A; putative formula: C16H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.479,"smiles":null,"spectrum_id":"CCMSLIB00017219748","spectrum_index":6985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 64.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.128,"smiles":null,"spectrum_id":"CCMSLIB00017219751","spectrum_index":6986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 117.0431 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.119,"smiles":null,"spectrum_id":"CCMSLIB00017219753","spectrum_index":6987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uric acid (delta mass: 40.0544 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.09,"smiles":null,"spectrum_id":"CCMSLIB00017219754","spectrum_index":6988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 165.1359 Da; putative annotation: N/A; putative formula: C8H15N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.352,"smiles":null,"spectrum_id":"CCMSLIB00017219756","spectrum_index":6989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 77.0303 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.111,"smiles":null,"spectrum_id":"CCMSLIB00017219758","spectrum_index":6990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 97.0739 Da; putative annotation: N/A; putative formula: C3H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.285,"smiles":null,"spectrum_id":"CCMSLIB00017219759","spectrum_index":6991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 138.0793 Da; putative annotation: N/A; putative formula: C7H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.166,"smiles":null,"spectrum_id":"CCMSLIB00017219760","spectrum_index":6992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 194.0603 Da; putative annotation: N/A; putative formula: C9H11N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.141,"smiles":null,"spectrum_id":"CCMSLIB00017219763","spectrum_index":6993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 284.0907 Da; putative annotation: N/A; putative formula: C14H20O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.151,"smiles":null,"spectrum_id":"CCMSLIB00017219765","spectrum_index":6994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 99.0691 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.129,"smiles":null,"spectrum_id":"CCMSLIB00017219766","spectrum_index":6995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 120.998 Da; putative annotation: N/A; putative formula: C6H3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.042,"smiles":null,"spectrum_id":"CCMSLIB00017219767","spectrum_index":6996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347773-02!1-[4,5-bis(hydroxymethyl)-3-methoxy-2-methylphenoxy]-3-methylbutane-2,3-diol (delta mass: 31.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.209,"smiles":null,"spectrum_id":"CCMSLIB00017219769","spectrum_index":6997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 604.3665 Da; putative annotation: N/A; putative formula: C40H48N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.468,"smiles":null,"spectrum_id":"CCMSLIB00017219771","spectrum_index":6998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of QuinicAcid (delta mass: 149.0473 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.118,"smiles":null,"spectrum_id":"CCMSLIB00017219773","spectrum_index":6999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid (delta mass: 97.9651 Da; putative annotation: N/A; putative formula: C4H2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.119,"smiles":null,"spectrum_id":"CCMSLIB00017219774","spectrum_index":7000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 134.084 Da; putative annotation: N/A; putative formula: C8H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.125,"smiles":null,"spectrum_id":"CCMSLIB00017219776","spectrum_index":7001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 70.0791 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.139,"smiles":null,"spectrum_id":"CCMSLIB00017219778","spectrum_index":7002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 57.0212 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017219780","spectrum_index":7003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 300.0515 Da; putative annotation: N/A; putative formula: C9H16O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.158,"smiles":null,"spectrum_id":"CCMSLIB00017219781","spectrum_index":7004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 297.2725 Da; putative annotation: N/A; putative formula: C17H36N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.515,"smiles":null,"spectrum_id":"CCMSLIB00017219783","spectrum_index":7005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 230.19 Da; putative annotation: N/A; putative formula: C14H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.312,"smiles":null,"spectrum_id":"CCMSLIB00017219785","spectrum_index":7006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 323.19 Da; putative annotation: N/A; putative formula: C14H25N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.265,"smiles":null,"spectrum_id":"CCMSLIB00017219786","spectrum_index":7007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORADRENALINE (delta mass: 83.0366 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017219788","spectrum_index":7008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 75.959 Da; putative annotation: N/A; putative formula: CO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.098,"smiles":null,"spectrum_id":"CCMSLIB00017219789","spectrum_index":7009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydroprostaglandin F2.alpha. (delta mass: 75.9935 Da; putative annotation: N/A; putative formula: C5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.257,"smiles":null,"spectrum_id":"CCMSLIB00017219792","spectrum_index":7010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15(R)-15-Methylprostaglandin D2 (delta mass: 43.0414 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.289,"smiles":null,"spectrum_id":"CCMSLIB00017219794","spectrum_index":7011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 114.0679 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.26,"smiles":null,"spectrum_id":"CCMSLIB00017219795","spectrum_index":7012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 147.0319 Da; putative annotation: N/A; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.08,"smiles":null,"spectrum_id":"CCMSLIB00017219796","spectrum_index":7013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 215.0969 Da; putative annotation: N/A; putative formula: C12H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.173,"smiles":null,"spectrum_id":"CCMSLIB00017219798","spectrum_index":7014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 491.3817 Da; putative annotation: N/A; putative formula: C26H53NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.442,"smiles":null,"spectrum_id":"CCMSLIB00017219799","spectrum_index":7015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP012803 Benzoic acid (delta mass: 32.0627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.107,"smiles":null,"spectrum_id":"CCMSLIB00017219802","spectrum_index":7016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 430.2698 Da; putative annotation: N/A; putative formula: C30H38S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.507,"smiles":null,"spectrum_id":"CCMSLIB00017219804","spectrum_index":7017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.169,"smiles":null,"spectrum_id":"CCMSLIB00017219805","spectrum_index":7018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 335.2436 Da; putative annotation: N/A; putative formula: C16H29N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.372,"smiles":null,"spectrum_id":"CCMSLIB00017219806","spectrum_index":7019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylcyclohexaneacetic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017219809","spectrum_index":7020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 427.2112 Da; putative annotation: N/A; putative formula: C16H29N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.324,"smiles":null,"spectrum_id":"CCMSLIB00017219811","spectrum_index":7021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 894.2849 Da; putative annotation: N/A; putative formula: C47H46N2O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1057.34,"smiles":null,"spectrum_id":"CCMSLIB00017219812","spectrum_index":7022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norgestrel (delta mass: 36.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017219815","spectrum_index":7023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 120.0938 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.352,"smiles":null,"spectrum_id":"CCMSLIB00017219817","spectrum_index":7024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 369.2372 Da; putative annotation: N/A; putative formula: C17H31N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.37,"smiles":null,"spectrum_id":"CCMSLIB00017219818","spectrum_index":7025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4'-Bipiperidin-3-ol (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.191,"smiles":null,"spectrum_id":"CCMSLIB00017219819","spectrum_index":7026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 46.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.07,"smiles":null,"spectrum_id":"CCMSLIB00017219821","spectrum_index":7027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 120.0466 Da; putative annotation: N/A; putative formula: C2H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.181,"smiles":null,"spectrum_id":"CCMSLIB00017219824","spectrum_index":7028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 127.042 Da; putative annotation: N/A; putative formula: C9H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.123,"smiles":null,"spectrum_id":"CCMSLIB00017219825","spectrum_index":7029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Cyclopentylpropyl)methylamine (delta mass: 534.5128 Da; putative annotation: N/A; putative formula: C34H66N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.672,"smiles":null,"spectrum_id":"CCMSLIB00017219826","spectrum_index":7030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 51.9982 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.058,"smiles":null,"spectrum_id":"CCMSLIB00017219829","spectrum_index":7031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 182.0724 Da; putative annotation: N/A; putative formula: C7H11N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.19,"smiles":null,"spectrum_id":"CCMSLIB00017219831","spectrum_index":7032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine D (delta mass: 294.1737 Da; putative annotation: N/A; putative formula: C12H22N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.355,"smiles":null,"spectrum_id":"CCMSLIB00017219832","spectrum_index":7033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 193.0406 Da; putative annotation: N/A; putative formula: C8H8N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.105,"smiles":null,"spectrum_id":"CCMSLIB00017219834","spectrum_index":7034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 86.0554 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.131,"smiles":null,"spectrum_id":"CCMSLIB00017219837","spectrum_index":7035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 43.0424 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.113,"smiles":null,"spectrum_id":"CCMSLIB00017219838","spectrum_index":7036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 620.2104 Da; putative annotation: N/A; putative formula: C30H36O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":826.292,"smiles":null,"spectrum_id":"CCMSLIB00017219839","spectrum_index":7037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 118.0821 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.33,"smiles":null,"spectrum_id":"CCMSLIB00017219841","spectrum_index":7038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 172.162 Da; putative annotation: N/A; putative formula: C14H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.373,"smiles":null,"spectrum_id":"CCMSLIB00017219843","spectrum_index":7039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 757.2199 Da; putative annotation: N/A; putative formula: C33H39N7O10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":920.28,"smiles":null,"spectrum_id":"CCMSLIB00017219845","spectrum_index":7040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 992.3065 Da; putative annotation: N/A; putative formula: C54H52N6O7S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1155.37,"smiles":null,"spectrum_id":"CCMSLIB00017219846","spectrum_index":7041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 829.7681 Da; putative annotation: N/A; putative formula: C57H99NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":992.828,"smiles":null,"spectrum_id":"CCMSLIB00017219849","spectrum_index":7042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 39.995 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.05,"smiles":null,"spectrum_id":"CCMSLIB00017219850","spectrum_index":7043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1064.5426 Da; putative annotation: N/A; putative formula: C66H76N6O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1227.6,"smiles":null,"spectrum_id":"CCMSLIB00017219851","spectrum_index":7044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 82.8619 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.939,"smiles":null,"spectrum_id":"CCMSLIB00017219853","spectrum_index":7045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 36.0468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.206,"smiles":null,"spectrum_id":"CCMSLIB00017219855","spectrum_index":7046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 295.2176 Da; putative annotation: N/A; putative formula: C16H30N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.46,"smiles":null,"spectrum_id":"CCMSLIB00017219857","spectrum_index":7047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 26.0342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.11,"smiles":null,"spectrum_id":"CCMSLIB00017219858","spectrum_index":7048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 240.2196 Da; putative annotation: N/A; putative formula: C14H28N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.535,"smiles":null,"spectrum_id":"CCMSLIB00017219861","spectrum_index":7049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 373.1491 Da; putative annotation: N/A; putative formula: C18H24N5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.298,"smiles":null,"spectrum_id":"CCMSLIB00017219862","spectrum_index":7050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 57.0208 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.117,"smiles":null,"spectrum_id":"CCMSLIB00017219864","spectrum_index":7051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 54.0106 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.108,"smiles":null,"spectrum_id":"CCMSLIB00017219866","spectrum_index":7052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 307.1752 Da; putative annotation: N/A; putative formula: C13H29N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.334,"smiles":null,"spectrum_id":"CCMSLIB00017219868","spectrum_index":7053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Eicosenoic acid (delta mass: 126.1407 Da; putative annotation: N/A; putative formula: C9H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.435,"smiles":null,"spectrum_id":"CCMSLIB00017219870","spectrum_index":7054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,11E,13E)-18-(2,6-Dioxopiperidin-4-yl)-9-hydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11,13-tetraenoic acid (delta mass: 76.0372 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.317,"smiles":null,"spectrum_id":"CCMSLIB00017219872","spectrum_index":7055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 128.1659 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017219874","spectrum_index":7056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 219.9564 Da; putative annotation: N/A; putative formula: C9HO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.038,"smiles":null,"spectrum_id":"CCMSLIB00017219875","spectrum_index":7057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 134.0738 Da; putative annotation: N/A; putative formula: C2H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.358,"smiles":null,"spectrum_id":"CCMSLIB00017219876","spectrum_index":7058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 33.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017219877","spectrum_index":7059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017219881","spectrum_index":7060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methylquinoline-2-carboxylic acid CollisionEnergy:205060 (delta mass: 283.2845 Da; putative annotation: N/A; putative formula: C14H33N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.355,"smiles":null,"spectrum_id":"CCMSLIB00017219882","spectrum_index":7061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 16.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.092,"smiles":null,"spectrum_id":"CCMSLIB00017219883","spectrum_index":7062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Resorcylic acid (delta mass: 92.0988 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017219884","spectrum_index":7063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin analogue LVR (or VLR) (delta mass: 15.9093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.196,"smiles":null,"spectrum_id":"CCMSLIB00017219888","spectrum_index":7064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 75.0137 Da; putative annotation: N/A; putative formula: C2H5NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.095,"smiles":null,"spectrum_id":"CCMSLIB00017219889","spectrum_index":7065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 354.2672 Da; putative annotation: N/A; putative formula: C23H34N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.318,"smiles":null,"spectrum_id":"CCMSLIB00017219890","spectrum_index":7066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid CollisionEnergy:205060 (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.378,"smiles":null,"spectrum_id":"CCMSLIB00017219892","spectrum_index":7067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 455.216 Da; putative annotation: N/A; putative formula: C25H34N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.276,"smiles":null,"spectrum_id":"CCMSLIB00017219894","spectrum_index":7068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 83.9887 Da; putative annotation: N/A; putative formula: CN4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.086,"smiles":null,"spectrum_id":"CCMSLIB00017219895","spectrum_index":7069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 409.2314 Da; putative annotation: N/A; putative formula: C18H35NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.38,"smiles":null,"spectrum_id":"CCMSLIB00017219896","spectrum_index":7070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .omega.-3 Arachidonic acid (delta mass: 320.272 Da; putative annotation: N/A; putative formula: C21H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.519,"smiles":null,"spectrum_id":"CCMSLIB00017219898","spectrum_index":7071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperazinyl)acetamide (delta mass: 18.0122 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.125,"smiles":null,"spectrum_id":"CCMSLIB00017219901","spectrum_index":7072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptamine (delta mass: 86.0376 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017219902","spectrum_index":7073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 32.0328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.234,"smiles":null,"spectrum_id":"CCMSLIB00017219903","spectrum_index":7074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 73.1158 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.191,"smiles":null,"spectrum_id":"CCMSLIB00017219905","spectrum_index":7075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyclopropylmethyl)piperazine (delta mass: 54.0894 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.228,"smiles":null,"spectrum_id":"CCMSLIB00017219908","spectrum_index":7076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 142.0378 Da; putative annotation: N/A; putative formula: C5H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.166,"smiles":null,"spectrum_id":"CCMSLIB00017219910","spectrum_index":7077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 226.0613 Da; putative annotation: N/A; putative formula: C14H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.132,"smiles":null,"spectrum_id":"CCMSLIB00017219911","spectrum_index":7078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Allotetrahydrocortisol (delta mass: 146.0767 Da; putative annotation: N/A; putative formula: C7H14OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.325,"smiles":null,"spectrum_id":"CCMSLIB00017219912","spectrum_index":7079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 178.1031 Da; putative annotation: N/A; putative formula: C10H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.351,"smiles":null,"spectrum_id":"CCMSLIB00017219916","spectrum_index":7080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 61.0397 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.1,"smiles":null,"spectrum_id":"CCMSLIB00017219917","spectrum_index":7081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA001639 Coniine (delta mass: 73.0421 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.186,"smiles":null,"spectrum_id":"CCMSLIB00017219918","spectrum_index":7082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 57.988 Da; putative annotation: N/A; putative formula: C2H2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.241,"smiles":null,"spectrum_id":"CCMSLIB00017219920","spectrum_index":7083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 217.2034 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.493,"smiles":null,"spectrum_id":"CCMSLIB00017219923","spectrum_index":7084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .delta.-Tocotrienol (delta mass: 17.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.335,"smiles":null,"spectrum_id":"CCMSLIB00017219924","spectrum_index":7085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 153.0547 Da; putative annotation: N/A; putative formula: C6H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.13,"smiles":null,"spectrum_id":"CCMSLIB00017219925","spectrum_index":7086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 41.0699 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017219926","spectrum_index":7087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 141.0979 Da; putative annotation: N/A; putative formula: C8H15NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.163,"smiles":null,"spectrum_id":"CCMSLIB00017219930","spectrum_index":7088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CLE_291.1026_12.2 (delta mass: 56.0804 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.183,"smiles":null,"spectrum_id":"CCMSLIB00017219931","spectrum_index":7089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 30.0471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.107,"smiles":null,"spectrum_id":"CCMSLIB00017219932","spectrum_index":7090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 283.2875 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.411,"smiles":null,"spectrum_id":"CCMSLIB00017219933","spectrum_index":7091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Piperazin-1-yl)ethanamine (delta mass: 83.9248 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.059,"smiles":null,"spectrum_id":"CCMSLIB00017219935","spectrum_index":7092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylhistamine CollisionEnergy:102040 (delta mass: 92.0318 Da; putative annotation: N/A; putative formula: H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.134,"smiles":null,"spectrum_id":"CCMSLIB00017219938","spectrum_index":7093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Felbinac (delta mass: 14.982 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.073,"smiles":null,"spectrum_id":"CCMSLIB00017219939","spectrum_index":7094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 27.9366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.043,"smiles":null,"spectrum_id":"CCMSLIB00017219940","spectrum_index":7095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 65.0384 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.136,"smiles":null,"spectrum_id":"CCMSLIB00017219942","spectrum_index":7096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 275.1013 Da; putative annotation: N/A; putative formula: C12H21NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.256,"smiles":null,"spectrum_id":"CCMSLIB00017219945","spectrum_index":7097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00821 Isorhamnetin-3,7-di-O-glucoside (delta mass: 162.0528 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.224,"smiles":null,"spectrum_id":"CCMSLIB00017219946","spectrum_index":7098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Methoxyphenyl)acetic acid (delta mass: 28.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.138,"smiles":null,"spectrum_id":"CCMSLIB00017219947","spectrum_index":7099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luciferin (delta mass: 60.027 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.032,"smiles":null,"spectrum_id":"CCMSLIB00017219949","spectrum_index":7100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bonactin (delta mass: 415.2568 Da; putative annotation: N/A; putative formula: C21H37NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.51,"smiles":null,"spectrum_id":"CCMSLIB00017219952","spectrum_index":7101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.077,"smiles":null,"spectrum_id":"CCMSLIB00017219953","spectrum_index":7102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 166.9852 Da; putative annotation: N/A; putative formula: C6HNO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.045,"smiles":null,"spectrum_id":"CCMSLIB00017219954","spectrum_index":7103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 445.1674 Da; putative annotation: N/A; putative formula: C22H27N3O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.208,"smiles":null,"spectrum_id":"CCMSLIB00017219955","spectrum_index":7104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 262.1312 Da; putative annotation: N/A; putative formula: C16H23O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.234,"smiles":null,"spectrum_id":"CCMSLIB00017219959","spectrum_index":7105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 220.094 Da; putative annotation: N/A; putative formula: C13H18O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.18,"smiles":null,"spectrum_id":"CCMSLIB00017219960","spectrum_index":7106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,8Z,14Z-Eicosatrienoic acid (delta mass: 50.0364 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.3,"smiles":null,"spectrum_id":"CCMSLIB00017219961","spectrum_index":7107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 407.3243 Da; putative annotation: N/A; putative formula: C18H37N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.541,"smiles":null,"spectrum_id":"CCMSLIB00017219962","spectrum_index":7108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol, 1-[2-(2,4-dimethylphenyl)diazenyl]- (delta mass: 135.079 Da; putative annotation: N/A; putative formula: C7H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.212,"smiles":null,"spectrum_id":"CCMSLIB00017219965","spectrum_index":7109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 207.1171 Da; putative annotation: N/A; putative formula: C6H19N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.271,"smiles":null,"spectrum_id":"CCMSLIB00017219967","spectrum_index":7110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 381.325 Da; putative annotation: N/A; putative formula: C24H39N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.362,"smiles":null,"spectrum_id":"CCMSLIB00017219968","spectrum_index":7111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 448.3349 Da; putative annotation: N/A; putative formula: C24H44N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.427,"smiles":null,"spectrum_id":"CCMSLIB00017219970","spectrum_index":7112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 157.1003 Da; putative annotation: N/A; putative formula: C10H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.18,"smiles":null,"spectrum_id":"CCMSLIB00017219971","spectrum_index":7113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl tyramine (delta mass: 280.2751 Da; putative annotation: N/A; putative formula: C15H32N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.377,"smiles":null,"spectrum_id":"CCMSLIB00017219973","spectrum_index":7114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 106.0784 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017219974","spectrum_index":7115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA256101 Gabapentin|1-(Aminomethyl)cyclohexaneacetic acid| 2-[1-(aminomethyl)cyclohexyl]acetic acid (delta mass: 99.0324 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.166,"smiles":null,"spectrum_id":"CCMSLIB00017219976","spectrum_index":7116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 191.0785 Da; putative annotation: N/A; putative formula: C4H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.112,"smiles":null,"spectrum_id":"CCMSLIB00017219979","spectrum_index":7117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,,3S,5Z)-3-hydroxy-1,5-octadien-1-yl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5Z)- (delta mass: 463.2951 Da; putative annotation: N/A; putative formula: C27H37N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.532,"smiles":null,"spectrum_id":"CCMSLIB00017219980","spectrum_index":7118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 519.3767 Da; putative annotation: N/A; putative formula: C27H53NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.437,"smiles":null,"spectrum_id":"CCMSLIB00017219982","spectrum_index":7119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 67.9875 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.063,"smiles":null,"spectrum_id":"CCMSLIB00017219983","spectrum_index":7120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 25.0315 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017219985","spectrum_index":7121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 104.0259 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.112,"smiles":null,"spectrum_id":"CCMSLIB00017219987","spectrum_index":7122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 51.0322 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.202,"smiles":null,"spectrum_id":"CCMSLIB00017219989","spectrum_index":7123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Allyl-2,6-dimethoxyphenol (delta mass: 239.1525 Da; putative annotation: N/A; putative formula: C13H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.254,"smiles":null,"spectrum_id":"CCMSLIB00017219991","spectrum_index":7124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 174.0468 Da; putative annotation: N/A; putative formula: C14H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.17,"smiles":null,"spectrum_id":"CCMSLIB00017219992","spectrum_index":7125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 23.016 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.087,"smiles":null,"spectrum_id":"CCMSLIB00017219994","spectrum_index":7126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Oxo-11Z,13E-eicosadienoic acid (delta mass: 36.0358 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.294,"smiles":null,"spectrum_id":"CCMSLIB00017219995","spectrum_index":7127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 9.9878 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.163,"smiles":null,"spectrum_id":"CCMSLIB00017219997","spectrum_index":7128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002981 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 242.1342 Da; putative annotation: N/A; putative formula: C13H22O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.173,"smiles":null,"spectrum_id":"CCMSLIB00017219998","spectrum_index":7129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 246.11 Da; putative annotation: N/A; putative formula: C11H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.191,"smiles":null,"spectrum_id":"CCMSLIB00017220001","spectrum_index":7130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Bis[hydroxymethyl]-2,2',2''-nitrilotriethanol (delta mass: 233.0884 Da; putative annotation: N/A; putative formula: C13H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.222,"smiles":null,"spectrum_id":"CCMSLIB00017220002","spectrum_index":7131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 244.1789 Da; putative annotation: N/A; putative formula: C12H24N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.328,"smiles":null,"spectrum_id":"CCMSLIB00017220004","spectrum_index":7132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-trans-Myrtanol (delta mass: 31.8132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.956,"smiles":null,"spectrum_id":"CCMSLIB00017220006","spectrum_index":7133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-erythro-Sphinganine from NIST14 (delta mass: 9.9839 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.289,"smiles":null,"spectrum_id":"CCMSLIB00017220008","spectrum_index":7134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 37.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.264,"smiles":null,"spectrum_id":"CCMSLIB00017220010","spectrum_index":7135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine 5'-diphosphoribose (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.095,"smiles":null,"spectrum_id":"CCMSLIB00017220012","spectrum_index":7136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 387.0651 Da; putative annotation: N/A; putative formula: C17H9N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":842.417,"smiles":null,"spectrum_id":"CCMSLIB00017220014","spectrum_index":7137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 522.3328 Da; putative annotation: N/A; putative formula: C27H55O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.393,"smiles":null,"spectrum_id":"CCMSLIB00017220016","spectrum_index":7138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310841 LPC 18:3 (delta mass: 517.316 Da; putative annotation: N/A; putative formula: C29H47N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1035.64,"smiles":null,"spectrum_id":"CCMSLIB00017220017","spectrum_index":7139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 461.1749 Da; putative annotation: N/A; putative formula: C19H32N3O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.344,"smiles":null,"spectrum_id":"CCMSLIB00017220020","spectrum_index":7140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4'-Ethenyl-2'-hydroxy-1,4',4a-trimethyl-5-oxospiro[2,3,4,7,8,8a-hexahydronaphthalene-6,1'-cyclopentane]-1-carboxylic acid (delta mass: 532.2877 Da; putative annotation: N/A; putative formula: C39H36N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":867.509,"smiles":null,"spectrum_id":"CCMSLIB00017220022","spectrum_index":7141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecan-5-ol (delta mass: 54.0508 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.298,"smiles":null,"spectrum_id":"CCMSLIB00017220023","spectrum_index":7142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 236.0637 Da; putative annotation: N/A; putative formula: C9H17O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.317,"smiles":null,"spectrum_id":"CCMSLIB00017220026","spectrum_index":7143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 120.0942 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.218,"smiles":null,"spectrum_id":"CCMSLIB00017220027","spectrum_index":7144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Fluorophenyl)azepane (delta mass: 52.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017220029","spectrum_index":7145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 198.1379 Da; putative annotation: N/A; putative formula: C10H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.278,"smiles":null,"spectrum_id":"CCMSLIB00017220031","spectrum_index":7146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 196.0104 Da; putative annotation: N/A; putative formula: C9H9OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.092,"smiles":null,"spectrum_id":"CCMSLIB00017220033","spectrum_index":7147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.beta.,17.alpha.-Dimethyl-5.beta.-androstane-3.alpha.,17.beta.-diol (delta mass: 101.0834 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.362,"smiles":null,"spectrum_id":"CCMSLIB00017220034","spectrum_index":7148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Eicosenoic acid (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.332,"smiles":null,"spectrum_id":"CCMSLIB00017220035","spectrum_index":7149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Methylgallic acid (delta mass: 117.0998 Da; putative annotation: N/A; putative formula: C3H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.144,"smiles":null,"spectrum_id":"CCMSLIB00017220038","spectrum_index":7150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017220040","spectrum_index":7151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017220041","spectrum_index":7152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 950.3466 Da; putative annotation: N/A; putative formula: C49H58N8O4S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1172.44,"smiles":null,"spectrum_id":"CCMSLIB00017220043","spectrum_index":7153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 221.1631 Da; putative annotation: N/A; putative formula: C11H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.228,"smiles":null,"spectrum_id":"CCMSLIB00017220044","spectrum_index":7154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 264.3124 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.393,"smiles":null,"spectrum_id":"CCMSLIB00017220046","spectrum_index":7155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 85.0524 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.149,"smiles":null,"spectrum_id":"CCMSLIB00017220048","spectrum_index":7156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 91.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.149,"smiles":null,"spectrum_id":"CCMSLIB00017220050","spectrum_index":7157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 183.8883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.964,"smiles":null,"spectrum_id":"CCMSLIB00017220052","spectrum_index":7158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Castanospermine (delta mass: 319.1033 Da; putative annotation: N/A; putative formula: C20H17NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.211,"smiles":null,"spectrum_id":"CCMSLIB00017220053","spectrum_index":7159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 292.1593 Da; putative annotation: N/A; putative formula: C17H25O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.345,"smiles":null,"spectrum_id":"CCMSLIB00017220055","spectrum_index":7160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Docosenoic acid (delta mass: 16.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.368,"smiles":null,"spectrum_id":"CCMSLIB00017220058","spectrum_index":7161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP007402 Glycohyocholic acid|AM022340|2-[4-(3,6,7-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid (delta mass: 176.032 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.348,"smiles":null,"spectrum_id":"CCMSLIB00017220059","spectrum_index":7162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. alcohol methyl ether (delta mass: 313.1895 Da; putative annotation: N/A; putative formula: C17H31NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.474,"smiles":null,"spectrum_id":"CCMSLIB00017220060","spectrum_index":7163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 76.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.118,"smiles":null,"spectrum_id":"CCMSLIB00017220061","spectrum_index":7164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 94.044 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.115,"smiles":null,"spectrum_id":"CCMSLIB00017220065","spectrum_index":7165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6,7,8-Tetrahydro-2(1H)-quinolinone (delta mass: 90.0062 Da; putative annotation: N/A; putative formula: CH2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.098,"smiles":null,"spectrum_id":"CCMSLIB00017220066","spectrum_index":7166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopentylacetic acid (delta mass: 127.0634 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.165,"smiles":null,"spectrum_id":"CCMSLIB00017220067","spectrum_index":7167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 27.9939 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.059,"smiles":null,"spectrum_id":"CCMSLIB00017220068","spectrum_index":7168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 730.2916 Da; putative annotation: N/A; putative formula: C45H34N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.367,"smiles":null,"spectrum_id":"CCMSLIB00017220071","spectrum_index":7169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 306.0958 Da; putative annotation: N/A; putative formula: C13H22O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.193,"smiles":null,"spectrum_id":"CCMSLIB00017220072","spectrum_index":7170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 241.1684 Da; putative annotation: N/A; putative formula: C13H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.228,"smiles":null,"spectrum_id":"CCMSLIB00017220074","spectrum_index":7171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 161.0685 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.228,"smiles":null,"spectrum_id":"CCMSLIB00017220077","spectrum_index":7172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 161.1086 Da; putative annotation: N/A; putative formula: C6H16N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.205,"smiles":null,"spectrum_id":"CCMSLIB00017220078","spectrum_index":7173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.103,"smiles":null,"spectrum_id":"CCMSLIB00017220079","spectrum_index":7174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 147.0369 Da; putative annotation: N/A; putative formula: C5H11NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.098,"smiles":null,"spectrum_id":"CCMSLIB00017220081","spectrum_index":7175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 218.042 Da; putative annotation: N/A; putative formula: C12H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.081,"smiles":null,"spectrum_id":"CCMSLIB00017220084","spectrum_index":7176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 80.0622 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017220085","spectrum_index":7177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 195.1145 Da; putative annotation: N/A; putative formula: C13H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017220086","spectrum_index":7178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 27.0471 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.129,"smiles":null,"spectrum_id":"CCMSLIB00017220087","spectrum_index":7179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-cysteine (delta mass: 56.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.096,"smiles":null,"spectrum_id":"CCMSLIB00017220090","spectrum_index":7180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 128.1035 Da; putative annotation: N/A; putative formula: C8H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.174,"smiles":null,"spectrum_id":"CCMSLIB00017220092","spectrum_index":7181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Fluorophenyl)-N-(4-methoxybenzyl)methanamine (delta mass: 127.0569 Da; putative annotation: N/A; putative formula: C5H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.186,"smiles":null,"spectrum_id":"CCMSLIB00017220093","spectrum_index":7182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 34.0204 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.07,"smiles":null,"spectrum_id":"CCMSLIB00017220095","spectrum_index":7183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epilupeol (delta mass: 15.0012 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.395,"smiles":null,"spectrum_id":"CCMSLIB00017220097","spectrum_index":7184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 406.283 Da; putative annotation: N/A; putative formula: C23H38N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.422,"smiles":null,"spectrum_id":"CCMSLIB00017220100","spectrum_index":7185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 150.0082 Da; putative annotation: N/A; putative formula: C4H7O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.068,"smiles":null,"spectrum_id":"CCMSLIB00017220101","spectrum_index":7186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of QuinicAcid (delta mass: 200.1193 Da; putative annotation: N/A; putative formula: C8H17N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.19,"smiles":null,"spectrum_id":"CCMSLIB00017220102","spectrum_index":7187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 82.0812 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.36,"smiles":null,"spectrum_id":"CCMSLIB00017220105","spectrum_index":7188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 116.1032 Da; putative annotation: N/A; putative formula: C4H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.33,"smiles":null,"spectrum_id":"CCMSLIB00017220107","spectrum_index":7189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 100.0978 Da; putative annotation: N/A; putative formula: C5H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.159,"smiles":null,"spectrum_id":"CCMSLIB00017220108","spectrum_index":7190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 136.0749 Da; putative annotation: N/A; putative formula: C6H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.135,"smiles":null,"spectrum_id":"CCMSLIB00017220109","spectrum_index":7191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-4-(3,4-Dihydroxyphenyl)-3-buten-2-one (delta mass: 58.0049 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.075,"smiles":null,"spectrum_id":"CCMSLIB00017220110","spectrum_index":7192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 261.0997 Da; putative annotation: N/A; putative formula: C14H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.326,"smiles":null,"spectrum_id":"CCMSLIB00017220114","spectrum_index":7193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 108.0998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.452,"smiles":null,"spectrum_id":"CCMSLIB00017220115","spectrum_index":7194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 39.9948 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.055,"smiles":null,"spectrum_id":"CCMSLIB00017220116","spectrum_index":7195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 255.6389 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.736,"smiles":null,"spectrum_id":"CCMSLIB00017220117","spectrum_index":7196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lithocholic acid (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.357,"smiles":null,"spectrum_id":"CCMSLIB00017220121","spectrum_index":7197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PYRROLE-2-CARBOXYLIC ACID CollisionEnergy:102040 (delta mass: 50.0407 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.08,"smiles":null,"spectrum_id":"CCMSLIB00017220122","spectrum_index":7198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 355.1383 Da; putative annotation: N/A; putative formula: C18H22N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.225,"smiles":null,"spectrum_id":"CCMSLIB00017220123","spectrum_index":7199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 161.0359 Da; putative annotation: N/A; putative formula: C4H8N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.096,"smiles":null,"spectrum_id":"CCMSLIB00017220125","spectrum_index":7200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 236.1175 Da; putative annotation: N/A; putative formula: C13H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.344,"smiles":null,"spectrum_id":"CCMSLIB00017220128","spectrum_index":7201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 503.2414 Da; putative annotation: N/A; putative formula: C21H37N5O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":856.51,"smiles":null,"spectrum_id":"CCMSLIB00017220129","spectrum_index":7202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine propyl ester (delta mass: 72.0328 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.141,"smiles":null,"spectrum_id":"CCMSLIB00017220130","spectrum_index":7203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 89.0114 Da; putative annotation: N/A; putative formula: C2H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.05,"smiles":null,"spectrum_id":"CCMSLIB00017220132","spectrum_index":7204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 79.9671 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.143,"smiles":null,"spectrum_id":"CCMSLIB00017220135","spectrum_index":7205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 18.0093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.148,"smiles":null,"spectrum_id":"CCMSLIB00017220136","spectrum_index":7206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Acetyl-11-keto-.beta.-boswellic acid (delta mass: 68.0615 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.419,"smiles":null,"spectrum_id":"CCMSLIB00017220138","spectrum_index":7207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 97.9633 Da; putative annotation: N/A; putative formula: C3H-2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.091,"smiles":null,"spectrum_id":"CCMSLIB00017220139","spectrum_index":7208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 118.0776 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.18,"smiles":null,"spectrum_id":"CCMSLIB00017220141","spectrum_index":7209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cephalotaxine (delta mass: 32.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.18,"smiles":null,"spectrum_id":"CCMSLIB00017220143","spectrum_index":7210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 19.0049 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.107,"smiles":null,"spectrum_id":"CCMSLIB00017220145","spectrum_index":7211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 134.0579 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017220146","spectrum_index":7212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 38.0159 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017220147","spectrum_index":7213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 60.0215 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017220148","spectrum_index":7214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 61.9829 Da; putative annotation: N/A; putative formula: CH2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.069,"smiles":null,"spectrum_id":"CCMSLIB00017220152","spectrum_index":7215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxycamptothecin (delta mass: 226.1485 Da; putative annotation: N/A; putative formula: C13H23OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.262,"smiles":null,"spectrum_id":"CCMSLIB00017220153","spectrum_index":7216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 63.0322 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.139,"smiles":null,"spectrum_id":"CCMSLIB00017220154","spectrum_index":7217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopentylacetic acid (delta mass: 43.0067 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.109,"smiles":null,"spectrum_id":"CCMSLIB00017220156","spectrum_index":7218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 814.377 Da; putative annotation: N/A; putative formula: C35H62N2O17S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1036.47,"smiles":null,"spectrum_id":"CCMSLIB00017220159","spectrum_index":7219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 24.0001 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.107,"smiles":null,"spectrum_id":"CCMSLIB00017220160","spectrum_index":7220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroandrographolide (delta mass: 128.099 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.305,"smiles":null,"spectrum_id":"CCMSLIB00017220162","spectrum_index":7221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.(3S,4S)-14-Ethyl-9-(hydroxymethyl)-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid (delta mass: 43.9901 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.255,"smiles":null,"spectrum_id":"CCMSLIB00017220163","spectrum_index":7222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 541.487 Da; putative annotation: N/A; putative formula: C36H63NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.787,"smiles":null,"spectrum_id":"CCMSLIB00017220166","spectrum_index":7223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 64.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.321,"smiles":null,"spectrum_id":"CCMSLIB00017220168","spectrum_index":7224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 150.1946 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.26,"smiles":null,"spectrum_id":"CCMSLIB00017220169","spectrum_index":7225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 192.009 Da; putative annotation: N/A; putative formula: C8H5N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.069,"smiles":null,"spectrum_id":"CCMSLIB00017220170","spectrum_index":7226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 43.0061 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.108,"smiles":null,"spectrum_id":"CCMSLIB00017220172","spectrum_index":7227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-15-Tetracosenoic acid (delta mass: 18.0099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.367,"smiles":null,"spectrum_id":"CCMSLIB00017220175","spectrum_index":7228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 345.2504 Da; putative annotation: N/A; putative formula: C18H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.493,"smiles":null,"spectrum_id":"CCMSLIB00017220176","spectrum_index":7229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 460.1605 Da; putative annotation: N/A; putative formula: C22H20N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.242,"smiles":null,"spectrum_id":"CCMSLIB00017220178","spectrum_index":7230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 54.0464 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.2,"smiles":null,"spectrum_id":"CCMSLIB00017220179","spectrum_index":7231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 151.03 Da; putative annotation: N/A; putative formula: C6H6N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.121,"smiles":null,"spectrum_id":"CCMSLIB00017220182","spectrum_index":7232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,16.Xi.)-17-Hydroxykauran-19-oic acid (delta mass: 84.0212 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.264,"smiles":null,"spectrum_id":"CCMSLIB00017220184","spectrum_index":7233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 50.0468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.31,"smiles":null,"spectrum_id":"CCMSLIB00017220185","spectrum_index":7234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.253,"smiles":null,"spectrum_id":"CCMSLIB00017220186","spectrum_index":7235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 158.0708 Da; putative annotation: N/A; putative formula: C11H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.221,"smiles":null,"spectrum_id":"CCMSLIB00017220188","spectrum_index":7236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 40.0413 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.123,"smiles":null,"spectrum_id":"CCMSLIB00017220191","spectrum_index":7237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 158.0981 Da; putative annotation: N/A; putative formula: C7H15N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.18,"smiles":null,"spectrum_id":"CCMSLIB00017220192","spectrum_index":7238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 320.3082 Da; putative annotation: N/A; putative formula: C22H40O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.426,"smiles":null,"spectrum_id":"CCMSLIB00017220194","spectrum_index":7239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 28.031 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.097,"smiles":null,"spectrum_id":"CCMSLIB00017220196","spectrum_index":7240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 231.157 Da; putative annotation: N/A; putative formula: C12H26NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.238,"smiles":null,"spectrum_id":"CCMSLIB00017220197","spectrum_index":7241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 72.0658 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017220198","spectrum_index":7242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11-Dideoxy-9.alpha.,11.alpha.-epoxymethanoprosta-5E,13E-dien-1-oic acid (delta mass: 74.052 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017220200","spectrum_index":7243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 347.2679 Da; putative annotation: N/A; putative formula: C19H33N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.484,"smiles":null,"spectrum_id":"CCMSLIB00017220202","spectrum_index":7244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 220.2013 Da; putative annotation: N/A; putative formula: C4H20N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.28,"smiles":null,"spectrum_id":"CCMSLIB00017220204","spectrum_index":7245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 105.0727 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.139,"smiles":null,"spectrum_id":"CCMSLIB00017220206","spectrum_index":7246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 136.0524 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.165,"smiles":null,"spectrum_id":"CCMSLIB00017220207","spectrum_index":7247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 119.058 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.29,"smiles":null,"spectrum_id":"CCMSLIB00017220210","spectrum_index":7248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 263.0682 Da; putative annotation: N/A; putative formula: C7H13N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.123,"smiles":null,"spectrum_id":"CCMSLIB00017220212","spectrum_index":7249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dexpanthenol (delta mass: 30.0103 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.149,"smiles":null,"spectrum_id":"CCMSLIB00017220213","spectrum_index":7250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 288.146 Da; putative annotation: N/A; putative formula: C10H21N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.253,"smiles":null,"spectrum_id":"CCMSLIB00017220214","spectrum_index":7251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 338.3657 Da; putative annotation: N/A; putative formula: C22H46N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.457,"smiles":null,"spectrum_id":"CCMSLIB00017220217","spectrum_index":7252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1a,1b-Dihomoprostaglandin E1 (delta mass: 74.0519 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.331,"smiles":null,"spectrum_id":"CCMSLIB00017220218","spectrum_index":7253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 35.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.268,"smiles":null,"spectrum_id":"CCMSLIB00017220219","spectrum_index":7254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid methyl ester (delta mass: 146.1073 Da; putative annotation: N/A; putative formula: C5H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.491,"smiles":null,"spectrum_id":"CCMSLIB00017220220","spectrum_index":7255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1.alpha.,2.alpha.,3.beta.,5.Xi.,9.Xi.,13.Xi.,14.Xi.,18.Xi.)-1,2,3,22,23,29-Hexahydroxy-13,27-cycloolean-11-en-28-oic acid (delta mass: 90.0935 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.42,"smiles":null,"spectrum_id":"CCMSLIB00017220222","spectrum_index":7256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 34.4348 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017220225","spectrum_index":7257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CLE_291.1026_12.2 (delta mass: 9.9321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.035,"smiles":null,"spectrum_id":"CCMSLIB00017220226","spectrum_index":7258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 79.9257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.111,"smiles":null,"spectrum_id":"CCMSLIB00017220227","spectrum_index":7259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.144,"smiles":null,"spectrum_id":"CCMSLIB00017220230","spectrum_index":7260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylglutaric acid (delta mass: 26.0158 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017220232","spectrum_index":7261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 50.0513 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.299,"smiles":null,"spectrum_id":"CCMSLIB00017220233","spectrum_index":7262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 140.1202 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.197,"smiles":null,"spectrum_id":"CCMSLIB00017220234","spectrum_index":7263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-.beta.,2,5,5,8a-pentamethyl-3-oxo-, (8aS)- (delta mass: 48.0357 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.278,"smiles":null,"spectrum_id":"CCMSLIB00017220237","spectrum_index":7264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Cyclopentylpropyl)methylamine (delta mass: 536.5283 Da; putative annotation: N/A; putative formula: C34H68N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.687,"smiles":null,"spectrum_id":"CCMSLIB00017220239","spectrum_index":7265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dichlorokynurenic acid (delta mass: 59.1774 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.149,"smiles":null,"spectrum_id":"CCMSLIB00017220240","spectrum_index":7266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 113.0844 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.234,"smiles":null,"spectrum_id":"CCMSLIB00017220242","spectrum_index":7267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 122.113 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.355,"smiles":null,"spectrum_id":"CCMSLIB00017220245","spectrum_index":7268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hexadecenoic acid, 16-[[(ethylamino)carbonyl]amino]-, (11Z)- (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.342,"smiles":null,"spectrum_id":"CCMSLIB00017220246","spectrum_index":7269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 70.0414 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.242,"smiles":null,"spectrum_id":"CCMSLIB00017220247","spectrum_index":7270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Aminopropyl)-4-methyl-2-nitroaniline (delta mass: 44.9986 Da; putative annotation: N/A; putative formula: C4H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017220249","spectrum_index":7271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 192.0271 Da; putative annotation: N/A; putative formula: C6H8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.061,"smiles":null,"spectrum_id":"CCMSLIB00017220252","spectrum_index":7272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 62.0389 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.266,"smiles":null,"spectrum_id":"CCMSLIB00017220253","spectrum_index":7273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 310.2989 Da; putative annotation: N/A; putative formula: C19H38N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.438,"smiles":null,"spectrum_id":"CCMSLIB00017220255","spectrum_index":7274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 291.1458 Da; putative annotation: N/A; putative formula: C16H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.211,"smiles":null,"spectrum_id":"CCMSLIB00017220256","spectrum_index":7275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 87.0737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.139,"smiles":null,"spectrum_id":"CCMSLIB00017220259","spectrum_index":7276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 203.0924 Da; putative annotation: N/A; putative formula: C8H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.158,"smiles":null,"spectrum_id":"CCMSLIB00017220261","spectrum_index":7277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.206,"smiles":null,"spectrum_id":"CCMSLIB00017220262","spectrum_index":7278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 224.2139 Da; putative annotation: N/A; putative formula: C15H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.327,"smiles":null,"spectrum_id":"CCMSLIB00017220264","spectrum_index":7279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 204.0632 Da; putative annotation: N/A; putative formula: C8H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.128,"smiles":null,"spectrum_id":"CCMSLIB00017220267","spectrum_index":7280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 254.2332 Da; putative annotation: N/A; putative formula: C11H26N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.518,"smiles":null,"spectrum_id":"CCMSLIB00017220268","spectrum_index":7281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 40.0309 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.294,"smiles":null,"spectrum_id":"CCMSLIB00017220269","spectrum_index":7282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 999.3692 Da; putative annotation: N/A; putative formula: C50H61N7O9S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1159.5,"smiles":null,"spectrum_id":"CCMSLIB00017220271","spectrum_index":7283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 104.0261 Da; putative annotation: Salicylaldehyde; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.076,"smiles":null,"spectrum_id":"CCMSLIB00017220274","spectrum_index":7284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 162.0601 Da; putative annotation: 2-(Hydroxymethyl)-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one; putative formula: C7H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.101,"smiles":null,"spectrum_id":"CCMSLIB00017220275","spectrum_index":7285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 190.1753 Da; putative annotation: 1-Ethynylcyclododecanol; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.418,"smiles":null,"spectrum_id":"CCMSLIB00017220277","spectrum_index":7286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 332.2356 Da; putative annotation: 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid; putative formula: C21H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.468,"smiles":null,"spectrum_id":"CCMSLIB00017220279","spectrum_index":7287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 260.2113 Da; putative annotation: gamma-linolenic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.573,"smiles":null,"spectrum_id":"CCMSLIB00017220282","spectrum_index":7288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethynodrel (delta mass: 298.1912 Da; putative annotation: all-trans-4-Hydroxyretinoic acid; putative formula: C20H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.392,"smiles":null,"spectrum_id":"CCMSLIB00017220283","spectrum_index":7289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 358.2862 Da; putative annotation: Lithocholic acid; putative formula: C24H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.544,"smiles":null,"spectrum_id":"CCMSLIB00017220284","spectrum_index":7290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 248.1735 Da; putative annotation: 8R-Hydroxy-4Z,6E,10Z-hexadecatrienoic acid; putative formula: C16H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.238,"smiles":null,"spectrum_id":"CCMSLIB00017220286","spectrum_index":7291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 280.2414 Da; putative annotation: 6-Oxooctadecanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.473,"smiles":null,"spectrum_id":"CCMSLIB00017220289","spectrum_index":7292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 108.0938 Da; putative annotation: Bicyclo[2.2.1]heptane-2-methanol; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.294,"smiles":null,"spectrum_id":"CCMSLIB00017220290","spectrum_index":7293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 281.2705 Da; putative annotation: Palmitoyl Ethanolamide; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.529,"smiles":null,"spectrum_id":"CCMSLIB00017220291","spectrum_index":7294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 157.1075 Da; putative annotation: Statine; putative formula: C8H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.622,"smiles":null,"spectrum_id":"CCMSLIB00017220293","spectrum_index":7295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 574.4968 Da; putative annotation: 1-Palmitoyl-2-linoleoyl-rac-glycerol; putative formula: C37H66O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.724,"smiles":null,"spectrum_id":"CCMSLIB00017220296","spectrum_index":7296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 201.075 Da; putative annotation: 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid; putative formula: C12H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.123,"smiles":null,"spectrum_id":"CCMSLIB00017220297","spectrum_index":7297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 257.1055 Da; putative annotation: Massbank:MT000128 gamma-Glutamylglutamine; putative formula: C10H15N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.192,"smiles":null,"spectrum_id":"CCMSLIB00017220298","spectrum_index":7298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 122.1094 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.148,"smiles":null,"spectrum_id":"CCMSLIB00017220300","spectrum_index":7299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(18)-Epoxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid (delta mass: 53.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017220303","spectrum_index":7300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 74.0365 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.185,"smiles":null,"spectrum_id":"CCMSLIB00017220304","spectrum_index":7301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 233.089 Da; putative annotation: N/A; putative formula: C13H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.149,"smiles":null,"spectrum_id":"CCMSLIB00017220305","spectrum_index":7302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desferrioxamine (delta mass: 242.1264 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.487,"smiles":null,"spectrum_id":"CCMSLIB00017220307","spectrum_index":7303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 486.2568 Da; putative annotation: N/A; putative formula: C25H43O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.37,"smiles":null,"spectrum_id":"CCMSLIB00017220310","spectrum_index":7304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 112.0519 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017220311","spectrum_index":7305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Loliolide (delta mass: 64.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.169,"smiles":null,"spectrum_id":"CCMSLIB00017220312","spectrum_index":7306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 68.0629 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.206,"smiles":null,"spectrum_id":"CCMSLIB00017220314","spectrum_index":7307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 113.0479 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.108,"smiles":null,"spectrum_id":"CCMSLIB00017220317","spectrum_index":7308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHOSPHOCREATINE - 20.0 eV (delta mass: 422.0711 Da; putative annotation: N/A; putative formula: C17H26O4S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.114,"smiles":null,"spectrum_id":"CCMSLIB00017220318","spectrum_index":7309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diallyl-1,3,5-triazinane-2,4,6-trione (delta mass: 42.0466 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.134,"smiles":null,"spectrum_id":"CCMSLIB00017220319","spectrum_index":7310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 158.0217 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.269,"smiles":null,"spectrum_id":"CCMSLIB00017220322","spectrum_index":7311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1S,4R,5S,6R)-5-[(1E,3S)-3-hydroxy-1-octen-1-yl]-2-oxabicyclo[2.2.1]hept-6-yl]-, (5Z)- (delta mass: 91.0429 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.296,"smiles":null,"spectrum_id":"CCMSLIB00017220324","spectrum_index":7312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 427.2939 Da; putative annotation: N/A; putative formula: C24H45NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.365,"smiles":null,"spectrum_id":"CCMSLIB00017220325","spectrum_index":7313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 198.0741 Da; putative annotation: N/A; putative formula: C9H15N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.337,"smiles":null,"spectrum_id":"CCMSLIB00017220326","spectrum_index":7314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 70.0767 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.23,"smiles":null,"spectrum_id":"CCMSLIB00017220329","spectrum_index":7315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:MSJ00168 alpha-Tocopherol|Vitamin E (delta mass: 213.1025 Da; putative annotation: N/A; putative formula: C9H16N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.491,"smiles":null,"spectrum_id":"CCMSLIB00017220331","spectrum_index":7316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,12.alpha.-Epidioxy-13(14)-abieten-18-oic acid (delta mass: 36.0365 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.258,"smiles":null,"spectrum_id":"CCMSLIB00017220332","spectrum_index":7317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 74.0521 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.3,"smiles":null,"spectrum_id":"CCMSLIB00017220334","spectrum_index":7318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyquinuclidine-3-carbonitrile (delta mass: 163.0304 Da; putative annotation: N/A; putative formula: C5H9NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.133,"smiles":null,"spectrum_id":"CCMSLIB00017220337","spectrum_index":7319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 239.1006 Da; putative annotation: N/A; putative formula: C8H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.27,"smiles":null,"spectrum_id":"CCMSLIB00017220338","spectrum_index":7320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 614.3674 Da; putative annotation: N/A; putative formula: C33H58O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":941.496,"smiles":null,"spectrum_id":"CCMSLIB00017220339","spectrum_index":7321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 17.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.211,"smiles":null,"spectrum_id":"CCMSLIB00017220341","spectrum_index":7322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.176,"smiles":null,"spectrum_id":"CCMSLIB00017220343","spectrum_index":7323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 70.078 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.305,"smiles":null,"spectrum_id":"CCMSLIB00017220344","spectrum_index":7324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxycoumarin-4-acetic acid (delta mass: 115.027 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.071,"smiles":null,"spectrum_id":"CCMSLIB00017220345","spectrum_index":7325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 40.9785 Da; putative annotation: N/A; putative formula: CNO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.075,"smiles":null,"spectrum_id":"CCMSLIB00017220347","spectrum_index":7326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11-Methyl-2-dodecenoic acid (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.237,"smiles":null,"spectrum_id":"CCMSLIB00017220350","spectrum_index":7327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5S)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one (delta mass: 129.0428 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.165,"smiles":null,"spectrum_id":"CCMSLIB00017220351","spectrum_index":7328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 36.039 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.261,"smiles":null,"spectrum_id":"CCMSLIB00017220352","spectrum_index":7329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 43.9896 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017220354","spectrum_index":7330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 110.0362 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.133,"smiles":null,"spectrum_id":"CCMSLIB00017220357","spectrum_index":7331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cucurbitacin D (delta mass: 857.4448 Da; putative annotation: N/A; putative formula: C45H55N13O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1374.76,"smiles":null,"spectrum_id":"CCMSLIB00017220358","spectrum_index":7332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 226.1318 Da; putative annotation: N/A; putative formula: C11H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.27,"smiles":null,"spectrum_id":"CCMSLIB00017220360","spectrum_index":7333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aleuretic Acid (delta mass: 82.0435 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.276,"smiles":null,"spectrum_id":"CCMSLIB00017220361","spectrum_index":7334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CMP - 20.0 eV (delta mass: 291.094 Da; putative annotation: N/A; putative formula: C8H9N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.153,"smiles":null,"spectrum_id":"CCMSLIB00017220364","spectrum_index":7335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.066,"smiles":null,"spectrum_id":"CCMSLIB00017220365","spectrum_index":7336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 657.511 Da; putative annotation: N/A; putative formula: C36H71N3O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":952.738,"smiles":null,"spectrum_id":"CCMSLIB00017220367","spectrum_index":7337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 225.0848 Da; putative annotation: N/A; putative formula: C7H15NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.139,"smiles":null,"spectrum_id":"CCMSLIB00017220369","spectrum_index":7338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 55.0417 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.112,"smiles":null,"spectrum_id":"CCMSLIB00017220371","spectrum_index":7339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 60.0365 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.087,"smiles":null,"spectrum_id":"CCMSLIB00017220373","spectrum_index":7340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Amyrin (delta mass: 178.1004 Da; putative annotation: N/A; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.494,"smiles":null,"spectrum_id":"CCMSLIB00017220375","spectrum_index":7341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 6.1616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.216,"smiles":null,"spectrum_id":"CCMSLIB00017220377","spectrum_index":7342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terephthalic acid (delta mass: 54.1183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.152,"smiles":null,"spectrum_id":"CCMSLIB00017220379","spectrum_index":7343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 236.0467 Da; putative annotation: N/A; putative formula: C7H12N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.223,"smiles":null,"spectrum_id":"CCMSLIB00017220380","spectrum_index":7344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385057-01! (delta mass: 169.0301 Da; putative annotation: N/A; putative formula: C7H8NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.118,"smiles":null,"spectrum_id":"CCMSLIB00017220382","spectrum_index":7345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 62.0532 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.306,"smiles":null,"spectrum_id":"CCMSLIB00017220385","spectrum_index":7346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine (delta mass: 67.042 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.218,"smiles":null,"spectrum_id":"CCMSLIB00017220386","spectrum_index":7347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 45.987 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.24,"smiles":null,"spectrum_id":"CCMSLIB00017220387","spectrum_index":7348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16(17)-Epoxy-4Z,7Z,10Z,13Z,19Z-docosapentaenoic acid (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.252,"smiles":null,"spectrum_id":"CCMSLIB00017220389","spectrum_index":7349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 359.1214 Da; putative annotation: N/A; putative formula: C15H21NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.218,"smiles":null,"spectrum_id":"CCMSLIB00017220392","spectrum_index":7350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 3.0137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017220393","spectrum_index":7351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8Z,14Z-Eicosadienoic acid (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.289,"smiles":null,"spectrum_id":"CCMSLIB00017220394","spectrum_index":7352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 206.243 Da; putative annotation: N/A; putative formula: C16H30O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.323,"smiles":null,"spectrum_id":"CCMSLIB00017220396","spectrum_index":7353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 14.0513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.085,"smiles":null,"spectrum_id":"CCMSLIB00017220399","spectrum_index":7354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 27.9912 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.102,"smiles":null,"spectrum_id":"CCMSLIB00017220400","spectrum_index":7355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 286.1734 Da; putative annotation: N/A; putative formula: C13H27N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.26,"smiles":null,"spectrum_id":"CCMSLIB00017220401","spectrum_index":7356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mononervonin (15c) (delta mass: 36.0373 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.431,"smiles":null,"spectrum_id":"CCMSLIB00017220403","spectrum_index":7357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(R)-4-((5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid\"\" (delta mass: 31.0424 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.332,"smiles":null,"spectrum_id":"CCMSLIB00017220406","spectrum_index":7358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloro-4-fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 113.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.122,"smiles":null,"spectrum_id":"CCMSLIB00017220407","spectrum_index":7359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 46.002 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.135,"smiles":null,"spectrum_id":"CCMSLIB00017220408","spectrum_index":7360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 148.0527 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.102,"smiles":null,"spectrum_id":"CCMSLIB00017220410","spectrum_index":7361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 231.1296 Da; putative annotation: N/A; putative formula: C11H21NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.2,"smiles":null,"spectrum_id":"CCMSLIB00017220413","spectrum_index":7362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 179.08 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.14,"smiles":null,"spectrum_id":"CCMSLIB00017220414","spectrum_index":7363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 50.0465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.206,"smiles":null,"spectrum_id":"CCMSLIB00017220415","spectrum_index":7364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 163.0857 Da; putative annotation: N/A; putative formula: C7H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.166,"smiles":null,"spectrum_id":"CCMSLIB00017220416","spectrum_index":7365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nervobscurine (delta mass: 360.2169 Da; putative annotation: N/A; putative formula: C20H24N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":743.413,"smiles":null,"spectrum_id":"CCMSLIB00017220420","spectrum_index":7366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385638-01!2,2'-bis(3,4-dihydroxyphenyl)-3',4,5',6-tetrahydroxyspiro[2H-1-benzofuran-3,9'-3,4-dihydro-2H-furo[2,3-h]chromene]-8'-one (delta mass: 574.1069 Da; putative annotation: N/A; putative formula: C31H22N6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1149.23,"smiles":null,"spectrum_id":"CCMSLIB00017220421","spectrum_index":7367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Taurocholic acid (delta mass: 314.245 Da; putative annotation: N/A; putative formula: C18H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.544,"smiles":null,"spectrum_id":"CCMSLIB00017220422","spectrum_index":7368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 313.2646 Da; putative annotation: N/A; putative formula: C17H36N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.434,"smiles":null,"spectrum_id":"CCMSLIB00017220424","spectrum_index":7369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitelaidic acid (delta mass: 66.0465 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.278,"smiles":null,"spectrum_id":"CCMSLIB00017220427","spectrum_index":7370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 127.0092 Da; putative annotation: N/A; putative formula: C5H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.091,"smiles":null,"spectrum_id":"CCMSLIB00017220428","spectrum_index":7371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 117.0786 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.229,"smiles":null,"spectrum_id":"CCMSLIB00017220430","spectrum_index":7372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 245.1265 Da; putative annotation: N/A; putative formula: C11H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.197,"smiles":null,"spectrum_id":"CCMSLIB00017220432","spectrum_index":7373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4-(1H-Pyrazol-1-yl)phenyl]methanamine (delta mass: 50.0152 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.118,"smiles":null,"spectrum_id":"CCMSLIB00017220433","spectrum_index":7374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-O-Me-Ado - 40.0 eV (delta mass: 132.1132 Da; putative annotation: N/A; putative formula: C3H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.233,"smiles":null,"spectrum_id":"CCMSLIB00017220434","spectrum_index":7375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 234.0619 Da; putative annotation: N/A; putative formula: C15H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.123,"smiles":null,"spectrum_id":"CCMSLIB00017220437","spectrum_index":7376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 113.0934 Da; putative annotation: N/A; putative formula: C5H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.174,"smiles":null,"spectrum_id":"CCMSLIB00017220439","spectrum_index":7377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 427.1846 Da; putative annotation: N/A; putative formula: C23H30N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.265,"smiles":null,"spectrum_id":"CCMSLIB00017220440","spectrum_index":7378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 598.3873 Da; putative annotation: N/A; putative formula: C31H51N8O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.447,"smiles":null,"spectrum_id":"CCMSLIB00017220442","spectrum_index":7379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 83.05 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.24,"smiles":null,"spectrum_id":"CCMSLIB00017220445","spectrum_index":7380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 104.0945 Da; putative annotation: N/A; putative formula: H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.337,"smiles":null,"spectrum_id":"CCMSLIB00017220446","spectrum_index":7381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 911.3121 Da; putative annotation: N/A; putative formula: C48H53N3O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1074.37,"smiles":null,"spectrum_id":"CCMSLIB00017220448","spectrum_index":7382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinanethromboxane A2 (delta mass: 52.065 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.37,"smiles":null,"spectrum_id":"CCMSLIB00017220450","spectrum_index":7383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 172.1102 Da; putative annotation: N/A; putative formula: C9H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.358,"smiles":null,"spectrum_id":"CCMSLIB00017220453","spectrum_index":7384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 96.0425 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017220454","spectrum_index":7385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 38.0408 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.175,"smiles":null,"spectrum_id":"CCMSLIB00017220455","spectrum_index":7386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxygypsogenic acid (delta mass: 17.0275 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.364,"smiles":null,"spectrum_id":"CCMSLIB00017220457","spectrum_index":7387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 8.0044 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.059,"smiles":null,"spectrum_id":"CCMSLIB00017220460","spectrum_index":7388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 55.0425 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.113,"smiles":null,"spectrum_id":"CCMSLIB00017220461","spectrum_index":7389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 113.9436 Da; putative annotation: N/A; putative formula: C3OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.004,"smiles":null,"spectrum_id":"CCMSLIB00017220462","spectrum_index":7390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aureonitol (delta mass: 133.0732 Da; putative annotation: N/A; putative formula: C5H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.211,"smiles":null,"spectrum_id":"CCMSLIB00017220464","spectrum_index":7391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 167.1155 Da; putative annotation: N/A; putative formula: C7H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.379,"smiles":null,"spectrum_id":"CCMSLIB00017220466","spectrum_index":7392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 83.0399 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.094,"smiles":null,"spectrum_id":"CCMSLIB00017220467","spectrum_index":7393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[5-[Acetyl(hydroxy)amino]pentylcarbamoyl]-5-[3-[acetyl(hydroxy)amino]propylamino]-3-hydroxy-5-oxopentanoic acid (delta mass: 249.1485 Da; putative annotation: N/A; putative formula: C13H19N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.373,"smiles":null,"spectrum_id":"CCMSLIB00017220469","spectrum_index":7394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzoic acid (delta mass: 37.9807 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.015,"smiles":null,"spectrum_id":"CCMSLIB00017220472","spectrum_index":7395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 171.1625 Da; putative annotation: N/A; putative formula: C10H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.348,"smiles":null,"spectrum_id":"CCMSLIB00017220473","spectrum_index":7396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[1-(5-hydroxy-2,6,6-trimethyltetrahydro-2H-pyran-2-yl)ethyl]-2(1H)-quinolinone (delta mass: 13.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.211,"smiles":null,"spectrum_id":"CCMSLIB00017220474","spectrum_index":7397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 74.0005 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.087,"smiles":null,"spectrum_id":"CCMSLIB00017220476","spectrum_index":7398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 59.0738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.285,"smiles":null,"spectrum_id":"CCMSLIB00017220479","spectrum_index":7399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003545 Hordenine|4-[2-(dimethylamino)ethyl]phenol (delta mass: 149.0567 Da; putative annotation: N/A; putative formula: C3H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.179,"smiles":null,"spectrum_id":"CCMSLIB00017220480","spectrum_index":7400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 155.9975 Da; putative annotation: N/A; putative formula: C6H5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.078,"smiles":null,"spectrum_id":"CCMSLIB00017220481","spectrum_index":7401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.144,"smiles":null,"spectrum_id":"CCMSLIB00017220483","spectrum_index":7402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 497.3038 Da; putative annotation: N/A; putative formula: C24H43N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.52,"smiles":null,"spectrum_id":"CCMSLIB00017220486","spectrum_index":7403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 90.0933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.43,"smiles":null,"spectrum_id":"CCMSLIB00017220487","spectrum_index":7404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 307.2438 Da; putative annotation: N/A; putative formula: C18H33N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.46,"smiles":null,"spectrum_id":"CCMSLIB00017220488","spectrum_index":7405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 132.0932 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.32,"smiles":null,"spectrum_id":"CCMSLIB00017220490","spectrum_index":7406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 180.0637 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.29,"smiles":null,"spectrum_id":"CCMSLIB00017220493","spectrum_index":7407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 106.0398 Da; putative annotation: N/A; putative formula: C3H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.079,"smiles":null,"spectrum_id":"CCMSLIB00017220494","spectrum_index":7408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 644.3786 Da; putative annotation: N/A; putative formula: C34H52N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.449,"smiles":null,"spectrum_id":"CCMSLIB00017220495","spectrum_index":7409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 58.0766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.136,"smiles":null,"spectrum_id":"CCMSLIB00017220497","spectrum_index":7410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 187.0835 Da; putative annotation: N/A; putative formula: C8H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.164,"smiles":null,"spectrum_id":"CCMSLIB00017220500","spectrum_index":7411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 25Dihydroxy_phenyl_acetic_acid_homogenistic (delta mass: 133.9642 Da; putative annotation: N/A; putative formula: C6H-2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.014,"smiles":null,"spectrum_id":"CCMSLIB00017220501","spectrum_index":7412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 355.3426 Da; putative annotation: N/A; putative formula: C18H41N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.857,"smiles":null,"spectrum_id":"CCMSLIB00017220502","spectrum_index":7413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Cyclohexanecarbonylpentadecylamine from NIST14 (delta mass: 44.9044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.246,"smiles":null,"spectrum_id":"CCMSLIB00017220504","spectrum_index":7414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 411.1714 Da; putative annotation: N/A; putative formula: C22H26N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.294,"smiles":null,"spectrum_id":"CCMSLIB00017220507","spectrum_index":7415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 112.0744 Da; putative annotation: N/A; putative formula: C4H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.338,"smiles":null,"spectrum_id":"CCMSLIB00017220508","spectrum_index":7416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(Leu-Pro) (delta mass: 41.0131 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.157,"smiles":null,"spectrum_id":"CCMSLIB00017220509","spectrum_index":7417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 85.0527 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.117,"smiles":null,"spectrum_id":"CCMSLIB00017220512","spectrum_index":7418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(benzimidazol-2-ylthiomethyl)-4-methoxybenzaldehyde CollisionEnergy:102040 (delta mass: 138.0384 Da; putative annotation: N/A; putative formula: CH6N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.123,"smiles":null,"spectrum_id":"CCMSLIB00017220514","spectrum_index":7419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 27.9902 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.17,"smiles":null,"spectrum_id":"CCMSLIB00017220515","spectrum_index":7420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 104.033 Da; putative annotation: N/A; putative formula: CH4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.202,"smiles":null,"spectrum_id":"CCMSLIB00017220517","spectrum_index":7421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 52.0312 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017220519","spectrum_index":7422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 38.0155 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017220520","spectrum_index":7423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 94.0785 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.326,"smiles":null,"spectrum_id":"CCMSLIB00017220521","spectrum_index":7424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rhinocerotinoic acid (delta mass: 53.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.274,"smiles":null,"spectrum_id":"CCMSLIB00017220523","spectrum_index":7425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 280.302 Da; putative annotation: N/A; putative formula: C17H36N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":873.578,"smiles":null,"spectrum_id":"CCMSLIB00017220526","spectrum_index":7426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 212.1422 Da; putative annotation: N/A; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.228,"smiles":null,"spectrum_id":"CCMSLIB00017220527","spectrum_index":7427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.253,"smiles":null,"spectrum_id":"CCMSLIB00017220528","spectrum_index":7428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 103.0383 Da; putative annotation: N/A; putative formula: C2H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.292,"smiles":null,"spectrum_id":"CCMSLIB00017220531","spectrum_index":7429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one (delta mass: 94.0417 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017220533","spectrum_index":7430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 34.1504 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.279,"smiles":null,"spectrum_id":"CCMSLIB00017220534","spectrum_index":7431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 78.0467 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.107,"smiles":null,"spectrum_id":"CCMSLIB00017220536","spectrum_index":7432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 46.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.092,"smiles":null,"spectrum_id":"CCMSLIB00017220538","spectrum_index":7433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017220539","spectrum_index":7434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of decursinol (delta mass: 80.0475 Da; putative annotation: N/A; putative formula: C3H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.144,"smiles":null,"spectrum_id":"CCMSLIB00017220540","spectrum_index":7435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 90.0466 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.294,"smiles":null,"spectrum_id":"CCMSLIB00017220543","spectrum_index":7436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 55.0781 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.227,"smiles":null,"spectrum_id":"CCMSLIB00017220545","spectrum_index":7437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 435.2615 Da; putative annotation: N/A; putative formula: C24H37NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.358,"smiles":null,"spectrum_id":"CCMSLIB00017220546","spectrum_index":7438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Ala (delta mass: 127.1005 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.214,"smiles":null,"spectrum_id":"CCMSLIB00017220547","spectrum_index":7439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 137.0681 Da; putative annotation: N/A; putative formula: C8H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.269,"smiles":null,"spectrum_id":"CCMSLIB00017220551","spectrum_index":7440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 318.2042 Da; putative annotation: N/A; putative formula: C16H30O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.243,"smiles":null,"spectrum_id":"CCMSLIB00017220552","spectrum_index":7441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 93.0432 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.108,"smiles":null,"spectrum_id":"CCMSLIB00017220553","spectrum_index":7442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 543.4634 Da; putative annotation: N/A; putative formula: C31H57N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.716,"smiles":null,"spectrum_id":"CCMSLIB00017220554","spectrum_index":7443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maleic hydrazide (delta mass: 32.0341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.069,"smiles":null,"spectrum_id":"CCMSLIB00017220558","spectrum_index":7444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"5,6-DIHYDROURACIL\"\" (delta mass: 57.015 Da; putative annotation: N/A; putative formula: C2H4NO-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.065,"smiles":null,"spectrum_id":"CCMSLIB00017220559","spectrum_index":7445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 144.0336 Da; putative annotation: N/A; putative formula: C6H9O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.098,"smiles":null,"spectrum_id":"CCMSLIB00017220560","spectrum_index":7446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 101.0514 Da; putative annotation: N/A; putative formula: C3H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.128,"smiles":null,"spectrum_id":"CCMSLIB00017220562","spectrum_index":7447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 194.041 Da; putative annotation: N/A; putative formula: C3H10N6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.106,"smiles":null,"spectrum_id":"CCMSLIB00017220565","spectrum_index":7448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.185,"smiles":null,"spectrum_id":"CCMSLIB00017220566","spectrum_index":7449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 69.0577 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.144,"smiles":null,"spectrum_id":"CCMSLIB00017220568","spectrum_index":7450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid CollisionEnergy:102040 (delta mass: 315.3137 Da; putative annotation: N/A; putative formula: C15H37N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.577,"smiles":null,"spectrum_id":"CCMSLIB00017220569","spectrum_index":7451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 332.3096 Da; putative annotation: N/A; putative formula: C23H40O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.557,"smiles":null,"spectrum_id":"CCMSLIB00017220572","spectrum_index":7452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 130.0994 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017220574","spectrum_index":7453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00168850-03_C16H20O6_1H-2-Benzopyran-6-acetic acid, 8a-ethenyloctahydro-5,7-dihydroxy-alpha,4-bis(methylene)-3-oxo-, methyl ester, (4aR,5R,6R,7S,8aR)- (delta mass: 78.0113 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.145,"smiles":null,"spectrum_id":"CCMSLIB00017220575","spectrum_index":7454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzoic acid (delta mass: 57.0579 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017220577","spectrum_index":7455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 83.9833 Da; putative annotation: N/A; putative formula: C3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.064,"smiles":null,"spectrum_id":"CCMSLIB00017220580","spectrum_index":7456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 91.0497 Da; putative annotation: N/A; putative formula: H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.131,"smiles":null,"spectrum_id":"CCMSLIB00017220581","spectrum_index":7457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.149,"smiles":null,"spectrum_id":"CCMSLIB00017220582","spectrum_index":7458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 17.0879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017220584","spectrum_index":7459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 128.0436 Da; putative annotation: N/A; putative formula: C2H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.124,"smiles":null,"spectrum_id":"CCMSLIB00017220587","spectrum_index":7460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 26-Hydroxycholesterol-(25R) (delta mass: 54.0466 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.404,"smiles":null,"spectrum_id":"CCMSLIB00017220588","spectrum_index":7461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 50.0342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.099,"smiles":null,"spectrum_id":"CCMSLIB00017220589","spectrum_index":7462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 50.0555 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.137,"smiles":null,"spectrum_id":"CCMSLIB00017220590","spectrum_index":7463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 226.1686 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.323,"smiles":null,"spectrum_id":"CCMSLIB00017220594","spectrum_index":7464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-C11:0 (delta mass: 94.079 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.291,"smiles":null,"spectrum_id":"CCMSLIB00017220595","spectrum_index":7465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 116.0875 Da; putative annotation: N/A; putative formula: C5H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.153,"smiles":null,"spectrum_id":"CCMSLIB00017220596","spectrum_index":7466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 119.0585 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.228,"smiles":null,"spectrum_id":"CCMSLIB00017220597","spectrum_index":7467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 90.0809 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.318,"smiles":null,"spectrum_id":"CCMSLIB00017220601","spectrum_index":7468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169963-02_C15H26O_(3,3,7-Trimethyltricyclo[5.4.0.0~2,9~]undec-8-yl)methanol (delta mass: 132.0991 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.305,"smiles":null,"spectrum_id":"CCMSLIB00017220602","spectrum_index":7469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.102,"smiles":null,"spectrum_id":"CCMSLIB00017220603","spectrum_index":7470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-hydroxyquinoline (delta mass: 80.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.118,"smiles":null,"spectrum_id":"CCMSLIB00017220604","spectrum_index":7471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 17.0347 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.077,"smiles":null,"spectrum_id":"CCMSLIB00017220608","spectrum_index":7472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 149.0477 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.129,"smiles":null,"spectrum_id":"CCMSLIB00017220609","spectrum_index":7473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 128.0839 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.149,"smiles":null,"spectrum_id":"CCMSLIB00017220610","spectrum_index":7474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 363.2794 Da; putative annotation: N/A; putative formula: C15H39N7O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.371,"smiles":null,"spectrum_id":"CCMSLIB00017220612","spectrum_index":7475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.049,"smiles":null,"spectrum_id":"CCMSLIB00017220615","spectrum_index":7476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 162.0535 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.192,"smiles":null,"spectrum_id":"CCMSLIB00017220616","spectrum_index":7477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 33.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017220617","spectrum_index":7478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 180.1264 Da; putative annotation: N/A; putative formula: C10H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.171,"smiles":null,"spectrum_id":"CCMSLIB00017220619","spectrum_index":7479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxy-16-methoxyoctadeca-9,12-dienoic acid (delta mass: 90.0835 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017220622","spectrum_index":7480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 44.026 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.065,"smiles":null,"spectrum_id":"CCMSLIB00017220623","spectrum_index":7481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369606 Salicylic acid|2-hydroxybenzoic acid (delta mass: 68.0991 Da; putative annotation: N/A; putative formula: C6H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017220624","spectrum_index":7482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Aminocamptothecin (delta mass: 325.1642 Da; putative annotation: N/A; putative formula: C16H27N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.293,"smiles":null,"spectrum_id":"CCMSLIB00017220627","spectrum_index":7483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 400.2613 Da; putative annotation: N/A; putative formula: C25H36O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.321,"smiles":null,"spectrum_id":"CCMSLIB00017220629","spectrum_index":7484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 360.0429 Da; putative annotation: N/A; putative formula: C17H8N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.103,"smiles":null,"spectrum_id":"CCMSLIB00017220630","spectrum_index":7485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 361.1748 Da; putative annotation: N/A; putative formula: C17H23N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.235,"smiles":null,"spectrum_id":"CCMSLIB00017220632","spectrum_index":7486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Benzimidazol-2-yl 3-chlorobenzyl sulfide (delta mass: 106.9955 Da; putative annotation: N/A; putative formula: C2H6NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.036,"smiles":null,"spectrum_id":"CCMSLIB00017220635","spectrum_index":7487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 142.0782 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.43,"smiles":null,"spectrum_id":"CCMSLIB00017220636","spectrum_index":7488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 94.078 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.305,"smiles":null,"spectrum_id":"CCMSLIB00017220637","spectrum_index":7489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentisic acid (delta mass: 74.1061 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.14,"smiles":null,"spectrum_id":"CCMSLIB00017220639","spectrum_index":7490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.,16.alpha.-diol-17-one (delta mass: 48.0374 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.249,"smiles":null,"spectrum_id":"CCMSLIB00017220642","spectrum_index":7491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Crotonoside (delta mass: 294.0956 Da; putative annotation: N/A; putative formula: C14H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.195,"smiles":null,"spectrum_id":"CCMSLIB00017220644","spectrum_index":7492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 895.4937 Da; putative annotation: N/A; putative formula: C60H61N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.6,"smiles":null,"spectrum_id":"CCMSLIB00017220645","spectrum_index":7493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 769.4243 Da; putative annotation: N/A; putative formula: C52H55N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":950.495,"smiles":null,"spectrum_id":"CCMSLIB00017220646","spectrum_index":7494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 42.0054 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.128,"smiles":null,"spectrum_id":"CCMSLIB00017220650","spectrum_index":7495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 157.9641 Da; putative annotation: N/A; putative formula: C8H-2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.043,"smiles":null,"spectrum_id":"CCMSLIB00017220651","spectrum_index":7496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 158.0208 Da; putative annotation: N/A; putative formula: C3H-2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.279,"smiles":null,"spectrum_id":"CCMSLIB00017220652","spectrum_index":7497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU203801 Carbamazepine-10,11-epoxide|Carbamazepine epoxide (delta mass: 79.9567 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.054,"smiles":null,"spectrum_id":"CCMSLIB00017220654","spectrum_index":7498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15(R)-15-Methylprostaglandin F2.alpha. methyl ester (delta mass: 52.0312 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.31,"smiles":null,"spectrum_id":"CCMSLIB00017220657","spectrum_index":7499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 118.0783 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.316,"smiles":null,"spectrum_id":"CCMSLIB00017220658","spectrum_index":7500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 50.0 eV (delta mass: 155.0346 Da; putative annotation: N/A; putative formula: C6HN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.126,"smiles":null,"spectrum_id":"CCMSLIB00017220660","spectrum_index":7501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 314.2983 Da; putative annotation: N/A; putative formula: C23H38)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.39,"smiles":null,"spectrum_id":"CCMSLIB00017220663","spectrum_index":7502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Methoxyphenyl)acetic acid (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.097,"smiles":null,"spectrum_id":"CCMSLIB00017220664","spectrum_index":7503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 178.084 Da; putative annotation: N/A; putative formula: C7H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.295,"smiles":null,"spectrum_id":"CCMSLIB00017220665","spectrum_index":7504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 313.2994 Da; putative annotation: N/A; putative formula: C19H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.552,"smiles":null,"spectrum_id":"CCMSLIB00017220667","spectrum_index":7505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-7,12-Dihydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 100.0673 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.274,"smiles":null,"spectrum_id":"CCMSLIB00017220670","spectrum_index":7506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 70.0898 Da; putative annotation: N/A; putative formula: C4H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.181,"smiles":null,"spectrum_id":"CCMSLIB00017220671","spectrum_index":7507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirubactin (delta mass: 495.2684 Da; putative annotation: N/A; putative formula: C25H42N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1100.49,"smiles":null,"spectrum_id":"CCMSLIB00017220672","spectrum_index":7508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 38.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.206,"smiles":null,"spectrum_id":"CCMSLIB00017220674","spectrum_index":7509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 94.1144 Da; putative annotation: N/A; putative formula: C8H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.216,"smiles":null,"spectrum_id":"CCMSLIB00017220677","spectrum_index":7510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazole (delta mass: 58.0944 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.139,"smiles":null,"spectrum_id":"CCMSLIB00017220678","spectrum_index":7511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 567.7391 Da; putative annotation: N/A; putative formula: C16H8O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.82,"smiles":null,"spectrum_id":"CCMSLIB00017220679","spectrum_index":7512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 101.1204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.316,"smiles":null,"spectrum_id":"CCMSLIB00017220682","spectrum_index":7513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 180.119 Da; putative annotation: N/A; putative formula: C10H17N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.214,"smiles":null,"spectrum_id":"CCMSLIB00017220684","spectrum_index":7514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lagochilin (delta mass: 62.0517 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.315,"smiles":null,"spectrum_id":"CCMSLIB00017220685","spectrum_index":7515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002737 Lycopsamine|[(7R,8R)-7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2S)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoate (delta mass: 412.1596 Da; putative annotation: N/A; putative formula: C17H24N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.34,"smiles":null,"spectrum_id":"CCMSLIB00017220686","spectrum_index":7516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 57.9938 Da; putative annotation: N/A; putative formula: C4H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.06,"smiles":null,"spectrum_id":"CCMSLIB00017220687","spectrum_index":7517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 92.0659 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.11,"smiles":null,"spectrum_id":"CCMSLIB00017220691","spectrum_index":7518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 467.2488 Da; putative annotation: N/A; putative formula: C30H34N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.346,"smiles":null,"spectrum_id":"CCMSLIB00017220692","spectrum_index":7519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Enterolactone from NIST14 (delta mass: 15.1417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.27,"smiles":null,"spectrum_id":"CCMSLIB00017220693","spectrum_index":7520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:102040 (delta mass: 267.2135 Da; putative annotation: N/A; putative formula: C15H29N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.482,"smiles":null,"spectrum_id":"CCMSLIB00017220695","spectrum_index":7521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 41.0256 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.106,"smiles":null,"spectrum_id":"CCMSLIB00017220698","spectrum_index":7522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 78.046 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.096,"smiles":null,"spectrum_id":"CCMSLIB00017220699","spectrum_index":7523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 79.0456 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.123,"smiles":null,"spectrum_id":"CCMSLIB00017220700","spectrum_index":7524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 187.0845 Da; putative annotation: N/A; putative formula: C8H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.155,"smiles":null,"spectrum_id":"CCMSLIB00017220702","spectrum_index":7525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 46.0124 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.139,"smiles":null,"spectrum_id":"CCMSLIB00017220705","spectrum_index":7526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 653.2287 Da; putative annotation: N/A; putative formula: C39H27N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1158.41,"smiles":null,"spectrum_id":"CCMSLIB00017220706","spectrum_index":7527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 365.8679 Da; putative annotation: N/A; putative formula: C10H6O3S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.907,"smiles":null,"spectrum_id":"CCMSLIB00017220708","spectrum_index":7528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Glu (delta mass: 555.2334 Da; putative annotation: N/A; putative formula: C29H40N3O2P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.347,"smiles":null,"spectrum_id":"CCMSLIB00017220710","spectrum_index":7529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-S-phenyl-2-(piperidin-1-yl)ethane-1-sulfonamido (delta mass: 41.0269 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.138,"smiles":null,"spectrum_id":"CCMSLIB00017220711","spectrum_index":7530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 298.2143 Da; putative annotation: N/A; putative formula: C17H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.493,"smiles":null,"spectrum_id":"CCMSLIB00017220713","spectrum_index":7531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 294.9819 Da; putative annotation: N/A; putative formula: C8H9NO7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.042,"smiles":null,"spectrum_id":"CCMSLIB00017220716","spectrum_index":7532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-[(Z)-oct-2-enyl]pentanedioic acid (delta mass: 59.0182 Da; putative annotation: N/A; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.172,"smiles":null,"spectrum_id":"CCMSLIB00017220717","spectrum_index":7533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 515.3462 Da; putative annotation: N/A; putative formula: C27H49NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.562,"smiles":null,"spectrum_id":"CCMSLIB00017220719","spectrum_index":7534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 74.052 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.268,"smiles":null,"spectrum_id":"CCMSLIB00017220722","spectrum_index":7535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 91.0638 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.119,"smiles":null,"spectrum_id":"CCMSLIB00017220723","spectrum_index":7536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 74.0839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.207,"smiles":null,"spectrum_id":"CCMSLIB00017220724","spectrum_index":7537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of butyrylhomoserine (delta mass: 45.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.166,"smiles":null,"spectrum_id":"CCMSLIB00017220726","spectrum_index":7538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 129.078 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.164,"smiles":null,"spectrum_id":"CCMSLIB00017220727","spectrum_index":7539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA001641 Coniine (delta mass: 72.0578 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.201,"smiles":null,"spectrum_id":"CCMSLIB00017220730","spectrum_index":7540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 105.0579 Da; putative annotation: N/A; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017220732","spectrum_index":7541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 84.0212 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.274,"smiles":null,"spectrum_id":"CCMSLIB00017220733","spectrum_index":7542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lanosterol (delta mass: 327.2558 Da; putative annotation: N/A; putative formula: C22H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.649,"smiles":null,"spectrum_id":"CCMSLIB00017220734","spectrum_index":7543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperazinyl)acetamide (delta mass: 67.0199 Da; putative annotation: N/A; putative formula: C2HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017220738","spectrum_index":7544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethoxy)benzaldehyde (delta mass: 47.0381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.108,"smiles":null,"spectrum_id":"CCMSLIB00017220739","spectrum_index":7545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-5-carboxylic acid (delta mass: 54.9947 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.05,"smiles":null,"spectrum_id":"CCMSLIB00017220740","spectrum_index":7546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 129.073 Da; putative annotation: N/A; putative formula: C5H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.144,"smiles":null,"spectrum_id":"CCMSLIB00017220742","spectrum_index":7547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 186.0523 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017220745","spectrum_index":7548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 131.0406 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.164,"smiles":null,"spectrum_id":"CCMSLIB00017220746","spectrum_index":7549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 134.1096 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.352,"smiles":null,"spectrum_id":"CCMSLIB00017220748","spectrum_index":7550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 104.0919 Da; putative annotation: N/A; putative formula: H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.35,"smiles":null,"spectrum_id":"CCMSLIB00017220750","spectrum_index":7551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 114.0679 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.107,"smiles":null,"spectrum_id":"CCMSLIB00017220752","spectrum_index":7552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 45.022 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.093,"smiles":null,"spectrum_id":"CCMSLIB00017220753","spectrum_index":7553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 568.95 Da; putative annotation: N/A; putative formula: C10H15N5O15P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.047,"smiles":null,"spectrum_id":"CCMSLIB00017220754","spectrum_index":7554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N,N'-DIACETYL-1,6-DIAMINOHEXANE\"\" (delta mass: 200.1523 Da; putative annotation: N/A; putative formula: C10H20N2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.312,"smiles":null,"spectrum_id":"CCMSLIB00017220756","spectrum_index":7555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 308.2746 Da; putative annotation: N/A; putative formula: C19H37N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.55,"smiles":null,"spectrum_id":"CCMSLIB00017220759","spectrum_index":7556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 54.0315 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.295,"smiles":null,"spectrum_id":"CCMSLIB00017220760","spectrum_index":7557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 131.0677 Da; putative annotation: N/A; putative formula: C4H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.154,"smiles":null,"spectrum_id":"CCMSLIB00017220762","spectrum_index":7558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Chloroacetyl)pyrrole (delta mass: 64.0065 Da; putative annotation: N/A; putative formula: C3N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.028,"smiles":null,"spectrum_id":"CCMSLIB00017220764","spectrum_index":7559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 460.1915 Da; putative annotation: N/A; putative formula: C27H29N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":844.341,"smiles":null,"spectrum_id":"CCMSLIB00017220766","spectrum_index":7560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 609.8865 Da; putative annotation: N/A; putative formula: C16H10N2O16P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.957,"smiles":null,"spectrum_id":"CCMSLIB00017220767","spectrum_index":7561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 182.0574 Da; putative annotation: N/A; putative formula: C9H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.144,"smiles":null,"spectrum_id":"CCMSLIB00017220769","spectrum_index":7562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 415.1553 Da; putative annotation: N/A; putative formula: C12H25N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.247,"smiles":null,"spectrum_id":"CCMSLIB00017220770","spectrum_index":7563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 46.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017220772","spectrum_index":7564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lauroyl Lysine (delta mass: 239.1879 Da; putative annotation: N/A; putative formula: C14H25NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.468,"smiles":null,"spectrum_id":"CCMSLIB00017220774","spectrum_index":7565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 860.7114 Da; putative annotation: N/A; putative formula: C53H96O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1082.81,"smiles":null,"spectrum_id":"CCMSLIB00017220775","spectrum_index":7566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyethoxy)phenol (delta mass: 14.0147 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.085,"smiles":null,"spectrum_id":"CCMSLIB00017220777","spectrum_index":7567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 208.1213 Da; putative annotation: N/A; putative formula: C11H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.27,"smiles":null,"spectrum_id":"CCMSLIB00017220780","spectrum_index":7568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 149.069 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.208,"smiles":null,"spectrum_id":"CCMSLIB00017220781","spectrum_index":7569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.086,"smiles":null,"spectrum_id":"CCMSLIB00017220783","spectrum_index":7570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sumaresinolic acid (delta mass: 94.0798 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.442,"smiles":null,"spectrum_id":"CCMSLIB00017220785","spectrum_index":7571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 234.0506 Da; putative annotation: N/A; putative formula: C16H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.184,"smiles":null,"spectrum_id":"CCMSLIB00017220787","spectrum_index":7572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine 4-.beta.-D-glucuronide (delta mass: 84.0304 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.149,"smiles":null,"spectrum_id":"CCMSLIB00017220789","spectrum_index":7573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,13.alpha.)-7-Oxopimara-8,15-dien-18-oic acid (delta mass: 92.0615 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.273,"smiles":null,"spectrum_id":"CCMSLIB00017220791","spectrum_index":7574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.,16.alpha.-diol-17-one (delta mass: 112.0666 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.278,"smiles":null,"spectrum_id":"CCMSLIB00017220793","spectrum_index":7575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 151.1184 Da; putative annotation: N/A; putative formula: C7H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.163,"smiles":null,"spectrum_id":"CCMSLIB00017220794","spectrum_index":7576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-C18:0 (delta mass: 33.9587 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.296,"smiles":null,"spectrum_id":"CCMSLIB00017220796","spectrum_index":7577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 106.0597 Da; putative annotation: N/A; putative formula: H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.171,"smiles":null,"spectrum_id":"CCMSLIB00017220799","spectrum_index":7578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 604.1878 Da; putative annotation: N/A; putative formula: C24H28N8O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":785.229,"smiles":null,"spectrum_id":"CCMSLIB00017220800","spectrum_index":7579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 869.4758 Da; putative annotation: N/A; putative formula: C41H63N11O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1050.55,"smiles":null,"spectrum_id":"CCMSLIB00017220801","spectrum_index":7580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 691.6361 Da; putative annotation: N/A; putative formula: C42H77N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.727,"smiles":null,"spectrum_id":"CCMSLIB00017220803","spectrum_index":7581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 101.0105 Da; putative annotation: N/A; putative formula: C3H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.097,"smiles":null,"spectrum_id":"CCMSLIB00017220806","spectrum_index":7582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 12-hydroxystearate (delta mass: 192.1491 Da; putative annotation: N/A; putative formula: C9H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.439,"smiles":null,"spectrum_id":"CCMSLIB00017220807","spectrum_index":7583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxo-4-cholestenoic acid (delta mass: 53.9205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.241,"smiles":null,"spectrum_id":"CCMSLIB00017220809","spectrum_index":7584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 82.0414 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.253,"smiles":null,"spectrum_id":"CCMSLIB00017220811","spectrum_index":7585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 74.0726 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.206,"smiles":null,"spectrum_id":"CCMSLIB00017220813","spectrum_index":7586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylpiperidine (delta mass: 86.0212 Da; putative annotation: N/A; putative formula: CH2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.165,"smiles":null,"spectrum_id":"CCMSLIB00017220814","spectrum_index":7587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU099405 8-Hydroxyquinoline|quinolin-8-ol (delta mass: 210.1311 Da; putative annotation: N/A; putative formula: C10H18N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.191,"smiles":null,"spectrum_id":"CCMSLIB00017220816","spectrum_index":7588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 52.0315 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.31,"smiles":null,"spectrum_id":"CCMSLIB00017220819","spectrum_index":7589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 232.1487 Da; putative annotation: N/A; putative formula: C14H21N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.24,"smiles":null,"spectrum_id":"CCMSLIB00017220820","spectrum_index":7590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 58.0416 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017220822","spectrum_index":7591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 76.0694 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.296,"smiles":null,"spectrum_id":"CCMSLIB00017220823","spectrum_index":7592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 158.0713 Da; putative annotation: N/A; putative formula: C7H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.221,"smiles":null,"spectrum_id":"CCMSLIB00017220826","spectrum_index":7593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.268,"smiles":null,"spectrum_id":"CCMSLIB00017220828","spectrum_index":7594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinic acid (delta mass: 90.0835 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.154,"smiles":null,"spectrum_id":"CCMSLIB00017220829","spectrum_index":7595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 283.106 Da; putative annotation: N/A; putative formula: C13H17NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.166,"smiles":null,"spectrum_id":"CCMSLIB00017220831","spectrum_index":7596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 58.0525 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.139,"smiles":null,"spectrum_id":"CCMSLIB00017220834","spectrum_index":7597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 245.1726 Da; putative annotation: N/A; putative formula: C13H28NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.254,"smiles":null,"spectrum_id":"CCMSLIB00017220835","spectrum_index":7598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2 isopropyl ester (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.326,"smiles":null,"spectrum_id":"CCMSLIB00017220836","spectrum_index":7599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufalin (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.315,"smiles":null,"spectrum_id":"CCMSLIB00017220838","spectrum_index":7600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxycapric acid (delta mass: 144.0419 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.19,"smiles":null,"spectrum_id":"CCMSLIB00017220841","spectrum_index":7601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Thr (delta mass: 195.9838 Da; putative annotation: N/A; putative formula: C9H8O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.15,"smiles":null,"spectrum_id":"CCMSLIB00017220842","spectrum_index":7602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 30.0108 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.055,"smiles":null,"spectrum_id":"CCMSLIB00017220843","spectrum_index":7603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 60.0209 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.128,"smiles":null,"spectrum_id":"CCMSLIB00017220844","spectrum_index":7604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxycarbonyl-2H-1,4-benzoxazin-3(4H)-one (delta mass: 31.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.103,"smiles":null,"spectrum_id":"CCMSLIB00017220848","spectrum_index":7605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Allyl 3-amino-1-piperidinecarboxylate (delta mass: 342.9992 Da; putative annotation: N/A; putative formula: C12H9NO9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.128,"smiles":null,"spectrum_id":"CCMSLIB00017220849","spectrum_index":7606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 247.157 Da; putative annotation: N/A; putative formula: C15H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.232,"smiles":null,"spectrum_id":"CCMSLIB00017220850","spectrum_index":7607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,18-Dihydroxy-8,11,13-abietatrien-7-one (delta mass: 109.0528 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.264,"smiles":null,"spectrum_id":"CCMSLIB00017220853","spectrum_index":7608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethylpiperazine (delta mass: 116.0831 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.206,"smiles":null,"spectrum_id":"CCMSLIB00017220855","spectrum_index":7609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 18.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.101,"smiles":null,"spectrum_id":"CCMSLIB00017220856","spectrum_index":7610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 90.0467 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.315,"smiles":null,"spectrum_id":"CCMSLIB00017220857","spectrum_index":7611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 224.1047 Da; putative annotation: N/A; putative formula: C12H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.154,"smiles":null,"spectrum_id":"CCMSLIB00017220859","spectrum_index":7612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 209.0687 Da; putative annotation: N/A; putative formula: C10H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.144,"smiles":null,"spectrum_id":"CCMSLIB00017220862","spectrum_index":7613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Acetyl-16alpha-hydroxytrametenolic acid (delta mass: 104.0669 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.44,"smiles":null,"spectrum_id":"CCMSLIB00017220863","spectrum_index":7614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.-Hydroxyetiocholanolone (delta mass: 142.0991 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.326,"smiles":null,"spectrum_id":"CCMSLIB00017220865","spectrum_index":7615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclic adenosine diphosphate ribose (delta mass: 280.9326 Da; putative annotation: N/A; putative formula: C8H3N5O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":823.001,"smiles":null,"spectrum_id":"CCMSLIB00017220867","spectrum_index":7616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 151.0549 Da; putative annotation: N/A; putative formula: C8H10NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.126,"smiles":null,"spectrum_id":"CCMSLIB00017220869","spectrum_index":7617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ginsenoside F1 (delta mass: 48.0406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.487,"smiles":null,"spectrum_id":"CCMSLIB00017220870","spectrum_index":7618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 411.3863 Da; putative annotation: N/A; putative formula: C29H49N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.451,"smiles":null,"spectrum_id":"CCMSLIB00017220872","spectrum_index":7619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 24.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.134,"smiles":null,"spectrum_id":"CCMSLIB00017220875","spectrum_index":7620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 111.0323 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.15,"smiles":null,"spectrum_id":"CCMSLIB00017220876","spectrum_index":7621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)Semivioxanthin (delta mass: 134.0578 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.149,"smiles":null,"spectrum_id":"CCMSLIB00017220878","spectrum_index":7622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 266.0719 Da; putative annotation: N/A; putative formula: C14H11N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.12,"smiles":null,"spectrum_id":"CCMSLIB00017220880","spectrum_index":7623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-4,8-dimethyl-2H-chromen-2-one (delta mass: 208.1817 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.252,"smiles":null,"spectrum_id":"CCMSLIB00017220883","spectrum_index":7624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 99.0314 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.118,"smiles":null,"spectrum_id":"CCMSLIB00017220884","spectrum_index":7625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 352.1151 Da; putative annotation: N/A; putative formula: C11H21N4O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.221,"smiles":null,"spectrum_id":"CCMSLIB00017220885","spectrum_index":7626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 44.0826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.169,"smiles":null,"spectrum_id":"CCMSLIB00017220887","spectrum_index":7627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-(1H-Imidazol-4-yl)propyl]-N'-methylthiourea (delta mass: 99.0426 Da; putative annotation: N/A; putative formula: C3H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.144,"smiles":null,"spectrum_id":"CCMSLIB00017220890","spectrum_index":7628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 17.0046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.07,"smiles":null,"spectrum_id":"CCMSLIB00017220891","spectrum_index":7629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.268,"smiles":null,"spectrum_id":"CCMSLIB00017220893","spectrum_index":7630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 51.9971 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.094,"smiles":null,"spectrum_id":"CCMSLIB00017220894","spectrum_index":7631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 27.9874 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.1,"smiles":null,"spectrum_id":"CCMSLIB00017220897","spectrum_index":7632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084605 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 78.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017220899","spectrum_index":7633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.347,"smiles":null,"spectrum_id":"CCMSLIB00017220900","spectrum_index":7634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 438.2617 Da; putative annotation: N/A; putative formula: C24H38O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.348,"smiles":null,"spectrum_id":"CCMSLIB00017220901","spectrum_index":7635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(8-Hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)prop-2-enoic acid (delta mass: 28.0317 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017220905","spectrum_index":7636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-(6,7-Dimethoxyquinazolin-4-yl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]amine (delta mass: 17.0135 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017220906","spectrum_index":7637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 45.0365 Da; putative annotation: N/A; putative formula: H3N3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.102,"smiles":null,"spectrum_id":"CCMSLIB00017220907","spectrum_index":7638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 293.1109 Da; putative annotation: N/A; putative formula: C11H19NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.312,"smiles":null,"spectrum_id":"CCMSLIB00017220908","spectrum_index":7639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 268.2383 Da; putative annotation: N/A; putative formula: C13H28N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.286,"smiles":null,"spectrum_id":"CCMSLIB00017220912","spectrum_index":7640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 264.2562 Da; putative annotation: N/A; putative formula: C17H32N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.483,"smiles":null,"spectrum_id":"CCMSLIB00017220913","spectrum_index":7641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 263.2466 Da; putative annotation: N/A; putative formula: C15H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.51,"smiles":null,"spectrum_id":"CCMSLIB00017220914","spectrum_index":7642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE10; MS2Dec (delta mass: 122.0732 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.149,"smiles":null,"spectrum_id":"CCMSLIB00017220916","spectrum_index":7643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 238.2288 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.342,"smiles":null,"spectrum_id":"CCMSLIB00017220919","spectrum_index":7644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 27.9665 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017220920","spectrum_index":7645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 158.1053 Da; putative annotation: N/A; putative formula: C7H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.208,"smiles":null,"spectrum_id":"CCMSLIB00017220921","spectrum_index":7646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 90.0832 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017220924","spectrum_index":7647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 388.1308 Da; putative annotation: N/A; putative formula: C24H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.264,"smiles":null,"spectrum_id":"CCMSLIB00017220926","spectrum_index":7648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 107.0195 Da; putative annotation: 3-Aminobenzenethiol; putative formula: C6H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.09,"smiles":null,"spectrum_id":"CCMSLIB00017220927","spectrum_index":7649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 119.0367 Da; putative annotation: Salicylamide; AIF; CE0; MS2Dec; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.123,"smiles":null,"spectrum_id":"CCMSLIB00017220929","spectrum_index":7650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 121.0632 Da; putative annotation: 4-Amino-2-methyl-5-pyrimidinemethanol; putative formula: C6H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.124,"smiles":null,"spectrum_id":"CCMSLIB00017220931","spectrum_index":7651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-MANNOSAMINE (delta mass: 184.1228 Da; putative annotation: L-Alanyl-L-norleucine; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.22,"smiles":null,"spectrum_id":"CCMSLIB00017220933","spectrum_index":7652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 352.2225 Da; putative annotation: 15(R),19(R)-Hydroxyprostaglandin F2.alpha.; putative formula: C20H32O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.434,"smiles":null,"spectrum_id":"CCMSLIB00017220935","spectrum_index":7653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grandiflorenic acid (delta mass: 346.2148 Da; putative annotation: 3.beta.,5.beta.-Tetrahydrocortisone; putative formula: C21H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.431,"smiles":null,"spectrum_id":"CCMSLIB00017220937","spectrum_index":7654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 274.193 Da; putative annotation: NCGC00386020-01_C18H28O3_8-{(1S,5R)-4-Oxo-5-[(2Z)-2-penten-1-yl]-2-cyclopenten-1-yl}octanoic acid; putative formula: C18H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.404,"smiles":null,"spectrum_id":"CCMSLIB00017220939","spectrum_index":7655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 278.2202 Da; putative annotation: (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.463,"smiles":null,"spectrum_id":"CCMSLIB00017220941","spectrum_index":7656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 294.2559 Da; putative annotation: Ricinoleic acid methyl ester; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.503,"smiles":null,"spectrum_id":"CCMSLIB00017220942","spectrum_index":7657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 312.2454 Da; putative annotation: cis-7,10,13,16,19-Docosapentaenoic acid; putative formula: C22H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.456,"smiles":null,"spectrum_id":"CCMSLIB00017220944","spectrum_index":7658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,7,10,13,16,19-Docosahexaenoic acid (delta mass: 278.261 Da; putative annotation: Phytomonic acid; putative formula: C19H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.508,"smiles":null,"spectrum_id":"CCMSLIB00017220947","spectrum_index":7659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 332.2356 Da; putative annotation: 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one; putative formula: C21H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.468,"smiles":null,"spectrum_id":"CCMSLIB00017220948","spectrum_index":7660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 238.2296 Da; putative annotation: 2-Hexyldecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.451,"smiles":null,"spectrum_id":"CCMSLIB00017220950","spectrum_index":7661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 488.1965 Da; putative annotation: 6-O-((2E)-2-Methylbut-2-enoyl)-.alpha.-D-glucopyranosyl 6-O-((2E)-2-methylbut-2-enoyl)-.alpha.-D-glucopyranoside; putative formula: C22H32O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.308,"smiles":null,"spectrum_id":"CCMSLIB00017220952","spectrum_index":7662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 150.0687 Da; putative annotation: 1-(4-Hydroxyphenyl)propane-1,2-diol; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.135,"smiles":null,"spectrum_id":"CCMSLIB00017220954","spectrum_index":7663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocorticosterone (delta mass: 317.2366 Da; putative annotation: Gly-C18:3; putative formula: C20H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.49,"smiles":null,"spectrum_id":"CCMSLIB00017220955","spectrum_index":7664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .omega.-3 Arachidonic acid (delta mass: 280.241 Da; putative annotation: 6-Oxooctadecanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.489,"smiles":null,"spectrum_id":"CCMSLIB00017220958","spectrum_index":7665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Leu from NIST14 (delta mass: 128.0952 Da; putative annotation: Lysine; LC-tDDA; CE10; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.292,"smiles":null,"spectrum_id":"CCMSLIB00017220960","spectrum_index":7666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 166.1333 Da; putative annotation: 10-Hendecenoic acid; putative formula: C11H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.209,"smiles":null,"spectrum_id":"CCMSLIB00017220961","spectrum_index":7667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Putative (3-hydroxyheptadecanoyl)glycine (delta mass: 254.2259 Da; putative annotation: DL-.beta.-Hydroxypalmitic acid; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.505,"smiles":null,"spectrum_id":"CCMSLIB00017220962","spectrum_index":7668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 468.2731 Da; putative annotation: 2-(Hexopyranosyloxy)-3-hydroxypropyl (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate; putative formula: C25H40O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.489,"smiles":null,"spectrum_id":"CCMSLIB00017220965","spectrum_index":7669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 363.2601 Da; putative annotation: D-erythro-Sphinganine-1-phosphate; putative formula: C18H38NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.482,"smiles":null,"spectrum_id":"CCMSLIB00017220966","spectrum_index":7670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 161.084 Da; putative annotation: 2-Amino-3-(3-methylphenyl)propanoic acid; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.197,"smiles":null,"spectrum_id":"CCMSLIB00017220967","spectrum_index":7671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coniine (delta mass: 293.1658 Da; putative annotation: N/A; putative formula: C15H24N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.309,"smiles":null,"spectrum_id":"CCMSLIB00017220970","spectrum_index":7672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.206,"smiles":null,"spectrum_id":"CCMSLIB00017220972","spectrum_index":7673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 314.2809 Da; putative annotation: N/A; putative formula: C19H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.544,"smiles":null,"spectrum_id":"CCMSLIB00017220973","spectrum_index":7674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 166.0625 Da; putative annotation: N/A; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.305,"smiles":null,"spectrum_id":"CCMSLIB00017220974","spectrum_index":7675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 180.0804 Da; putative annotation: N/A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.114,"smiles":null,"spectrum_id":"CCMSLIB00017220976","spectrum_index":7676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(1H-Indol-3-yl)vinyl]isoquinoline (delta mass: 248.1148 Da; putative annotation: N/A; putative formula: C7H17N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.238,"smiles":null,"spectrum_id":"CCMSLIB00017220979","spectrum_index":7677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 97.9653 Da; putative annotation: N/A; putative formula: C4H2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.239,"smiles":null,"spectrum_id":"CCMSLIB00017220980","spectrum_index":7678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 694.2237 Da; putative annotation: N/A; putative formula: C38H26N14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1029.33,"smiles":null,"spectrum_id":"CCMSLIB00017220981","spectrum_index":7679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 104.0102 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.117,"smiles":null,"spectrum_id":"CCMSLIB00017220983","spectrum_index":7680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 320.3071 Da; putative annotation: N/A; putative formula: C22H40O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.43,"smiles":null,"spectrum_id":"CCMSLIB00017220986","spectrum_index":7681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 90.0835 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.347,"smiles":null,"spectrum_id":"CCMSLIB00017220987","spectrum_index":7682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 55.0754 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.081,"smiles":null,"spectrum_id":"CCMSLIB00017220988","spectrum_index":7683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 255.1117 Da; putative annotation: N/A; putative formula: C13H21NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.162,"smiles":null,"spectrum_id":"CCMSLIB00017220989","spectrum_index":7684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 75.8367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.912,"smiles":null,"spectrum_id":"CCMSLIB00017220993","spectrum_index":7685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desoxypipradrol (delta mass: 514.2097 Da; putative annotation: N/A; putative formula: C22H34N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.384,"smiles":null,"spectrum_id":"CCMSLIB00017220994","spectrum_index":7686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 176.0682 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.149,"smiles":null,"spectrum_id":"CCMSLIB00017220995","spectrum_index":7687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxyquinoline-2-carboxylic acid CollisionEnergy:102040 (delta mass: 121.0529 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.118,"smiles":null,"spectrum_id":"CCMSLIB00017220997","spectrum_index":7688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 201.075 Da; putative annotation: N/A; putative formula: C7H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.146,"smiles":null,"spectrum_id":"CCMSLIB00017221000","spectrum_index":7689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-3.alpha.-ol-11,20-dione (delta mass: 453.2716 Da; putative annotation: N/A; putative formula: C21H31N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.514,"smiles":null,"spectrum_id":"CCMSLIB00017221001","spectrum_index":7690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2Z,6S)-6-[(1S,3aS,9aR,11aS)-3a,6,6,9a,11a-pentamethyl-7-oxo-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.373,"smiles":null,"spectrum_id":"CCMSLIB00017221002","spectrum_index":7691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 345.2509 Da; putative annotation: N/A; putative formula: C18H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.453,"smiles":null,"spectrum_id":"CCMSLIB00017221004","spectrum_index":7692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 50.0516 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.305,"smiles":null,"spectrum_id":"CCMSLIB00017221007","spectrum_index":7693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxyphenylacetic acid (delta mass: 118.0419 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.091,"smiles":null,"spectrum_id":"CCMSLIB00017221008","spectrum_index":7694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 104.1925 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.331,"smiles":null,"spectrum_id":"CCMSLIB00017221010","spectrum_index":7695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 993.5313 Da; putative annotation: N/A; putative formula: C52H75N5O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1186.6,"smiles":null,"spectrum_id":"CCMSLIB00017221011","spectrum_index":7696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-1-piperazinyl)acetic acid (delta mass: 58.006 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.119,"smiles":null,"spectrum_id":"CCMSLIB00017221014","spectrum_index":7697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 113.484 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.575,"smiles":null,"spectrum_id":"CCMSLIB00017221015","spectrum_index":7698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 211.0695 Da; putative annotation: N/A; putative formula: C9H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.125,"smiles":null,"spectrum_id":"CCMSLIB00017221016","spectrum_index":7699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 175.0458 Da; putative annotation: N/A; putative formula: C10H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.116,"smiles":null,"spectrum_id":"CCMSLIB00017221017","spectrum_index":7700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 176.015 Da; putative annotation: N/A; putative formula: C7H12O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.05,"smiles":null,"spectrum_id":"CCMSLIB00017221021","spectrum_index":7701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00386058-01_C24H35NO4_(1S,2R,3R,6S,7R,8S,11S,14S,15S,18R)-18-Hydroxy-8-isobutyl-5,6,15-trimethyl-19-oxa-9-azapentacyclo[13.3.1.0~2,14~.0~3,11~.0~7,11~]nonadec-4-ene-10,12-dione (delta mass: 77.9368 Da; putative annotation: N/A; putative formula: HO-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.201,"smiles":null,"spectrum_id":"CCMSLIB00017221022","spectrum_index":7702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 210.198 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.311,"smiles":null,"spectrum_id":"CCMSLIB00017221023","spectrum_index":7703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,,3S,5Z)-3-hydroxy-1,5-octadien-1-yl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5Z)- (delta mass: 23.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.289,"smiles":null,"spectrum_id":"CCMSLIB00017221025","spectrum_index":7704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C5:0 (delta mass: 157.1459 Da; putative annotation: N/A; putative formula: C9H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.29,"smiles":null,"spectrum_id":"CCMSLIB00017221028","spectrum_index":7705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 289.2632 Da; putative annotation: N/A; putative formula: C17H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.453,"smiles":null,"spectrum_id":"CCMSLIB00017221029","spectrum_index":7706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 618.4242 Da; putative annotation: N/A; putative formula: C35H58N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.563,"smiles":null,"spectrum_id":"CCMSLIB00017221030","spectrum_index":7707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvaol (delta mass: 142.1216 Da; putative annotation: N/A; putative formula: C6H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.51,"smiles":null,"spectrum_id":"CCMSLIB00017221032","spectrum_index":7708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 145.0204 Da; putative annotation: N/A; putative formula: C5H9NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.159,"smiles":null,"spectrum_id":"CCMSLIB00017221035","spectrum_index":7709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 186.1037 Da; putative annotation: N/A; putative formula: C7H15N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.159,"smiles":null,"spectrum_id":"CCMSLIB00017221036","spectrum_index":7710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Syringaresinol (delta mass: 49.9823 Da; putative annotation: N/A; putative formula: C3H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.152,"smiles":null,"spectrum_id":"CCMSLIB00017221037","spectrum_index":7711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 46.0053 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.232,"smiles":null,"spectrum_id":"CCMSLIB00017221039","spectrum_index":7712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017221042","spectrum_index":7713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 45.9513 Da; putative annotation: N/A; putative formula: H-2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.006,"smiles":null,"spectrum_id":"CCMSLIB00017221043","spectrum_index":7714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16(17)-Epoxy-4Z,7Z,10Z,13Z,19Z-docosapentaenoic acid (delta mass: 35.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.28,"smiles":null,"spectrum_id":"CCMSLIB00017221045","spectrum_index":7715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 128.0838 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.165,"smiles":null,"spectrum_id":"CCMSLIB00017221046","spectrum_index":7716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 32.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.106,"smiles":null,"spectrum_id":"CCMSLIB00017221049","spectrum_index":7717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 127.0629 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.149,"smiles":null,"spectrum_id":"CCMSLIB00017221051","spectrum_index":7718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 80.0612 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.309,"smiles":null,"spectrum_id":"CCMSLIB00017221052","spectrum_index":7719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ramosetron (delta mass: 159.0897 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.234,"smiles":null,"spectrum_id":"CCMSLIB00017221053","spectrum_index":7720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLPUTRESCINE (delta mass: 71.0733 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.191,"smiles":null,"spectrum_id":"CCMSLIB00017221057","spectrum_index":7721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 409.1844 Da; putative annotation: N/A; putative formula: C21H32NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.25,"smiles":null,"spectrum_id":"CCMSLIB00017221058","spectrum_index":7722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 16.1985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.274,"smiles":null,"spectrum_id":"CCMSLIB00017221059","spectrum_index":7723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 106.0419 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.106,"smiles":null,"spectrum_id":"CCMSLIB00017221060","spectrum_index":7724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 50.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.248,"smiles":null,"spectrum_id":"CCMSLIB00017221063","spectrum_index":7725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-4-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 723.4544 Da; putative annotation: N/A; putative formula: C36H57N11O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":982.624,"smiles":null,"spectrum_id":"CCMSLIB00017221064","spectrum_index":7726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nordentatin (delta mass: 241.0314 Da; putative annotation: N/A; putative formula: C20H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.175,"smiles":null,"spectrum_id":"CCMSLIB00017221066","spectrum_index":7727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 279.3528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.629,"smiles":null,"spectrum_id":"CCMSLIB00017221067","spectrum_index":7728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydro-11-deoxycorticosterone (delta mass: 132.0974 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.355,"smiles":null,"spectrum_id":"CCMSLIB00017221070","spectrum_index":7729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 338.2446 Da; putative annotation: N/A; putative formula: C20H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.284,"smiles":null,"spectrum_id":"CCMSLIB00017221072","spectrum_index":7730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uzarigenin (delta mass: 94.077 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.33,"smiles":null,"spectrum_id":"CCMSLIB00017221073","spectrum_index":7731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003547 Hordenine|4-[2-(dimethylamino)ethyl]phenol (delta mass: 57.0603 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.183,"smiles":null,"spectrum_id":"CCMSLIB00017221075","spectrum_index":7732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 444.0993 Da; putative annotation: N/A; putative formula: C21H20N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.165,"smiles":null,"spectrum_id":"CCMSLIB00017221077","spectrum_index":7733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentedrone (delta mass: 114.0682 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.207,"smiles":null,"spectrum_id":"CCMSLIB00017221079","spectrum_index":7734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-[(3S)-piperidin-3-yl]acetate (delta mass: 43.0058 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.123,"smiles":null,"spectrum_id":"CCMSLIB00017221081","spectrum_index":7735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-[(3S)-piperidin-3-yl]acetate (delta mass: 42.8781 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.996,"smiles":null,"spectrum_id":"CCMSLIB00017221083","spectrum_index":7736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 66.048 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.296,"smiles":null,"spectrum_id":"CCMSLIB00017221085","spectrum_index":7737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 86.0518 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017221086","spectrum_index":7738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 66.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.3,"smiles":null,"spectrum_id":"CCMSLIB00017221088","spectrum_index":7739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 64.0163 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.056,"smiles":null,"spectrum_id":"CCMSLIB00017221090","spectrum_index":7740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Hydroxy-5Z,7E,11Z,14Z,17Z-eicosapentaenoic acid (delta mass: 24.0364 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.263,"smiles":null,"spectrum_id":"CCMSLIB00017221092","spectrum_index":7741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 81.0794 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.322,"smiles":null,"spectrum_id":"CCMSLIB00017221094","spectrum_index":7742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulin (delta mass: 200.1566 Da; putative annotation: N/A; putative formula: C15H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.545,"smiles":null,"spectrum_id":"CCMSLIB00017221096","spectrum_index":7743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 58.0058 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.103,"smiles":null,"spectrum_id":"CCMSLIB00017221098","spectrum_index":7744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 63.064 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.155,"smiles":null,"spectrum_id":"CCMSLIB00017221099","spectrum_index":7745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 41.1286 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.101,"smiles":null,"spectrum_id":"CCMSLIB00017221101","spectrum_index":7746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DIHYDROURACIL (delta mass: 73.0412 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.091,"smiles":null,"spectrum_id":"CCMSLIB00017221103","spectrum_index":7747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 218.0758 Da; putative annotation: N/A; putative formula: C13H14OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.151,"smiles":null,"spectrum_id":"CCMSLIB00017221105","spectrum_index":7748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 209.0691 Da; putative annotation: N/A; putative formula: C10H11NO4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.134,"smiles":null,"spectrum_id":"CCMSLIB00017221107","spectrum_index":7749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 178.0835 Da; putative annotation: N/A; putative formula: C7H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.159,"smiles":null,"spectrum_id":"CCMSLIB00017221108","spectrum_index":7750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 161.0415 Da; putative annotation: N/A; putative formula: C8H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.119,"smiles":null,"spectrum_id":"CCMSLIB00017221111","spectrum_index":7751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(+)-4-Amino-3-hydroxybutyric acid (delta mass: 268.2405 Da; putative annotation: N/A; putative formula: C17H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.306,"smiles":null,"spectrum_id":"CCMSLIB00017221113","spectrum_index":7752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 283.1266 Da; putative annotation: N/A; putative formula: C10H21NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.311,"smiles":null,"spectrum_id":"CCMSLIB00017221114","spectrum_index":7753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 62.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.122,"smiles":null,"spectrum_id":"CCMSLIB00017221115","spectrum_index":7754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 264.0678 Da; putative annotation: N/A; putative formula: C13H9N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.128,"smiles":null,"spectrum_id":"CCMSLIB00017221118","spectrum_index":7755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of linoleic acid (delta mass: 615.5203 Da; putative annotation: N/A; putative formula: C43H69NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.768,"smiles":null,"spectrum_id":"CCMSLIB00017221120","spectrum_index":7756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 615.5238 Da; putative annotation: N/A; putative formula: C40H65N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":920.771,"smiles":null,"spectrum_id":"CCMSLIB00017221121","spectrum_index":7757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 591.5248 Da; putative annotation: N/A; putative formula: C38H65N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.757,"smiles":null,"spectrum_id":"CCMSLIB00017221122","spectrum_index":7758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 125.0403 Da; putative annotation: N/A; putative formula: C6H8NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.232,"smiles":null,"spectrum_id":"CCMSLIB00017221125","spectrum_index":7759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 250.1267 Da; putative annotation: N/A; putative formula: C10H23N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.202,"smiles":null,"spectrum_id":"CCMSLIB00017221127","spectrum_index":7760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 333.1249 Da; putative annotation: N/A; putative formula: C14H23NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.201,"smiles":null,"spectrum_id":"CCMSLIB00017221128","spectrum_index":7761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.305,"smiles":null,"spectrum_id":"CCMSLIB00017221129","spectrum_index":7762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 95.0368 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.076,"smiles":null,"spectrum_id":"CCMSLIB00017221132","spectrum_index":7763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 150.1819 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.362,"smiles":null,"spectrum_id":"CCMSLIB00017221134","spectrum_index":7764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 136.1226 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.251,"smiles":null,"spectrum_id":"CCMSLIB00017221135","spectrum_index":7765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 428.134 Da; putative annotation: N/A; putative formula: C20H30O4P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.231,"smiles":null,"spectrum_id":"CCMSLIB00017221137","spectrum_index":7766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 31.0184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.255,"smiles":null,"spectrum_id":"CCMSLIB00017221140","spectrum_index":7767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.206,"smiles":null,"spectrum_id":"CCMSLIB00017221141","spectrum_index":7768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxo-1-phenyl-1,6-dihydro-3-pyridazinecarboxylic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.071,"smiles":null,"spectrum_id":"CCMSLIB00017221143","spectrum_index":7769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 108.0935 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.331,"smiles":null,"spectrum_id":"CCMSLIB00017221144","spectrum_index":7770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 116.1002 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.327,"smiles":null,"spectrum_id":"CCMSLIB00017221147","spectrum_index":7771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethanolamide (delta mass: 102.0899 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.38,"smiles":null,"spectrum_id":"CCMSLIB00017221149","spectrum_index":7772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 152.1203 Da; putative annotation: N/A; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.179,"smiles":null,"spectrum_id":"CCMSLIB00017221150","spectrum_index":7773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Buphedrone (delta mass: 10.0289 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.152,"smiles":null,"spectrum_id":"CCMSLIB00017221151","spectrum_index":7774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Cyclopentylpropyl)methylamine (delta mass: 590.5752 Da; putative annotation: N/A; putative formula: C38H74N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.734,"smiles":null,"spectrum_id":"CCMSLIB00017221155","spectrum_index":7775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 509.2989 Da; putative annotation: N/A; putative formula: C27H43NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.531,"smiles":null,"spectrum_id":"CCMSLIB00017221156","spectrum_index":7776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 236.0887 Da; putative annotation: N/A; putative formula: C13H18P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.321,"smiles":null,"spectrum_id":"CCMSLIB00017221157","spectrum_index":7777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 131.0465 Da; putative annotation: N/A; putative formula: C7H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017221158","spectrum_index":7778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 122.1094 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017221162","spectrum_index":7779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 69.8753 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.923,"smiles":null,"spectrum_id":"CCMSLIB00017221163","spectrum_index":7780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of n-homoveratroylhomoveratrylamine (delta mass: 18.0094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.19,"smiles":null,"spectrum_id":"CCMSLIB00017221164","spectrum_index":7781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.alpha.-estrane-3.alpha.,17.beta.-diol (delta mass: 80.0619 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.325,"smiles":null,"spectrum_id":"CCMSLIB00017221165","spectrum_index":7782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)acetamide (delta mass: 15.8446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.962,"smiles":null,"spectrum_id":"CCMSLIB00017221169","spectrum_index":7783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 53.0036 Da; putative annotation: N/A; putative formula: CH-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.116,"smiles":null,"spectrum_id":"CCMSLIB00017221170","spectrum_index":7784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butaprost (free acid) (delta mass: 50.0518 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.331,"smiles":null,"spectrum_id":"CCMSLIB00017221171","spectrum_index":7785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 275.3764 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.652,"smiles":null,"spectrum_id":"CCMSLIB00017221172","spectrum_index":7786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1133.5615 Da; putative annotation: N/A; putative formula: C52H75N15O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1296.62,"smiles":null,"spectrum_id":"CCMSLIB00017221176","spectrum_index":7787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 162.0527 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1135.38,"smiles":null,"spectrum_id":"CCMSLIB00017221177","spectrum_index":7788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 346.0886 Da; putative annotation: N/A; putative formula: C18H20O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.212,"smiles":null,"spectrum_id":"CCMSLIB00017221178","spectrum_index":7789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 174.1216 Da; putative annotation: N/A; putative formula: CH10N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.217,"smiles":null,"spectrum_id":"CCMSLIB00017221180","spectrum_index":7790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 149.1031 Da; putative annotation: N/A; putative formula: C2H11N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.158,"smiles":null,"spectrum_id":"CCMSLIB00017221182","spectrum_index":7791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Orbifomitellic acid (delta mass: 112.0662 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.413,"smiles":null,"spectrum_id":"CCMSLIB00017221183","spectrum_index":7792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Piperazinyl)-1H-indole (delta mass: 15.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.155,"smiles":null,"spectrum_id":"CCMSLIB00017221184","spectrum_index":7793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 112.0523 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017221186","spectrum_index":7794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-chlorophenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 41.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.142,"smiles":null,"spectrum_id":"CCMSLIB00017221189","spectrum_index":7795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 865.5864 Da; putative annotation: N/A; putative formula: C48H79N7O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1087.68,"smiles":null,"spectrum_id":"CCMSLIB00017221190","spectrum_index":7796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phytomonic acid (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.305,"smiles":null,"spectrum_id":"CCMSLIB00017221191","spectrum_index":7797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 325.1566 Da; putative annotation: N/A; putative formula: C13H29NO4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.221,"smiles":null,"spectrum_id":"CCMSLIB00017221193","spectrum_index":7798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 270.2562 Da; putative annotation: N/A; putative formula: C17H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.332,"smiles":null,"spectrum_id":"CCMSLIB00017221196","spectrum_index":7799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 365.3167 Da; putative annotation: N/A; putative formula: C20H39N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.7,"smiles":null,"spectrum_id":"CCMSLIB00017221197","spectrum_index":7800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 118.0779 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.18,"smiles":null,"spectrum_id":"CCMSLIB00017221199","spectrum_index":7801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017221201","spectrum_index":7802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 195.0532 Da; putative annotation: N/A; putative formula: C9H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.087,"smiles":null,"spectrum_id":"CCMSLIB00017221203","spectrum_index":7803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 269.1854 Da; putative annotation: N/A; putative formula: C12H23N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.224,"smiles":null,"spectrum_id":"CCMSLIB00017221204","spectrum_index":7804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 721.5055 Da; putative annotation: N/A; putative formula: C41H72NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.581,"smiles":null,"spectrum_id":"CCMSLIB00017221206","spectrum_index":7805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 43.0036 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017221208","spectrum_index":7806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 72.021 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.16,"smiles":null,"spectrum_id":"CCMSLIB00017221210","spectrum_index":7807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-7,12-Dihydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 126.083 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.289,"smiles":null,"spectrum_id":"CCMSLIB00017221211","spectrum_index":7808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 105.1182 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.147,"smiles":null,"spectrum_id":"CCMSLIB00017221214","spectrum_index":7809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 141.0423 Da; putative annotation: N/A; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.118,"smiles":null,"spectrum_id":"CCMSLIB00017221216","spectrum_index":7810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 157.0414 Da; putative annotation: N/A; putative formula: C4H7N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.102,"smiles":null,"spectrum_id":"CCMSLIB00017221217","spectrum_index":7811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-3-Methyl-5-(1,2,5,5-tetramethyl-7-oxo-3,4,4a,6-tetrahydro-2H-naphthalen-1-yl)pent-2-enoic acid (delta mass: 34.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.28,"smiles":null,"spectrum_id":"CCMSLIB00017221220","spectrum_index":7812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 119.0042 Da; putative annotation: N/A; putative formula: C3H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.21,"smiles":null,"spectrum_id":"CCMSLIB00017221222","spectrum_index":7813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 64.0666 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.116,"smiles":null,"spectrum_id":"CCMSLIB00017221223","spectrum_index":7814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 494.1947 Da; putative annotation: N/A; putative formula: C20H36N2O8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":753.317,"smiles":null,"spectrum_id":"CCMSLIB00017221225","spectrum_index":7815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 39.0502 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.126,"smiles":null,"spectrum_id":"CCMSLIB00017221227","spectrum_index":7816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 66.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.143,"smiles":null,"spectrum_id":"CCMSLIB00017221228","spectrum_index":7817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 50.0 eV (delta mass: 126.063 Da; putative annotation: N/A; putative formula: C6H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.166,"smiles":null,"spectrum_id":"CCMSLIB00017221231","spectrum_index":7818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 28.1069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.182,"smiles":null,"spectrum_id":"CCMSLIB00017221233","spectrum_index":7819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 105.5658 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.657,"smiles":null,"spectrum_id":"CCMSLIB00017221234","spectrum_index":7820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 145.0778 Da; putative annotation: N/A; putative formula: C4H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.148,"smiles":null,"spectrum_id":"CCMSLIB00017221235","spectrum_index":7821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 70.078 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017221237","spectrum_index":7822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 100.5431 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.634,"smiles":null,"spectrum_id":"CCMSLIB00017221239","spectrum_index":7823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.133,"smiles":null,"spectrum_id":"CCMSLIB00017221241","spectrum_index":7824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dimethyl-1,3-benzenediol (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017221242","spectrum_index":7825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 137.1051 Da; putative annotation: N/A; putative formula: C6H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.202,"smiles":null,"spectrum_id":"CCMSLIB00017221244","spectrum_index":7826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 45.0124 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.13,"smiles":null,"spectrum_id":"CCMSLIB00017221246","spectrum_index":7827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 30.0828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.143,"smiles":null,"spectrum_id":"CCMSLIB00017221248","spectrum_index":7828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 51.0473 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.145,"smiles":null,"spectrum_id":"CCMSLIB00017221249","spectrum_index":7829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 30.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.107,"smiles":null,"spectrum_id":"CCMSLIB00017221252","spectrum_index":7830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 81.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.326,"smiles":null,"spectrum_id":"CCMSLIB00017221254","spectrum_index":7831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 17.9657 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.177,"smiles":null,"spectrum_id":"CCMSLIB00017221255","spectrum_index":7832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 78.0134 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.137,"smiles":null,"spectrum_id":"CCMSLIB00017221257","spectrum_index":7833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 71.0735 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.321,"smiles":null,"spectrum_id":"CCMSLIB00017221259","spectrum_index":7834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 153.0425 Da; putative annotation: N/A; putative formula: C7H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.129,"smiles":null,"spectrum_id":"CCMSLIB00017221261","spectrum_index":7835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 58.0418 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017221263","spectrum_index":7836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.044,"smiles":null,"spectrum_id":"CCMSLIB00017221265","spectrum_index":7837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl-4-fluoroindole-2-carboxylate (delta mass: 143.0419 Da; putative annotation: N/A; putative formula: C6H11NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.119,"smiles":null,"spectrum_id":"CCMSLIB00017221266","spectrum_index":7838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-17-ol-3,20-dione (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.237,"smiles":null,"spectrum_id":"CCMSLIB00017221267","spectrum_index":7839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(8-Chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethanone (delta mass: 43.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.089,"smiles":null,"spectrum_id":"CCMSLIB00017221269","spectrum_index":7840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 34.9908 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.066,"smiles":null,"spectrum_id":"CCMSLIB00017221271","spectrum_index":7841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 74.0352 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.116,"smiles":null,"spectrum_id":"CCMSLIB00017221273","spectrum_index":7842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-ethenyl-1,4a,7-trimethyl-6-oxo-2,3,4,8,8a,9,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.227,"smiles":null,"spectrum_id":"CCMSLIB00017221275","spectrum_index":7843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-N-stearoylsphingosine (delta mass: 346.323 Da; putative annotation: N/A; putative formula: C24H42O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.613,"smiles":null,"spectrum_id":"CCMSLIB00017221277","spectrum_index":7844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 152.0517 Da; putative annotation: N/A; putative formula: C6H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.112,"smiles":null,"spectrum_id":"CCMSLIB00017221279","spectrum_index":7845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-butylphenol (delta mass: 145.0928 Da; putative annotation: N/A; putative formula: C7H15NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.215,"smiles":null,"spectrum_id":"CCMSLIB00017221281","spectrum_index":7846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 78.0832 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.273,"smiles":null,"spectrum_id":"CCMSLIB00017221282","spectrum_index":7847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Altamisic acid (delta mass: 161.0674 Da; putative annotation: N/A; putative formula: C10H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.206,"smiles":null,"spectrum_id":"CCMSLIB00017221285","spectrum_index":7848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S-Hydroxy-9E,11Z,14Z-eicosatrienoic acid (delta mass: 105.0784 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.336,"smiles":null,"spectrum_id":"CCMSLIB00017221286","spectrum_index":7849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxyculmorin (delta mass: 172.1253 Da; putative annotation: N/A; putative formula: C13H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017221287","spectrum_index":7850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 661.476 Da; putative annotation: N/A; putative formula: C48H59N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.692,"smiles":null,"spectrum_id":"CCMSLIB00017221289","spectrum_index":7851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 123.0993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.212,"smiles":null,"spectrum_id":"CCMSLIB00017221291","spectrum_index":7852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 537.3311 Da; putative annotation: N/A; putative formula: C30H43N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.563,"smiles":null,"spectrum_id":"CCMSLIB00017221293","spectrum_index":7853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-5-hydroxybenzoic acid (delta mass: 26.049 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.099,"smiles":null,"spectrum_id":"CCMSLIB00017221295","spectrum_index":7854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Amino-1,2,5-oxadiazol-3-yl)(4-methylpiperazin-1-yl)methanone (delta mass: 60.0712 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.185,"smiles":null,"spectrum_id":"CCMSLIB00017221296","spectrum_index":7855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 620.5002 Da; putative annotation: N/A; putative formula: C42H70O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.779,"smiles":null,"spectrum_id":"CCMSLIB00017221297","spectrum_index":7856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 372.1562 Da; putative annotation: N/A; putative formula: C15H25N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.263,"smiles":null,"spectrum_id":"CCMSLIB00017221299","spectrum_index":7857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300223 Lyalosidic acid (delta mass: 210.1337 Da; putative annotation: N/A; putative formula: C7H14N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.32,"smiles":null,"spectrum_id":"CCMSLIB00017221302","spectrum_index":7858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arsubin (delta mass: 41.0264 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.175,"smiles":null,"spectrum_id":"CCMSLIB00017221303","spectrum_index":7859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 442.186 Da; putative annotation: N/A; putative formula: C23H30N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.257,"smiles":null,"spectrum_id":"CCMSLIB00017221304","spectrum_index":7860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tibolone (delta mass: 80.0622 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.278,"smiles":null,"spectrum_id":"CCMSLIB00017221306","spectrum_index":7861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl {[(5-chloro-1H-indol-2-yl)carbonyl]amino}acetate (delta mass: 209.1241 Da; putative annotation: N/A; putative formula: C12H19NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.177,"smiles":null,"spectrum_id":"CCMSLIB00017221309","spectrum_index":7862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Colubrinic acid (delta mass: 138.0309 Da; putative annotation: N/A; putative formula: CH7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.378,"smiles":null,"spectrum_id":"CCMSLIB00017221310","spectrum_index":7863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy-2-pyridinecarboxylic acid (delta mass: 22.0207 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.071,"smiles":null,"spectrum_id":"CCMSLIB00017221311","spectrum_index":7864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [3-(Dimethylamino)propyl]urea (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.139,"smiles":null,"spectrum_id":"CCMSLIB00017221314","spectrum_index":7865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 649.4194 Da; putative annotation: N/A; putative formula: C37H63NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.49,"smiles":null,"spectrum_id":"CCMSLIB00017221316","spectrum_index":7866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 204.9605 Da; putative annotation: N/A; putative formula: C3H-1N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.172,"smiles":null,"spectrum_id":"CCMSLIB00017221317","spectrum_index":7867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 211.0849 Da; putative annotation: N/A; putative formula: C10H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.177,"smiles":null,"spectrum_id":"CCMSLIB00017221319","spectrum_index":7868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 27.9475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.028,"smiles":null,"spectrum_id":"CCMSLIB00017221321","spectrum_index":7869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 281.2357 Da; putative annotation: N/A; putative formula: C17H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.343,"smiles":null,"spectrum_id":"CCMSLIB00017221323","spectrum_index":7870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 77.0301 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.111,"smiles":null,"spectrum_id":"CCMSLIB00017221324","spectrum_index":7871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)acetamide (delta mass: 92.0616 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.18,"smiles":null,"spectrum_id":"CCMSLIB00017221326","spectrum_index":7872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 321.198 Da; putative annotation: N/A; putative formula: C15H31NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.326,"smiles":null,"spectrum_id":"CCMSLIB00017221328","spectrum_index":7873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 100.053 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017221329","spectrum_index":7874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 236.0642 Da; putative annotation: N/A; putative formula: C7H12N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.291,"smiles":null,"spectrum_id":"CCMSLIB00017221331","spectrum_index":7875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 71.0582 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.295,"smiles":null,"spectrum_id":"CCMSLIB00017221332","spectrum_index":7876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 1072.5506 Da; putative annotation: N/A; putative formula: C58H88N8O-1S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1253.62,"smiles":null,"spectrum_id":"CCMSLIB00017221335","spectrum_index":7877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxy-4Z,7Z,10Z,13Z,16Z,18E-docosahexaenoic acid (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.268,"smiles":null,"spectrum_id":"CCMSLIB00017221337","spectrum_index":7878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 621.5685 Da; putative annotation: N/A; putative formula: C39H75NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.795,"smiles":null,"spectrum_id":"CCMSLIB00017221338","spectrum_index":7879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 146.0732 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.321,"smiles":null,"spectrum_id":"CCMSLIB00017221340","spectrum_index":7880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.133,"smiles":null,"spectrum_id":"CCMSLIB00017221341","spectrum_index":7881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 132.5253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.56,"smiles":null,"spectrum_id":"CCMSLIB00017221344","spectrum_index":7882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.,5.beta.-Tetrahydrocortisone (delta mass: 98.0551 Da; putative annotation: N/A; putative formula: C6H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.287,"smiles":null,"spectrum_id":"CCMSLIB00017221345","spectrum_index":7883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 370.1348 Da; putative annotation: N/A; putative formula: C22H19N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.176,"smiles":null,"spectrum_id":"CCMSLIB00017221347","spectrum_index":7884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 68.0374 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.108,"smiles":null,"spectrum_id":"CCMSLIB00017221350","spectrum_index":7885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 709.3856 Da; putative annotation: N/A; putative formula: C39H56N3O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":836.425,"smiles":null,"spectrum_id":"CCMSLIB00017221351","spectrum_index":7886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 128.1048 Da; putative annotation: N/A; putative formula: C5H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.352,"smiles":null,"spectrum_id":"CCMSLIB00017221353","spectrum_index":7887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 314.0997 Da; putative annotation: N/A; putative formula: C14H18O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.134,"smiles":null,"spectrum_id":"CCMSLIB00017221354","spectrum_index":7888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 180.0642 Da; putative annotation: N/A; putative formula: C7H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.119,"smiles":null,"spectrum_id":"CCMSLIB00017221357","spectrum_index":7889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 59.0009 Da; putative annotation: N/A; putative formula: CHNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.145,"smiles":null,"spectrum_id":"CCMSLIB00017221359","spectrum_index":7890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 202.0843 Da; putative annotation: N/A; putative formula: C9H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.165,"smiles":null,"spectrum_id":"CCMSLIB00017221360","spectrum_index":7891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 27.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.118,"smiles":null,"spectrum_id":"CCMSLIB00017221362","spectrum_index":7892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 36.0639 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.171,"smiles":null,"spectrum_id":"CCMSLIB00017221363","spectrum_index":7893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 601.9546 Da; putative annotation: N/A; putative formula: C20H26O5S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.036,"smiles":null,"spectrum_id":"CCMSLIB00017221365","spectrum_index":7894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 27.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.133,"smiles":null,"spectrum_id":"CCMSLIB00017221367","spectrum_index":7895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 14.0221 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.092,"smiles":null,"spectrum_id":"CCMSLIB00017221369","spectrum_index":7896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 76.0315 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.118,"smiles":null,"spectrum_id":"CCMSLIB00017221371","spectrum_index":7897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 35.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.295,"smiles":null,"spectrum_id":"CCMSLIB00017221373","spectrum_index":7898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-CA (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.358,"smiles":null,"spectrum_id":"CCMSLIB00017221375","spectrum_index":7899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carboxylic acid, ethyl ester (delta mass: 207.1078 Da; putative annotation: N/A; putative formula: C12H17NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.194,"smiles":null,"spectrum_id":"CCMSLIB00017221376","spectrum_index":7900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140306 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 15.0036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017221378","spectrum_index":7901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 183.2352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.541,"smiles":null,"spectrum_id":"CCMSLIB00017221381","spectrum_index":7902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 184.7102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.016,"smiles":null,"spectrum_id":"CCMSLIB00017221382","spectrum_index":7903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 544.2652 Da; putative annotation: N/A; putative formula: C27H40N6O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.383,"smiles":null,"spectrum_id":"CCMSLIB00017221383","spectrum_index":7904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 99.0344 Da; putative annotation: N/A; putative formula: C3H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.11,"smiles":null,"spectrum_id":"CCMSLIB00017221385","spectrum_index":7905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 301.1307 Da; putative annotation: N/A; putative formula: C11H20N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.296,"smiles":null,"spectrum_id":"CCMSLIB00017221388","spectrum_index":7906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 20.9779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.012,"smiles":null,"spectrum_id":"CCMSLIB00017221389","spectrum_index":7907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 11.9998 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017221390","spectrum_index":7908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aflatoxin M1 (delta mass: 74.073 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.139,"smiles":null,"spectrum_id":"CCMSLIB00017221393","spectrum_index":7909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 142.2036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.284,"smiles":null,"spectrum_id":"CCMSLIB00017221395","spectrum_index":7910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 223.1573 Da; putative annotation: N/A; putative formula: C13H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.244,"smiles":null,"spectrum_id":"CCMSLIB00017221396","spectrum_index":7911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine D (delta mass: 270.1487 Da; putative annotation: N/A; putative formula: C15H18N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.33,"smiles":null,"spectrum_id":"CCMSLIB00017221398","spectrum_index":7912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 292.9849 Da; putative annotation: N/A; putative formula: C9H11NO4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.045,"smiles":null,"spectrum_id":"CCMSLIB00017221401","spectrum_index":7913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Ala (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.182,"smiles":null,"spectrum_id":"CCMSLIB00017221402","spectrum_index":7914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(9H-Carbazol-9-yl)-3-(4-chlorophenoxy)-2-propanol (delta mass: 114.0406 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.151,"smiles":null,"spectrum_id":"CCMSLIB00017221403","spectrum_index":7915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 144.0423 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.18,"smiles":null,"spectrum_id":"CCMSLIB00017221406","spectrum_index":7916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 341.3274 Da; putative annotation: N/A; putative formula: C17H39N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.586,"smiles":null,"spectrum_id":"CCMSLIB00017221408","spectrum_index":7917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 72.0688 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.129,"smiles":null,"spectrum_id":"CCMSLIB00017221409","spectrum_index":7918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homogentisic acid (delta mass: 124.0966 Da; putative annotation: N/A; putative formula: C7H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.146,"smiles":null,"spectrum_id":"CCMSLIB00017221410","spectrum_index":7919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methylquinolin-2(1H)-one (delta mass: 128.8684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.944,"smiles":null,"spectrum_id":"CCMSLIB00017221414","spectrum_index":7920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 86.0252 Da; putative annotation: N/A; putative formula: C6H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.128,"smiles":null,"spectrum_id":"CCMSLIB00017221415","spectrum_index":7921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4-dihydroxybenzoic acid CollisionEnergy:102040\"\" (delta mass: 40.9748 Da; putative annotation: N/A; putative formula: C16H23N7O6S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.009,"smiles":null,"spectrum_id":"CCMSLIB00017221416","spectrum_index":7922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 273.0486 Da; putative annotation: N/A; putative formula: C10H11NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.109,"smiles":null,"spectrum_id":"CCMSLIB00017221417","spectrum_index":7923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-5,8,11,14-Eicosatetraenoic acid from NIST14 (delta mass: 62.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.284,"smiles":null,"spectrum_id":"CCMSLIB00017221421","spectrum_index":7924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 160.0711 Da; putative annotation: N/A; putative formula: C11H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.131,"smiles":null,"spectrum_id":"CCMSLIB00017221422","spectrum_index":7925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 42.047 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017221423","spectrum_index":7926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,17-diol, (3.alpha.,5.alpha.,17.beta.)- (delta mass: 140.1055 Da; putative annotation: N/A; putative formula: C6H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.353,"smiles":null,"spectrum_id":"CCMSLIB00017221424","spectrum_index":7927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 824.4549 Da; putative annotation: N/A; putative formula: C56H60N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.515,"smiles":null,"spectrum_id":"CCMSLIB00017221428","spectrum_index":7928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 92.0628 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.144,"smiles":null,"spectrum_id":"CCMSLIB00017221429","spectrum_index":7929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 154.1029 Da; putative annotation: N/A; putative formula: C8H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.242,"smiles":null,"spectrum_id":"CCMSLIB00017221430","spectrum_index":7930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vincamine (delta mass: 23.0694 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.271,"smiles":null,"spectrum_id":"CCMSLIB00017221433","spectrum_index":7931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 76.0438 Da; putative annotation: N/A; putative formula: C5H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.12,"smiles":null,"spectrum_id":"CCMSLIB00017221435","spectrum_index":7932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-3-(4-piperidinyl)-1H-indole (delta mass: 33.9894 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.119,"smiles":null,"spectrum_id":"CCMSLIB00017221436","spectrum_index":7933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 58.1384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.189,"smiles":null,"spectrum_id":"CCMSLIB00017221437","spectrum_index":7934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacetic acid (delta mass: 129.0427 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.113,"smiles":null,"spectrum_id":"CCMSLIB00017221441","spectrum_index":7935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 148.0735 Da; putative annotation: N/A; putative formula: C6H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017221442","spectrum_index":7936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8(9)-Epoxy-5Z,11Z,14Z,17Z-eicosatetraenoic acid (delta mass: 351.2415 Da; putative annotation: N/A; putative formula: C13H33N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.468,"smiles":null,"spectrum_id":"CCMSLIB00017221443","spectrum_index":7937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 39.0475 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.113,"smiles":null,"spectrum_id":"CCMSLIB00017221444","spectrum_index":7938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 463.1021 Da; putative annotation: N/A; putative formula: C15H23N5O8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.252,"smiles":null,"spectrum_id":"CCMSLIB00017221448","spectrum_index":7939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxy-4,5-dimethylphenyl)ethanone (delta mass: 57.0217 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017221449","spectrum_index":7940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 885.4672 Da; putative annotation: N/A; putative formula: C52H63N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1179.59,"smiles":null,"spectrum_id":"CCMSLIB00017221450","spectrum_index":7941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 351.2249 Da; putative annotation: N/A; putative formula: C20H35NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.363,"smiles":null,"spectrum_id":"CCMSLIB00017221453","spectrum_index":7942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 173.1077 Da; putative annotation: N/A; putative formula: C7H16N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.189,"smiles":null,"spectrum_id":"CCMSLIB00017221455","spectrum_index":7943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 76.0677 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.211,"smiles":null,"spectrum_id":"CCMSLIB00017221456","spectrum_index":7944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 415.1478 Da; putative annotation: N/A; putative formula: C18H25NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.24,"smiles":null,"spectrum_id":"CCMSLIB00017221457","spectrum_index":7945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Benzimidazol-2-ylcyanamide (delta mass: 33.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.077,"smiles":null,"spectrum_id":"CCMSLIB00017221461","spectrum_index":7946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.342,"smiles":null,"spectrum_id":"CCMSLIB00017221462","spectrum_index":7947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11,14-Eicosadienoic acid (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.305,"smiles":null,"spectrum_id":"CCMSLIB00017221463","spectrum_index":7948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 603.363 Da; putative annotation: N/A; putative formula: C41H50NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":958.647,"smiles":null,"spectrum_id":"CCMSLIB00017221466","spectrum_index":7949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 52.0249 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.09,"smiles":null,"spectrum_id":"CCMSLIB00017221468","spectrum_index":7950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Hydroxynorethindrone (delta mass: 74.0613 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.257,"smiles":null,"spectrum_id":"CCMSLIB00017221469","spectrum_index":7951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 200.0792 Da; putative annotation: N/A; putative formula: C10H17PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.15,"smiles":null,"spectrum_id":"CCMSLIB00017221471","spectrum_index":7952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 113.0486 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.108,"smiles":null,"spectrum_id":"CCMSLIB00017221473","spectrum_index":7953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 111.0884 Da; putative annotation: N/A; putative formula: C4H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.164,"smiles":null,"spectrum_id":"CCMSLIB00017221474","spectrum_index":7954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 176.0684 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017221476","spectrum_index":7955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 622.1904 Da; putative annotation: N/A; putative formula: C21H40N2O15P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.229,"smiles":null,"spectrum_id":"CCMSLIB00017221478","spectrum_index":7956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 516.2973 Da; putative annotation: N/A; putative formula: C24H44N4O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.415,"smiles":null,"spectrum_id":"CCMSLIB00017221480","spectrum_index":7957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 41.0024 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.069,"smiles":null,"spectrum_id":"CCMSLIB00017221481","spectrum_index":7958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 384.1531 Da; putative annotation: N/A; putative formula: C17H24N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.276,"smiles":null,"spectrum_id":"CCMSLIB00017221484","spectrum_index":7959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 215.2245 Da; putative annotation: N/A; putative formula: C9H25N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.467,"smiles":null,"spectrum_id":"CCMSLIB00017221486","spectrum_index":7960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 148.0362 Da; putative annotation: N/A; putative formula: C2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.107,"smiles":null,"spectrum_id":"CCMSLIB00017221487","spectrum_index":7961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 323.1867 Da; putative annotation: N/A; putative formula: C14H30NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.241,"smiles":null,"spectrum_id":"CCMSLIB00017221489","spectrum_index":7962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 91.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.305,"smiles":null,"spectrum_id":"CCMSLIB00017221491","spectrum_index":7963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017221493","spectrum_index":7964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 396.2408 Da; putative annotation: N/A; putative formula: C16H36N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.375,"smiles":null,"spectrum_id":"CCMSLIB00017221495","spectrum_index":7965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 105.1151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017221497","spectrum_index":7966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 126.0316 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017221498","spectrum_index":7967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 79.9666 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.075,"smiles":null,"spectrum_id":"CCMSLIB00017221501","spectrum_index":7968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melatonin (delta mass: 113.0482 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.177,"smiles":null,"spectrum_id":"CCMSLIB00017221503","spectrum_index":7969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1a,1b-Dihomoprostaglandin E1 (delta mass: 78.0472 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.326,"smiles":null,"spectrum_id":"CCMSLIB00017221504","spectrum_index":7970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 24.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.123,"smiles":null,"spectrum_id":"CCMSLIB00017221505","spectrum_index":7971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 278.1594 Da; putative annotation: N/A; putative formula: C12H29N2O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.24,"smiles":null,"spectrum_id":"CCMSLIB00017221507","spectrum_index":7972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 14.0038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.101,"smiles":null,"spectrum_id":"CCMSLIB00017221509","spectrum_index":7973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flindersine CollisionEnergy:102040 (delta mass: 27.9981 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.1,"smiles":null,"spectrum_id":"CCMSLIB00017221511","spectrum_index":7974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 17.0385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.12,"smiles":null,"spectrum_id":"CCMSLIB00017221513","spectrum_index":7975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 258.256 Da; putative annotation: N/A; putative formula: C12H30N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.327,"smiles":null,"spectrum_id":"CCMSLIB00017221514","spectrum_index":7976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 118.0991 Da; putative annotation: N/A; putative formula: C2H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.242,"smiles":null,"spectrum_id":"CCMSLIB00017221517","spectrum_index":7977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 125.1813 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.304,"smiles":null,"spectrum_id":"CCMSLIB00017221519","spectrum_index":7978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 259.2053 Da; putative annotation: N/A; putative formula: C16H25N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.271,"smiles":null,"spectrum_id":"CCMSLIB00017221520","spectrum_index":7979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 134.0928 Da; putative annotation: N/A; putative formula: C2H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.34,"smiles":null,"spectrum_id":"CCMSLIB00017221521","spectrum_index":7980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 268.1028 Da; putative annotation: N/A; putative formula: C8H20N4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.168,"smiles":null,"spectrum_id":"CCMSLIB00017221525","spectrum_index":7981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 429.6151 Da; putative annotation: N/A; putative formula: H-1O-1PS13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.686,"smiles":null,"spectrum_id":"CCMSLIB00017221526","spectrum_index":7982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(14,15-Epoxyeicosatrienoyl)glycerol (delta mass: 60.0359 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.315,"smiles":null,"spectrum_id":"CCMSLIB00017221527","spectrum_index":7983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 244.1306 Da; putative annotation: N/A; putative formula: C12H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.227,"smiles":null,"spectrum_id":"CCMSLIB00017221529","spectrum_index":7984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-O-((2.alpha.,3.beta.,5.Xi.,9.Xi.,18.Xi.,19.alpha.)-2,3,19-Trihydroxy-28-oxoolean-12-en-28-yl)-.beta.-D-glucopyranose (delta mass: 122.112 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.522,"smiles":null,"spectrum_id":"CCMSLIB00017221532","spectrum_index":7985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid (delta mass: 483.199 Da; putative annotation: N/A; putative formula: C22H21N13O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.29,"smiles":null,"spectrum_id":"CCMSLIB00017221533","spectrum_index":7986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,18.Xi.)-3-Oxolup-20(29)-ene-27,28-dioic acid (delta mass: 126.0838 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.41,"smiles":null,"spectrum_id":"CCMSLIB00017221534","spectrum_index":7987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 811.5468 Da; putative annotation: N/A; putative formula: C46H77N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1118.81,"smiles":null,"spectrum_id":"CCMSLIB00017221536","spectrum_index":7988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Channaine (delta mass: 277.2197 Da; putative annotation: N/A; putative formula: C21H27NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.5,"smiles":null,"spectrum_id":"CCMSLIB00017221539","spectrum_index":7989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 9.985 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.123,"smiles":null,"spectrum_id":"CCMSLIB00017221540","spectrum_index":7990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 178.0825 Da; putative annotation: N/A; putative formula: C4H6N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.33,"smiles":null,"spectrum_id":"CCMSLIB00017221541","spectrum_index":7991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoarachidin (delta mass: 465.3232 Da; putative annotation: N/A; putative formula: C24H44N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":852.67,"smiles":null,"spectrum_id":"CCMSLIB00017221543","spectrum_index":7992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; LC-tDDA; CE10 (delta mass: 56.0595 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.157,"smiles":null,"spectrum_id":"CCMSLIB00017221546","spectrum_index":7993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 157.1467 Da; putative annotation: N/A; putative formula: C9H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.379,"smiles":null,"spectrum_id":"CCMSLIB00017221547","spectrum_index":7994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytochalasin B (delta mass: 116.0666 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.341,"smiles":null,"spectrum_id":"CCMSLIB00017221549","spectrum_index":7995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 145.0372 Da; putative annotation: N/A; putative formula: C5H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.155,"smiles":null,"spectrum_id":"CCMSLIB00017221552","spectrum_index":7996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 188.0873 Da; putative annotation: N/A; putative formula: C9H16O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.226,"smiles":null,"spectrum_id":"CCMSLIB00017221553","spectrum_index":7997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 99.0681 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.165,"smiles":null,"spectrum_id":"CCMSLIB00017221555","spectrum_index":7998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 86.0683 Da; putative annotation: N/A; putative formula: CH6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.15,"smiles":null,"spectrum_id":"CCMSLIB00017221558","spectrum_index":7999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Cyclopentene-1-octanoic acid, 2-(3-hydroxy-1-penten-1-yl)-5-oxo- (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.232,"smiles":null,"spectrum_id":"CCMSLIB00017221559","spectrum_index":8000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 193.1402 Da; putative annotation: N/A; putative formula: C12H20NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.238,"smiles":null,"spectrum_id":"CCMSLIB00017221561","spectrum_index":8001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-3,4,5-Trimethoxycinnamic acid - 40.0 eV (delta mass: 31.0435 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.135,"smiles":null,"spectrum_id":"CCMSLIB00017221563","spectrum_index":8002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MELIBIOSE (delta mass: 113.0843 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.208,"smiles":null,"spectrum_id":"CCMSLIB00017221565","spectrum_index":8003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 72.0604 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017221567","spectrum_index":8004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 121.0964 Da; putative annotation: N/A; putative formula: C7H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.173,"smiles":null,"spectrum_id":"CCMSLIB00017221569","spectrum_index":8005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholecalciferol (delta mass: 17.9737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017221571","spectrum_index":8006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 65.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.108,"smiles":null,"spectrum_id":"CCMSLIB00017221573","spectrum_index":8007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 14,15-EE-(8Z)-E from NIST14 (delta mass: 198.0751 Da; putative annotation: N/A; putative formula: C7H10N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.349,"smiles":null,"spectrum_id":"CCMSLIB00017221575","spectrum_index":8008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 120.0466 Da; putative annotation: N/A; putative formula: C2H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.186,"smiles":null,"spectrum_id":"CCMSLIB00017221577","spectrum_index":8009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D2 (delta mass: 419.1605 Da; putative annotation: N/A; putative formula: C23H17N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.502,"smiles":null,"spectrum_id":"CCMSLIB00017221579","spectrum_index":8010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 315.279 Da; putative annotation: N/A; putative formula: C19H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.464,"smiles":null,"spectrum_id":"CCMSLIB00017221581","spectrum_index":8011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Trifluoromethylphenyl)ethylamine (delta mass: 60.0807 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.165,"smiles":null,"spectrum_id":"CCMSLIB00017221582","spectrum_index":8012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 111.0208 Da; putative annotation: N/A; putative formula: C7HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017221584","spectrum_index":8013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 189.0426 Da; putative annotation: N/A; putative formula: C10H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.166,"smiles":null,"spectrum_id":"CCMSLIB00017221586","spectrum_index":8014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Piperazin-1-yl)ethanamine (delta mass: 73.0891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.223,"smiles":null,"spectrum_id":"CCMSLIB00017221588","spectrum_index":8015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Untitled CollisionEnergy:205060 (delta mass: 18.0081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.173,"smiles":null,"spectrum_id":"CCMSLIB00017221590","spectrum_index":8016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 349.1194 Da; putative annotation: N/A; putative formula: C14H23NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.253,"smiles":null,"spectrum_id":"CCMSLIB00017221592","spectrum_index":8017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 92.0373 Da; putative annotation: 6-Amino-2-pyridone; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.098,"smiles":null,"spectrum_id":"CCMSLIB00017221594","spectrum_index":8018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-MANNOSAMINE (delta mass: 242.1268 Da; putative annotation: Ile-Glu; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.224,"smiles":null,"spectrum_id":"CCMSLIB00017221596","spectrum_index":8019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 111.0318 Da; putative annotation: D-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017221598","spectrum_index":8020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 126.0312 Da; putative annotation: 2-(Hydroxymethyl)-3-methoxy-2H-furan-5-one; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.091,"smiles":null,"spectrum_id":"CCMSLIB00017221600","spectrum_index":8021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 106.0529 Da; putative annotation: 2-Cyano-N-(prop-2-en-1-yl)acetamide; putative formula: C6H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.124,"smiles":null,"spectrum_id":"CCMSLIB00017221602","spectrum_index":8022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 278.2232 Da; putative annotation: Laetisaric acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.466,"smiles":null,"spectrum_id":"CCMSLIB00017221604","spectrum_index":8023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 292.2401 Da; putative annotation: 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.467,"smiles":null,"spectrum_id":"CCMSLIB00017221605","spectrum_index":8024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 954.3077 Da; putative annotation: .alpha.-Cyclodextrin; putative formula: C36H58O29)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1459.48,"smiles":null,"spectrum_id":"CCMSLIB00017221607","spectrum_index":8025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 316.2015 Da; putative annotation: 20-Carboxyarachidonic acid; putative formula: C20H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.46,"smiles":null,"spectrum_id":"CCMSLIB00017221610","spectrum_index":8026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 296.2338 Da; putative annotation: 9,10-Dihydroxy-12Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.476,"smiles":null,"spectrum_id":"CCMSLIB00017221611","spectrum_index":8027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 275.1389 Da; putative annotation: Massbank:PR310825 N-Fructosyl isoleucine; putative formula: C12H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.315,"smiles":null,"spectrum_id":"CCMSLIB00017221612","spectrum_index":8028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of 4-Vinylphenol (delta mass: 146.0579 Da; putative annotation: \"\"1,5-ANHYDRO-GLUCITOL\"\"; putative formula: C6H10O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017221614","spectrum_index":8029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 324.2665 Da; putative annotation: Prostaglandin F1.alpha. alcohol; putative formula: C20H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.514,"smiles":null,"spectrum_id":"CCMSLIB00017221617","spectrum_index":8030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 334.2473 Da; putative annotation: 1-Monolinolenin; putative formula: C21H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.307,"smiles":null,"spectrum_id":"CCMSLIB00017221618","spectrum_index":8031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 293.2413 Da; putative annotation: Gly-C16:1; putative formula: C18H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.458,"smiles":null,"spectrum_id":"CCMSLIB00017221619","spectrum_index":8032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid from NIST14 (delta mass: 407.2829 Da; putative annotation: Jervine; putative formula: C27H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.51,"smiles":null,"spectrum_id":"CCMSLIB00017221623","spectrum_index":8033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 296.0897 Da; putative annotation: (4-(.beta.-D-Glucopyranosyloxy)phenyl)acetic acid; putative formula: C14H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.15,"smiles":null,"spectrum_id":"CCMSLIB00017221624","spectrum_index":8034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid (delta mass: 186.0313 Da; putative annotation: 3-Carboxy-6-methylcoumarin; putative formula: C11H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.07,"smiles":null,"spectrum_id":"CCMSLIB00017221625","spectrum_index":8035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 173.0479 Da; putative annotation: 5-hydroxy-2-methylindole-3-carboxylic acid CollisionEnergy:205060; putative formula: C10H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.134,"smiles":null,"spectrum_id":"CCMSLIB00017221626","spectrum_index":8036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cinnamylpiperazine (delta mass: 164.072 Da; putative annotation: Harmane; putative formula: C12H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.226,"smiles":null,"spectrum_id":"CCMSLIB00017221630","spectrum_index":8037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 401.2985 Da; putative annotation: Ser-C22:4; putative formula: C25H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.51,"smiles":null,"spectrum_id":"CCMSLIB00017221631","spectrum_index":8038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin - 40.0 eV (delta mass: 64.0162 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.071,"smiles":null,"spectrum_id":"CCMSLIB00017221632","spectrum_index":8039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valeryl-carnitine; AIF; CE30; MS2Dec (delta mass: 56.0611 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.231,"smiles":null,"spectrum_id":"CCMSLIB00017221633","spectrum_index":8040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 126.0317 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.081,"smiles":null,"spectrum_id":"CCMSLIB00017221637","spectrum_index":8041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosahexaenoic acid - 40.0 eV (delta mass: 52.064 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.311,"smiles":null,"spectrum_id":"CCMSLIB00017221638","spectrum_index":8042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3S)-3-Hydroxyleucine (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017221639","spectrum_index":8043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 42.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.149,"smiles":null,"spectrum_id":"CCMSLIB00017221640","spectrum_index":8044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Lys (delta mass: 83.0734 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.234,"smiles":null,"spectrum_id":"CCMSLIB00017221644","spectrum_index":8045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 540.1649 Da; putative annotation: N/A; putative formula: C30H36OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.225,"smiles":null,"spectrum_id":"CCMSLIB00017221645","spectrum_index":8046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 210.0885 Da; putative annotation: N/A; putative formula: C5H15N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.153,"smiles":null,"spectrum_id":"CCMSLIB00017221646","spectrum_index":8047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)propanamide (delta mass: 45.0211 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.155,"smiles":null,"spectrum_id":"CCMSLIB00017221649","spectrum_index":8048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 179.0795 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.203,"smiles":null,"spectrum_id":"CCMSLIB00017221650","spectrum_index":8049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 106.0788 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017221651","spectrum_index":8050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 374.2837 Da; putative annotation: N/A; putative formula: C24H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.375,"smiles":null,"spectrum_id":"CCMSLIB00017221653","spectrum_index":8051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 32.0711 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017221656","spectrum_index":8052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminocaproic acid (delta mass: 128.0473 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017221657","spectrum_index":8053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-palmitoyl-D-erythro-sphinganine (delta mass: 808.2103 Da; putative annotation: N/A; putative formula: C47H40N2O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1348.75,"smiles":null,"spectrum_id":"CCMSLIB00017221659","spectrum_index":8054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 85.9995 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.221,"smiles":null,"spectrum_id":"CCMSLIB00017221661","spectrum_index":8055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 184.0371 Da; putative annotation: N/A; putative formula: C8H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.076,"smiles":null,"spectrum_id":"CCMSLIB00017221664","spectrum_index":8056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 61.0163 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.087,"smiles":null,"spectrum_id":"CCMSLIB00017221665","spectrum_index":8057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 417.3094 Da; putative annotation: N/A; putative formula: C22H43NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.38,"smiles":null,"spectrum_id":"CCMSLIB00017221666","spectrum_index":8058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 437.2773 Da; putative annotation: N/A; putative formula: C24H39NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.515,"smiles":null,"spectrum_id":"CCMSLIB00017221669","spectrum_index":8059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Methylgallic acid (delta mass: 45.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.096,"smiles":null,"spectrum_id":"CCMSLIB00017221670","spectrum_index":8060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 439.2938 Da; putative annotation: N/A; putative formula: C24H41NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":794.578,"smiles":null,"spectrum_id":"CCMSLIB00017221671","spectrum_index":8061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 239.1155 Da; putative annotation: N/A; putative formula: C12H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.186,"smiles":null,"spectrum_id":"CCMSLIB00017221673","spectrum_index":8062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 182.0578 Da; putative annotation: N/A; putative formula: C9H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.097,"smiles":null,"spectrum_id":"CCMSLIB00017221676","spectrum_index":8063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 315.2141 Da; putative annotation: N/A; putative formula: C19H29N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.305,"smiles":null,"spectrum_id":"CCMSLIB00017221677","spectrum_index":8064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 260.125 Da; putative annotation: N/A; putative formula: C16H22O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.216,"smiles":null,"spectrum_id":"CCMSLIB00017221678","spectrum_index":8065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017221681","spectrum_index":8066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 64.0074 Da; putative annotation: N/A; putative formula: C3N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.125,"smiles":null,"spectrum_id":"CCMSLIB00017221683","spectrum_index":8067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 9.984 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.013,"smiles":null,"spectrum_id":"CCMSLIB00017221684","spectrum_index":8068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 330.1125 Da; putative annotation: N/A; putative formula: C19H24O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.173,"smiles":null,"spectrum_id":"CCMSLIB00017221686","spectrum_index":8069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 161.1048 Da; putative annotation: N/A; putative formula: C7H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.321,"smiles":null,"spectrum_id":"CCMSLIB00017221688","spectrum_index":8070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 127.0556 Da; putative annotation: N/A; putative formula: C6H10NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.095,"smiles":null,"spectrum_id":"CCMSLIB00017221690","spectrum_index":8071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 453.286 Da; putative annotation: N/A; putative formula: C17H35N13S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.362,"smiles":null,"spectrum_id":"CCMSLIB00017221691","spectrum_index":8072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 94.0262 Da; putative annotation: N/A; putative formula: C3H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.103,"smiles":null,"spectrum_id":"CCMSLIB00017221694","spectrum_index":8073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 278.1311 Da; putative annotation: N/A; putative formula: C11H24N2O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.286,"smiles":null,"spectrum_id":"CCMSLIB00017221696","spectrum_index":8074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 253.1314 Da; putative annotation: N/A; putative formula: C13H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.218,"smiles":null,"spectrum_id":"CCMSLIB00017221697","spectrum_index":8075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 221.1626 Da; putative annotation: N/A; putative formula: C11H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.384,"smiles":null,"spectrum_id":"CCMSLIB00017221699","spectrum_index":8076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kirenol (delta mass: 88.0662 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.319,"smiles":null,"spectrum_id":"CCMSLIB00017221702","spectrum_index":8077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 103.0634 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.129,"smiles":null,"spectrum_id":"CCMSLIB00017221703","spectrum_index":8078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 268.0376 Da; putative annotation: N/A; putative formula: C8H16N2O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.092,"smiles":null,"spectrum_id":"CCMSLIB00017221704","spectrum_index":8079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 64.0673 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.191,"smiles":null,"spectrum_id":"CCMSLIB00017221706","spectrum_index":8080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10-Hydroxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl) (Z)-2-methylbut-2-enoate (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.16,"smiles":null,"spectrum_id":"CCMSLIB00017221709","spectrum_index":8081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 35.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.28,"smiles":null,"spectrum_id":"CCMSLIB00017221710","spectrum_index":8082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lactulose from NIST14 (delta mass: 316.2414 Da; putative annotation: N/A; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.365,"smiles":null,"spectrum_id":"CCMSLIB00017221712","spectrum_index":8083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 148.088 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.294,"smiles":null,"spectrum_id":"CCMSLIB00017221714","spectrum_index":8084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 73.0502 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.11,"smiles":null,"spectrum_id":"CCMSLIB00017221716","spectrum_index":8085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017221718","spectrum_index":8086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 219.1982 Da; putative annotation: N/A; putative formula: C15H25N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.264,"smiles":null,"spectrum_id":"CCMSLIB00017221720","spectrum_index":8087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 88.0664 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.246,"smiles":null,"spectrum_id":"CCMSLIB00017221722","spectrum_index":8088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetonitrile (delta mass: 15.9949 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.071,"smiles":null,"spectrum_id":"CCMSLIB00017221724","spectrum_index":8089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 146.1012 Da; putative annotation: N/A; putative formula: C5H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.38,"smiles":null,"spectrum_id":"CCMSLIB00017221726","spectrum_index":8090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lithocholic acid (delta mass: 88.066 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.371,"smiles":null,"spectrum_id":"CCMSLIB00017221728","spectrum_index":8091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-5,8,11,14-Eicosatetraenoic acid from NIST14 (delta mass: 31.0774 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.325,"smiles":null,"spectrum_id":"CCMSLIB00017221729","spectrum_index":8092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 66.0426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.097,"smiles":null,"spectrum_id":"CCMSLIB00017221732","spectrum_index":8093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 103.0628 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.117,"smiles":null,"spectrum_id":"CCMSLIB00017221734","spectrum_index":8094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 114.0317 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.155,"smiles":null,"spectrum_id":"CCMSLIB00017221735","spectrum_index":8095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 962.2985 Da; putative annotation: N/A; putative formula: C36H58N4O22S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1123.36,"smiles":null,"spectrum_id":"CCMSLIB00017221736","spectrum_index":8096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 568.1511 Da; putative annotation: N/A; putative formula: C30H25N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.192,"smiles":null,"spectrum_id":"CCMSLIB00017221740","spectrum_index":8097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C12:0 (delta mass: 257.1995 Da; putative annotation: N/A; putative formula: C14H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.406,"smiles":null,"spectrum_id":"CCMSLIB00017221741","spectrum_index":8098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lupeol (delta mass: 167.1408 Da; putative annotation: N/A; putative formula: C9H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.534,"smiles":null,"spectrum_id":"CCMSLIB00017221742","spectrum_index":8099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 147.0319 Da; putative annotation: N/A; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.108,"smiles":null,"spectrum_id":"CCMSLIB00017221745","spectrum_index":8100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 235.1421 Da; putative annotation: N/A; putative formula: C10H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.213,"smiles":null,"spectrum_id":"CCMSLIB00017221747","spectrum_index":8101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 140.0698 Da; putative annotation: N/A; putative formula: C5H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.136,"smiles":null,"spectrum_id":"CCMSLIB00017221748","spectrum_index":8102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE (delta mass: 271.1125 Da; putative annotation: N/A; putative formula: C16H18NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.157,"smiles":null,"spectrum_id":"CCMSLIB00017221749","spectrum_index":8103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 180.1401 Da; putative annotation: N/A; putative formula: C9H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.278,"smiles":null,"spectrum_id":"CCMSLIB00017221753","spectrum_index":8104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 428.2306 Da; putative annotation: N/A; putative formula: C26H37OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.348,"smiles":null,"spectrum_id":"CCMSLIB00017221754","spectrum_index":8105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 157.1099 Da; putative annotation: N/A; putative formula: C8H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.191,"smiles":null,"spectrum_id":"CCMSLIB00017221755","spectrum_index":8106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,18.Xi.)-3-Oxolup-20(29)-ene-27,28-dioic acid (delta mass: 14.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.378,"smiles":null,"spectrum_id":"CCMSLIB00017221757","spectrum_index":8107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 140.0451 Da; putative annotation: N/A; putative formula: C3H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.272,"smiles":null,"spectrum_id":"CCMSLIB00017221760","spectrum_index":8108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 206.1059 Da; putative annotation: N/A; putative formula: C11H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.203,"smiles":null,"spectrum_id":"CCMSLIB00017221761","spectrum_index":8109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 176.0299 Da; putative annotation: N/A; putative formula: C10H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.132,"smiles":null,"spectrum_id":"CCMSLIB00017221762","spectrum_index":8110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 98.0776 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.156,"smiles":null,"spectrum_id":"CCMSLIB00017221764","spectrum_index":8111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385666-01!(1R,2S)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-2-N,3-N-bis[2-(4-hydroxyphenyl)ethyl]-6,8-dimethoxy-1,2-dihydronaphthalene-2,3-dicarboxamide (delta mass: 18.0066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.282,"smiles":null,"spectrum_id":"CCMSLIB00017221767","spectrum_index":8112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 186.123 Da; putative annotation: N/A; putative formula: C6H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.355,"smiles":null,"spectrum_id":"CCMSLIB00017221769","spectrum_index":8113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 100.0676 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017221770","spectrum_index":8114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 74.0364 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017221773","spectrum_index":8115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 34.0206 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.154,"smiles":null,"spectrum_id":"CCMSLIB00017221775","spectrum_index":8116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6,7,8-Tetrahydro-2(1H)-quinolinone (delta mass: 82.0416 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.133,"smiles":null,"spectrum_id":"CCMSLIB00017221776","spectrum_index":8117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 531.1456 Da; putative annotation: N/A; putative formula: C20H29N5O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":820.398,"smiles":null,"spectrum_id":"CCMSLIB00017221777","spectrum_index":8118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 163.2391 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.301,"smiles":null,"spectrum_id":"CCMSLIB00017221780","spectrum_index":8119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 311.2813 Da; putative annotation: N/A; putative formula: C19H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.508,"smiles":null,"spectrum_id":"CCMSLIB00017221782","spectrum_index":8120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 254.0467 Da; putative annotation: N/A; putative formula: C11H15N2O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.138,"smiles":null,"spectrum_id":"CCMSLIB00017221783","spectrum_index":8121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 122.0727 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017221784","spectrum_index":8122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 181.1312 Da; putative annotation: N/A; putative formula: C8H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.363,"smiles":null,"spectrum_id":"CCMSLIB00017221788","spectrum_index":8123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 176.1417 Da; putative annotation: N/A; putative formula: C10H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.389,"smiles":null,"spectrum_id":"CCMSLIB00017221789","spectrum_index":8124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 330.2441 Da; putative annotation: N/A; putative formula: C17H35N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.471,"smiles":null,"spectrum_id":"CCMSLIB00017221790","spectrum_index":8125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxopimara-8(14),15-dien-20-oic acid (delta mass: 197.0919 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.303,"smiles":null,"spectrum_id":"CCMSLIB00017221792","spectrum_index":8126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 71.0369 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.207,"smiles":null,"spectrum_id":"CCMSLIB00017221795","spectrum_index":8127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 70.0777 Da; putative annotation: N/A; putative formula: C5H10)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017221796","spectrum_index":8128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 72.0361 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.159,"smiles":null,"spectrum_id":"CCMSLIB00017221797","spectrum_index":8129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-OxoOTrE from NIST14 (delta mass: 69.0423 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.253,"smiles":null,"spectrum_id":"CCMSLIB00017221799","spectrum_index":8130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 38.0157 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.076,"smiles":null,"spectrum_id":"CCMSLIB00017221802","spectrum_index":8131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bis(2-hydroxyethyl) phthalate (delta mass: 233.1265 Da; putative annotation: N/A; putative formula: C10H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.213,"smiles":null,"spectrum_id":"CCMSLIB00017221803","spectrum_index":8132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 122.1066 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.172,"smiles":null,"spectrum_id":"CCMSLIB00017221805","spectrum_index":8133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)piperazine (delta mass: 72.0506 Da; putative annotation: N/A; putative formula: C4H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.184,"smiles":null,"spectrum_id":"CCMSLIB00017221807","spectrum_index":8134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 284.2127 Da; putative annotation: N/A; putative formula: C20H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.336,"smiles":null,"spectrum_id":"CCMSLIB00017221809","spectrum_index":8135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 264.2449 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.326,"smiles":null,"spectrum_id":"CCMSLIB00017221810","spectrum_index":8136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 273.1945 Da; putative annotation: N/A; putative formula: C15H31NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.411,"smiles":null,"spectrum_id":"CCMSLIB00017221813","spectrum_index":8137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8Z,14Z-Eicosadienoic acid (delta mass: 64.0534 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.332,"smiles":null,"spectrum_id":"CCMSLIB00017221815","spectrum_index":8138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 329.2717 Da; putative annotation: N/A; putative formula: C22H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.374,"smiles":null,"spectrum_id":"CCMSLIB00017221816","spectrum_index":8139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 167.1161 Da; putative annotation: N/A; putative formula: C7H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.432,"smiles":null,"spectrum_id":"CCMSLIB00017221819","spectrum_index":8140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D2 1-glyceryl ester (delta mass: 72.036 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.305,"smiles":null,"spectrum_id":"CCMSLIB00017221820","spectrum_index":8141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 36.0 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.091,"smiles":null,"spectrum_id":"CCMSLIB00017221821","spectrum_index":8142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 44.0782 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017221824","spectrum_index":8143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 70.0781 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.159,"smiles":null,"spectrum_id":"CCMSLIB00017221826","spectrum_index":8144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:205060\"\" (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.154,"smiles":null,"spectrum_id":"CCMSLIB00017221827","spectrum_index":8145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 197.0909 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.276,"smiles":null,"spectrum_id":"CCMSLIB00017221830","spectrum_index":8146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 531.1601 Da; putative annotation: N/A; putative formula: C23H25N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.22,"smiles":null,"spectrum_id":"CCMSLIB00017221832","spectrum_index":8147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331602 Linoleic acid|(9Z,12Z)-octadeca-9,12-dienoic acid (delta mass: 550.5324 Da; putative annotation: N/A; putative formula: C36H70O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":831.78,"smiles":null,"spectrum_id":"CCMSLIB00017221833","spectrum_index":8148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 55.0141 Da; putative annotation: N/A; putative formula: CHN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.064,"smiles":null,"spectrum_id":"CCMSLIB00017221835","spectrum_index":8149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 163.0336 Da; putative annotation: N/A; putative formula: C4H10N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.094,"smiles":null,"spectrum_id":"CCMSLIB00017221838","spectrum_index":8150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 525.2837 Da; putative annotation: N/A; putative formula: C29H39N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1021.62,"smiles":null,"spectrum_id":"CCMSLIB00017221839","spectrum_index":8151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxyundecanoic acid (delta mass: 240.2461 Da; putative annotation: N/A; putative formula: C16H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.41,"smiles":null,"spectrum_id":"CCMSLIB00017221841","spectrum_index":8152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 40.0319 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.222,"smiles":null,"spectrum_id":"CCMSLIB00017221844","spectrum_index":8153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrophaseic acid (delta mass: 162.0524 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.206,"smiles":null,"spectrum_id":"CCMSLIB00017221845","spectrum_index":8154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Syringaldehyde (delta mass: 31.0215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.087,"smiles":null,"spectrum_id":"CCMSLIB00017221847","spectrum_index":8155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 35.9238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.14,"smiles":null,"spectrum_id":"CCMSLIB00017221850","spectrum_index":8156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 172.0481 Da; putative annotation: N/A; putative formula: C6H8N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.338,"smiles":null,"spectrum_id":"CCMSLIB00017221851","spectrum_index":8157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 69.0462 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.221,"smiles":null,"spectrum_id":"CCMSLIB00017221853","spectrum_index":8158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stercobilin (delta mass: 325.189 Da; putative annotation: N/A; putative formula: C17H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":920.538,"smiles":null,"spectrum_id":"CCMSLIB00017221856","spectrum_index":8159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130087 (delta mass: 18.0083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.179,"smiles":null,"spectrum_id":"CCMSLIB00017221858","spectrum_index":8160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Virginiaebutanolide C (delta mass: 76.0666 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.21,"smiles":null,"spectrum_id":"CCMSLIB00017221861","spectrum_index":8161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 380.4258 Da; putative annotation: N/A; putative formula: C24H52N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.503,"smiles":null,"spectrum_id":"CCMSLIB00017221862","spectrum_index":8162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of exo-Norborneol (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.111,"smiles":null,"spectrum_id":"CCMSLIB00017221864","spectrum_index":8163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 31.9978 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.115,"smiles":null,"spectrum_id":"CCMSLIB00017221865","spectrum_index":8164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 269.1941 Da; putative annotation: N/A; putative formula: C14H27N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.27,"smiles":null,"spectrum_id":"CCMSLIB00017221868","spectrum_index":8165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ornithine-C18:0 (delta mass: 18.0014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.359,"smiles":null,"spectrum_id":"CCMSLIB00017221870","spectrum_index":8166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 179.0943 Da; putative annotation: N/A; putative formula: C10H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.17,"smiles":null,"spectrum_id":"CCMSLIB00017221871","spectrum_index":8167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 131.0838 Da; putative annotation: N/A; putative formula: C8H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.134,"smiles":null,"spectrum_id":"CCMSLIB00017221874","spectrum_index":8168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 520.2223 Da; putative annotation: N/A; putative formula: C30H28N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.333,"smiles":null,"spectrum_id":"CCMSLIB00017221876","spectrum_index":8169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Tryptophan (delta mass: 73.0163 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.113,"smiles":null,"spectrum_id":"CCMSLIB00017221877","spectrum_index":8170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triisopropanolamine (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.244,"smiles":null,"spectrum_id":"CCMSLIB00017221879","spectrum_index":8171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 298.2646 Da; putative annotation: N/A; putative formula: C16H35N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.512,"smiles":null,"spectrum_id":"CCMSLIB00017221881","spectrum_index":8172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 90.0457 Da; putative annotation: N/A; putative formula: CH7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.111,"smiles":null,"spectrum_id":"CCMSLIB00017221883","spectrum_index":8173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 26.7724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.89,"smiles":null,"spectrum_id":"CCMSLIB00017221884","spectrum_index":8174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 45.0601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.11,"smiles":null,"spectrum_id":"CCMSLIB00017221885","spectrum_index":8175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 72.0359 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.247,"smiles":null,"spectrum_id":"CCMSLIB00017221889","spectrum_index":8176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Epiandrographolide (delta mass: 102.0835 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.3,"smiles":null,"spectrum_id":"CCMSLIB00017221892","spectrum_index":8177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA091603 Carbamazepine-10,11-epoxide|1a,10b-Dihydro-6H-dibenz(b,f)oxiren(d)azepine-6-carboxamide (delta mass: 17.094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.191,"smiles":null,"spectrum_id":"CCMSLIB00017221894","spectrum_index":8178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 36.0137 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.152,"smiles":null,"spectrum_id":"CCMSLIB00017221895","spectrum_index":8179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl morpholine-2-carboxylate (delta mass: 131.0586 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.155,"smiles":null,"spectrum_id":"CCMSLIB00017221897","spectrum_index":8180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid; AIF; CE0; MS2Dec (delta mass: 28.9983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.069,"smiles":null,"spectrum_id":"CCMSLIB00017221899","spectrum_index":8181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 96.0566 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.116,"smiles":null,"spectrum_id":"CCMSLIB00017221900","spectrum_index":8182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-6-ol, 1-(4-methoxyphenyl)-2-methyl-3-nitro- (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.129,"smiles":null,"spectrum_id":"CCMSLIB00017221901","spectrum_index":8183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 116.085 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.312,"smiles":null,"spectrum_id":"CCMSLIB00017221903","spectrum_index":8184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 196.0901 Da; putative annotation: N/A; putative formula: C14H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.166,"smiles":null,"spectrum_id":"CCMSLIB00017221906","spectrum_index":8185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 84.0943 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.337,"smiles":null,"spectrum_id":"CCMSLIB00017221907","spectrum_index":8186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 692.4756 Da; putative annotation: N/A; putative formula: C44H69O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":862.557,"smiles":null,"spectrum_id":"CCMSLIB00017221910","spectrum_index":8187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 107.0039 Da; putative annotation: N/A; putative formula: C2H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.075,"smiles":null,"spectrum_id":"CCMSLIB00017221911","spectrum_index":8188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 26.0158 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.258,"smiles":null,"spectrum_id":"CCMSLIB00017221912","spectrum_index":8189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Chloro-9H-carbazole (delta mass: 143.9816 Da; putative annotation: N/A; putative formula: C4H4N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.023,"smiles":null,"spectrum_id":"CCMSLIB00017221914","spectrum_index":8190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-L-phenylalanine (delta mass: 59.0377 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.114,"smiles":null,"spectrum_id":"CCMSLIB00017221916","spectrum_index":8191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 101.0845 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.208,"smiles":null,"spectrum_id":"CCMSLIB00017221918","spectrum_index":8192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 8.9891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.039,"smiles":null,"spectrum_id":"CCMSLIB00017221920","spectrum_index":8193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017221922","spectrum_index":8194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 164.0976 Da; putative annotation: N/A; putative formula: C14H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.267,"smiles":null,"spectrum_id":"CCMSLIB00017221925","spectrum_index":8195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,5R,9S,13R)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 193.0584 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.29,"smiles":null,"spectrum_id":"CCMSLIB00017221926","spectrum_index":8196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 553.3135 Da; putative annotation: N/A; putative formula: C43H39NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.613,"smiles":null,"spectrum_id":"CCMSLIB00017221928","spectrum_index":8197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 138.068 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017221930","spectrum_index":8198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 187.2721 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.384,"smiles":null,"spectrum_id":"CCMSLIB00017221931","spectrum_index":8199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 46.0428 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.285,"smiles":null,"spectrum_id":"CCMSLIB00017221933","spectrum_index":8200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 150.0517 Da; putative annotation: N/A; putative formula: C2H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.127,"smiles":null,"spectrum_id":"CCMSLIB00017221935","spectrum_index":8201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amoxicillin (delta mass: 16.0381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.15,"smiles":null,"spectrum_id":"CCMSLIB00017221938","spectrum_index":8202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 116.098 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.34,"smiles":null,"spectrum_id":"CCMSLIB00017221939","spectrum_index":8203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(N-Methylacetamido)benzoic acid (delta mass: 15.9983 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.079,"smiles":null,"spectrum_id":"CCMSLIB00017221940","spectrum_index":8204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 15.0112 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.093,"smiles":null,"spectrum_id":"CCMSLIB00017221942","spectrum_index":8205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 33.0845 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.15,"smiles":null,"spectrum_id":"CCMSLIB00017221945","spectrum_index":8206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terephthalic acid (delta mass: 14.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.071,"smiles":null,"spectrum_id":"CCMSLIB00017221946","spectrum_index":8207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 33.0831 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.118,"smiles":null,"spectrum_id":"CCMSLIB00017221948","spectrum_index":8208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-2-carboxylic acid (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.06,"smiles":null,"spectrum_id":"CCMSLIB00017221951","spectrum_index":8209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEPROPIONIC ACID (delta mass: 306.1229 Da; putative annotation: N/A; putative formula: C16H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.209,"smiles":null,"spectrum_id":"CCMSLIB00017221952","spectrum_index":8210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 391.1852 Da; putative annotation: N/A; putative formula: C18H33NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.245,"smiles":null,"spectrum_id":"CCMSLIB00017221953","spectrum_index":8211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 340.116 Da; putative annotation: N/A; putative formula: C16H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.197,"smiles":null,"spectrum_id":"CCMSLIB00017221956","spectrum_index":8212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 45.0356 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.174,"smiles":null,"spectrum_id":"CCMSLIB00017221958","spectrum_index":8213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Benz[g]indole-2-carboxylic acid (delta mass: 105.0348 Da; putative annotation: N/A; putative formula: C3H8NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.105,"smiles":null,"spectrum_id":"CCMSLIB00017221959","spectrum_index":8214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 177.0673 Da; putative annotation: N/A; putative formula: C12H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.179,"smiles":null,"spectrum_id":"CCMSLIB00017221962","spectrum_index":8215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 99.9248 Da; putative annotation: N/A; putative formula: C2H-2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.974,"smiles":null,"spectrum_id":"CCMSLIB00017221963","spectrum_index":8216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 76.0673 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017221964","spectrum_index":8217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 353.2319 Da; putative annotation: N/A; putative formula: C18H31N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.323,"smiles":null,"spectrum_id":"CCMSLIB00017221967","spectrum_index":8218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Val (delta mass: 229.0952 Da; putative annotation: N/A; putative formula: C10H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.266,"smiles":null,"spectrum_id":"CCMSLIB00017221969","spectrum_index":8219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 89.9939 Da; putative annotation: N/A; putative formula: C6H2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.076,"smiles":null,"spectrum_id":"CCMSLIB00017221970","spectrum_index":8220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-hexadec-7-enoylhomoserine (delta mass: 180.0644 Da; putative annotation: N/A; putative formula: C7H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.344,"smiles":null,"spectrum_id":"CCMSLIB00017221972","spectrum_index":8221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU406506 3,6,9,12-Tetraoxatetracosan-1-ol|Tetraethylene glycol monododecyl ether|2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethanol (delta mass: 132.0775 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.388,"smiles":null,"spectrum_id":"CCMSLIB00017221974","spectrum_index":8222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 338.086 Da; putative annotation: N/A; putative formula: C23H15OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":841.423,"smiles":null,"spectrum_id":"CCMSLIB00017221975","spectrum_index":8223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 60.0252 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017221976","spectrum_index":8224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 119.1 Da; putative annotation: N/A; putative formula: H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.135,"smiles":null,"spectrum_id":"CCMSLIB00017221980","spectrum_index":8225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 27.0908 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.139,"smiles":null,"spectrum_id":"CCMSLIB00017221981","spectrum_index":8226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 48.008 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.1,"smiles":null,"spectrum_id":"CCMSLIB00017221982","spectrum_index":8227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 32.062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017221983","spectrum_index":8228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 246.122 Da; putative annotation: N/A; putative formula: C12H25O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.24,"smiles":null,"spectrum_id":"CCMSLIB00017221987","spectrum_index":8229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 268.0813 Da; putative annotation: N/A; putative formula: C11H16N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.177,"smiles":null,"spectrum_id":"CCMSLIB00017221988","spectrum_index":8230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 325.2089 Da; putative annotation: N/A; putative formula: C18H31NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.342,"smiles":null,"spectrum_id":"CCMSLIB00017221989","spectrum_index":8231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 683.4085 Da; putative annotation: N/A; putative formula: C45H53N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.448,"smiles":null,"spectrum_id":"CCMSLIB00017221992","spectrum_index":8232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 59.0388 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.406,"smiles":null,"spectrum_id":"CCMSLIB00017221994","spectrum_index":8233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 53.9767 Da; putative annotation: N/A; putative formula: CH-1N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.224,"smiles":null,"spectrum_id":"CCMSLIB00017221995","spectrum_index":8234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-7,12-Dihydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 72.0358 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.242,"smiles":null,"spectrum_id":"CCMSLIB00017221998","spectrum_index":8235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 126.1638 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.242,"smiles":null,"spectrum_id":"CCMSLIB00017222000","spectrum_index":8236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 131.049 Da; putative annotation: N/A; putative formula: C7H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.136,"smiles":null,"spectrum_id":"CCMSLIB00017222001","spectrum_index":8237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxybenzoic acid (delta mass: 69.021 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.055,"smiles":null,"spectrum_id":"CCMSLIB00017222004","spectrum_index":8238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 140.0471 Da; putative annotation: N/A; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.144,"smiles":null,"spectrum_id":"CCMSLIB00017222005","spectrum_index":8239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9E)-11a-Hydroxy-3,6,10-trimethyl-6,7,8,11-tetrahydro-4H-cyclodeca[b]furan-2,5-dione (delta mass: 14.0152 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017222006","spectrum_index":8240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 136.0886 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.3,"smiles":null,"spectrum_id":"CCMSLIB00017222008","spectrum_index":8241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 1179.7616 Da; putative annotation: N/A; putative formula: C73H97N9O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1855.01,"smiles":null,"spectrum_id":"CCMSLIB00017222010","spectrum_index":8242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 35.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.405,"smiles":null,"spectrum_id":"CCMSLIB00017222012","spectrum_index":8243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 118.0433 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.167,"smiles":null,"spectrum_id":"CCMSLIB00017222014","spectrum_index":8244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 126.089 Da; putative annotation: N/A; putative formula: C5H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.316,"smiles":null,"spectrum_id":"CCMSLIB00017222015","spectrum_index":8245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 156.0937 Da; putative annotation: N/A; putative formula: C12H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017222019","spectrum_index":8246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 212.9257 Da; putative annotation: N/A; putative formula: C2H4N3OPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.232,"smiles":null,"spectrum_id":"CCMSLIB00017222020","spectrum_index":8247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 70.071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.21,"smiles":null,"spectrum_id":"CCMSLIB00017222022","spectrum_index":8248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 62.0919 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.178,"smiles":null,"spectrum_id":"CCMSLIB00017222025","spectrum_index":8249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 87.03 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.132,"smiles":null,"spectrum_id":"CCMSLIB00017222027","spectrum_index":8250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 262.1639 Da; putative annotation: N/A; putative formula: C10H22N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.244,"smiles":null,"spectrum_id":"CCMSLIB00017222028","spectrum_index":8251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-His (delta mass: 185.0685 Da; putative annotation: N/A; putative formula: C8H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.198,"smiles":null,"spectrum_id":"CCMSLIB00017222029","spectrum_index":8252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 92.0461 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.294,"smiles":null,"spectrum_id":"CCMSLIB00017222032","spectrum_index":8253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14(15)-Epoxy-5Z,8Z,11Z,17Z-eicosatetraenoic acid (delta mass: 66.0464 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.273,"smiles":null,"spectrum_id":"CCMSLIB00017222033","spectrum_index":8254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Benzyl-1H-indol-5-ylamine (delta mass: 72.04 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.163,"smiles":null,"spectrum_id":"CCMSLIB00017222034","spectrum_index":8255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 234.2715 Da; putative annotation: N/A; putative formula: C18H34O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.353,"smiles":null,"spectrum_id":"CCMSLIB00017222036","spectrum_index":8256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 350.0053 Da; putative annotation: N/A; putative formula: C8H6N12O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.253,"smiles":null,"spectrum_id":"CCMSLIB00017222039","spectrum_index":8257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 176.155 Da; putative annotation: N/A; putative formula: C13H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.251,"smiles":null,"spectrum_id":"CCMSLIB00017222040","spectrum_index":8258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Azelaic acid from NIST14 (delta mass: 130.0621 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.174,"smiles":null,"spectrum_id":"CCMSLIB00017222041","spectrum_index":8259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 132.0748 Da; putative annotation: N/A; putative formula: C2H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.134,"smiles":null,"spectrum_id":"CCMSLIB00017222043","spectrum_index":8260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 40.9433 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017222046","spectrum_index":8261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 102.0105 Da; putative annotation: N/A; putative formula: C7H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.071,"smiles":null,"spectrum_id":"CCMSLIB00017222047","spectrum_index":8262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 186.0528 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.124,"smiles":null,"spectrum_id":"CCMSLIB00017222048","spectrum_index":8263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.055,"smiles":null,"spectrum_id":"CCMSLIB00017222052","spectrum_index":8264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 309.2872 Da; putative annotation: N/A; putative formula: C20H39NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.326,"smiles":null,"spectrum_id":"CCMSLIB00017222053","spectrum_index":8265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 101.0746 Da; putative annotation: N/A; putative formula: C5H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.203,"smiles":null,"spectrum_id":"CCMSLIB00017222054","spectrum_index":8266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 112.0161 Da; putative annotation: N/A; putative formula: C5H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.129,"smiles":null,"spectrum_id":"CCMSLIB00017222056","spectrum_index":8267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 25.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.092,"smiles":null,"spectrum_id":"CCMSLIB00017222059","spectrum_index":8268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-oxopentadecanoic acid CollisionEnergy:205060 (delta mass: 28.0317 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.243,"smiles":null,"spectrum_id":"CCMSLIB00017222060","spectrum_index":8269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,9-Dihydroxy-6-methyl-3,10-dimethylidene-4,7,8,9,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one (delta mass: 162.0534 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.197,"smiles":null,"spectrum_id":"CCMSLIB00017222062","spectrum_index":8270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 102.0876 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.33,"smiles":null,"spectrum_id":"CCMSLIB00017222065","spectrum_index":8271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 83.0934 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.175,"smiles":null,"spectrum_id":"CCMSLIB00017222066","spectrum_index":8272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 1058.5294 Da; putative annotation: N/A; putative formula: C52H82O22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1239.6,"smiles":null,"spectrum_id":"CCMSLIB00017222067","spectrum_index":8273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amoxicillin (delta mass: 45.0271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.139,"smiles":null,"spectrum_id":"CCMSLIB00017222070","spectrum_index":8274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(9H-Carbazol-9-yl)-3-(4-chlorophenoxy)-2-propanol (delta mass: 327.1128 Da; putative annotation: N/A; putative formula: C19H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.223,"smiles":null,"spectrum_id":"CCMSLIB00017222072","spectrum_index":8275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Epoxy-5Z,8Z,11Z-eicosatrienoic acid (delta mass: 32.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.269,"smiles":null,"spectrum_id":"CCMSLIB00017222073","spectrum_index":8276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-17-ol-3,20-dione (delta mass: 102.0862 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.329,"smiles":null,"spectrum_id":"CCMSLIB00017222075","spectrum_index":8277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 155.0422 Da; putative annotation: N/A; putative formula: C7H11NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.129,"smiles":null,"spectrum_id":"CCMSLIB00017222078","spectrum_index":8278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 23.1196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.306,"smiles":null,"spectrum_id":"CCMSLIB00017222079","spectrum_index":8279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatol (delta mass: 194.0431 Da; putative annotation: N/A; putative formula: C9H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.124,"smiles":null,"spectrum_id":"CCMSLIB00017222081","spectrum_index":8280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 206.1069 Da; putative annotation: N/A; putative formula: C9H19O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.177,"smiles":null,"spectrum_id":"CCMSLIB00017222083","spectrum_index":8281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholestenoic acid (delta mass: 32.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.362,"smiles":null,"spectrum_id":"CCMSLIB00017222085","spectrum_index":8282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 178.0631 Da; putative annotation: N/A; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017222087","spectrum_index":8283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 185.1065 Da; putative annotation: N/A; putative formula: C10H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.266,"smiles":null,"spectrum_id":"CCMSLIB00017222089","spectrum_index":8284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 161.1416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.254,"smiles":null,"spectrum_id":"CCMSLIB00017222091","spectrum_index":8285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-linoleoyl-rac-glycerol (delta mass: 279.2485 Da; putative annotation: N/A; putative formula: C18H34NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.778,"smiles":null,"spectrum_id":"CCMSLIB00017222093","spectrum_index":8286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,3-Difluoroazetidin-1-yl)piperidine (delta mass: 41.993 Da; putative annotation: N/A; putative formula: C2H2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017222095","spectrum_index":8287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 320.9602 Da; putative annotation: N/A; putative formula: C6H7N7OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.015,"smiles":null,"spectrum_id":"CCMSLIB00017222096","spectrum_index":8288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 18.017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.124,"smiles":null,"spectrum_id":"CCMSLIB00017222099","spectrum_index":8289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(Leu-Pro) (delta mass: 41.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.196,"smiles":null,"spectrum_id":"CCMSLIB00017222101","spectrum_index":8290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 449.3073 Da; putative annotation: N/A; putative formula: C17H39N9O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.342,"smiles":null,"spectrum_id":"CCMSLIB00017222103","spectrum_index":8291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 37.0311 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017222105","spectrum_index":8292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.108,"smiles":null,"spectrum_id":"CCMSLIB00017222107","spectrum_index":8293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 87.1818 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.279,"smiles":null,"spectrum_id":"CCMSLIB00017222108","spectrum_index":8294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Val (delta mass: 85.054 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.224,"smiles":null,"spectrum_id":"CCMSLIB00017222109","spectrum_index":8295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 280.1312 Da; putative annotation: N/A; putative formula: C15H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.179,"smiles":null,"spectrum_id":"CCMSLIB00017222112","spectrum_index":8296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 22.0157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.988,"smiles":null,"spectrum_id":"CCMSLIB00017222114","spectrum_index":8297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 233.1265 Da; putative annotation: N/A; putative formula: C10H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.374,"smiles":null,"spectrum_id":"CCMSLIB00017222115","spectrum_index":8298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 92.0473 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.305,"smiles":null,"spectrum_id":"CCMSLIB00017222118","spectrum_index":8299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 214.1183 Da; putative annotation: N/A; putative formula: C15H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.215,"smiles":null,"spectrum_id":"CCMSLIB00017222120","spectrum_index":8300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 74.0732 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.154,"smiles":null,"spectrum_id":"CCMSLIB00017222121","spectrum_index":8301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 299.9269 Da; putative annotation: N/A; putative formula: C8H4N4OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.211,"smiles":null,"spectrum_id":"CCMSLIB00017222123","spectrum_index":8302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 505.2264 Da; putative annotation: N/A; putative formula: C23H40NO7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.298,"smiles":null,"spectrum_id":"CCMSLIB00017222126","spectrum_index":8303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 347.3023 Da; putative annotation: N/A; putative formula: C23H41NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.529,"smiles":null,"spectrum_id":"CCMSLIB00017222127","spectrum_index":8304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 52.0678 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.31,"smiles":null,"spectrum_id":"CCMSLIB00017222128","spectrum_index":8305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.4]nonane-2,4-dione (delta mass: 51.0207 Da; putative annotation: N/A; putative formula: C2HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017222131","spectrum_index":8306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 74.0522 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.295,"smiles":null,"spectrum_id":"CCMSLIB00017222133","spectrum_index":8307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 690.2883 Da; putative annotation: N/A; putative formula: C33H42N10O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1047.59,"smiles":null,"spectrum_id":"CCMSLIB00017222134","spectrum_index":8308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 451.27 Da; putative annotation: N/A; putative formula: C21H42NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.46,"smiles":null,"spectrum_id":"CCMSLIB00017222136","spectrum_index":8309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloropurine riboside (delta mass: 146.0591 Da; putative annotation: N/A; putative formula: C7H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.113,"smiles":null,"spectrum_id":"CCMSLIB00017222139","spectrum_index":8310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-trans-Chrysanthemic acid (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.149,"smiles":null,"spectrum_id":"CCMSLIB00017222140","spectrum_index":8311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2R,5R,6R,10R,13S,15S)-5-[(2R,3E,5R)-5,6-dimethylhept-3-en-2-yl]-6,10-dimethyl-16,17-dioxapentacyclo[13.2.2.0,?.0,?.0?,?]nonadec-18-en-13-ol (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.342,"smiles":null,"spectrum_id":"CCMSLIB00017222142","spectrum_index":8312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 67.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.28,"smiles":null,"spectrum_id":"CCMSLIB00017222145","spectrum_index":8313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381307-01!1-[2,4-dihydroxy-3-(2-hydroxyethyl)-6-methoxyphenyl]butan-1-one (delta mass: 45.0211 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.144,"smiles":null,"spectrum_id":"CCMSLIB00017222146","spectrum_index":8314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin A (delta mass: 110.0551 Da; putative annotation: N/A; putative formula: C7H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.23,"smiles":null,"spectrum_id":"CCMSLIB00017222148","spectrum_index":8315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine 4-.beta.-D-glucuronide (delta mass: 132.0472 Da; putative annotation: N/A; putative formula: C3H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.165,"smiles":null,"spectrum_id":"CCMSLIB00017222150","spectrum_index":8316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 372.1607 Da; putative annotation: N/A; putative formula: C18H28O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":839.369,"smiles":null,"spectrum_id":"CCMSLIB00017222151","spectrum_index":8317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Thiophen-2-yl)piperazin-2-one (delta mass: 16.0337 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.092,"smiles":null,"spectrum_id":"CCMSLIB00017222154","spectrum_index":8318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.299,"smiles":null,"spectrum_id":"CCMSLIB00017222156","spectrum_index":8319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 176.0471 Da; putative annotation: N/A; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.097,"smiles":null,"spectrum_id":"CCMSLIB00017222157","spectrum_index":8320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 135.0695 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.229,"smiles":null,"spectrum_id":"CCMSLIB00017222159","spectrum_index":8321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 180.0536 Da; putative annotation: N/A; putative formula: C8H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.192,"smiles":null,"spectrum_id":"CCMSLIB00017222162","spectrum_index":8322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 503.1853 Da; putative annotation: N/A; putative formula: C24H25N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1170.41,"smiles":null,"spectrum_id":"CCMSLIB00017222163","spectrum_index":8323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclopamine (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.342,"smiles":null,"spectrum_id":"CCMSLIB00017222165","spectrum_index":8324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 403.3462 Da; putative annotation: N/A; putative formula: C26H45NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.599,"smiles":null,"spectrum_id":"CCMSLIB00017222166","spectrum_index":8325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 128.062 Da; putative annotation: N/A; putative formula: C4H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.105,"smiles":null,"spectrum_id":"CCMSLIB00017222170","spectrum_index":8326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 202.0449 Da; putative annotation: N/A; putative formula: C4H6N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.131,"smiles":null,"spectrum_id":"CCMSLIB00017222171","spectrum_index":8327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurenoic acid (delta mass: 50.0512 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.283,"smiles":null,"spectrum_id":"CCMSLIB00017222172","spectrum_index":8328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Limaprost (delta mass: 48.0358 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.299,"smiles":null,"spectrum_id":"CCMSLIB00017222175","spectrum_index":8329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thymol (delta mass: 64.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.165,"smiles":null,"spectrum_id":"CCMSLIB00017222177","spectrum_index":8330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z-octadecadienoic acid (delta mass: 66.0432 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.27,"smiles":null,"spectrum_id":"CCMSLIB00017222178","spectrum_index":8331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 61.9999 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.154,"smiles":null,"spectrum_id":"CCMSLIB00017222180","spectrum_index":8332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 172.0736 Da; putative annotation: N/A; putative formula: C8H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.139,"smiles":null,"spectrum_id":"CCMSLIB00017222183","spectrum_index":8333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ332502 Epinephrine|4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.108,"smiles":null,"spectrum_id":"CCMSLIB00017222184","spectrum_index":8334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 303.2421 Da; putative annotation: N/A; putative formula: C17H29N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.355,"smiles":null,"spectrum_id":"CCMSLIB00017222185","spectrum_index":8335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 137.0789 Da; putative annotation: N/A; putative formula: C4H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.192,"smiles":null,"spectrum_id":"CCMSLIB00017222188","spectrum_index":8336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 131.0581 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.129,"smiles":null,"spectrum_id":"CCMSLIB00017222190","spectrum_index":8337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.alpha.-Hydroxystanozolol (delta mass: 114.093 Da; putative annotation: N/A; putative formula: C4H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.347,"smiles":null,"spectrum_id":"CCMSLIB00017222191","spectrum_index":8338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine; LC-tDDA; CE10 (delta mass: 394.2139 Da; putative annotation: N/A; putative formula: C17H34N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.31,"smiles":null,"spectrum_id":"CCMSLIB00017222193","spectrum_index":8339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 78.0218 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.082,"smiles":null,"spectrum_id":"CCMSLIB00017222196","spectrum_index":8340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 414.2031 Da; putative annotation: N/A; putative formula: C18H31N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.543,"smiles":null,"spectrum_id":"CCMSLIB00017222197","spectrum_index":8341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 14.9995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.055,"smiles":null,"spectrum_id":"CCMSLIB00017222198","spectrum_index":8342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ricinoleic acid methyl ester (delta mass: 128.0997 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.373,"smiles":null,"spectrum_id":"CCMSLIB00017222202","spectrum_index":8343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 162.0527 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.217,"smiles":null,"spectrum_id":"CCMSLIB00017222203","spectrum_index":8344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 507.3201 Da; putative annotation: N/A; putative formula: C31H46N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.562,"smiles":null,"spectrum_id":"CCMSLIB00017222204","spectrum_index":8345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 149.0693 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.135,"smiles":null,"spectrum_id":"CCMSLIB00017222206","spectrum_index":8346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethyl-4-pentenoic acid (delta mass: 138.0679 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.159,"smiles":null,"spectrum_id":"CCMSLIB00017222209","spectrum_index":8347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.263,"smiles":null,"spectrum_id":"CCMSLIB00017222210","spectrum_index":8348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 34.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.093,"smiles":null,"spectrum_id":"CCMSLIB00017222212","spectrum_index":8349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 241.1218 Da; putative annotation: N/A; putative formula: C14H15N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.187,"smiles":null,"spectrum_id":"CCMSLIB00017222214","spectrum_index":8350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 45.0288 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.089,"smiles":null,"spectrum_id":"CCMSLIB00017222216","spectrum_index":8351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 128.0857 Da; putative annotation: N/A; putative formula: C6H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.151,"smiles":null,"spectrum_id":"CCMSLIB00017222218","spectrum_index":8352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 249.2299 Da; putative annotation: N/A; putative formula: C14H27N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.311,"smiles":null,"spectrum_id":"CCMSLIB00017222220","spectrum_index":8353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 32.005 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.216,"smiles":null,"spectrum_id":"CCMSLIB00017222222","spectrum_index":8354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 15.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.091,"smiles":null,"spectrum_id":"CCMSLIB00017222224","spectrum_index":8355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1aR,2Z,4aR,6S,7S,7aR,8S,9R,11aS)-4a,7,8-Trihydroxy-1,1,3,6-tetramethyl-1a,4a,5,6,7,7a,8,10,11,11a-decahydrospiro[cyclopenta[a]cyclopropa[f][11]annulene-9,2'-oxiran]-4(1H)-one (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.243,"smiles":null,"spectrum_id":"CCMSLIB00017222226","spectrum_index":8356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 89.0109 Da; putative annotation: N/A; putative formula: C2H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.071,"smiles":null,"spectrum_id":"CCMSLIB00017222227","spectrum_index":8357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palitantin (delta mass: 132.0571 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.216,"smiles":null,"spectrum_id":"CCMSLIB00017222229","spectrum_index":8358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 107.0226 Da; putative annotation: N/A; putative formula: C3HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.244,"smiles":null,"spectrum_id":"CCMSLIB00017222231","spectrum_index":8359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 262.2723 Da; putative annotation: N/A; putative formula: C18H34N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.353,"smiles":null,"spectrum_id":"CCMSLIB00017222233","spectrum_index":8360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 618.4101 Da; putative annotation: N/A; putative formula: C32H62N2O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":811.481,"smiles":null,"spectrum_id":"CCMSLIB00017222235","spectrum_index":8361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 114.0827 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.33,"smiles":null,"spectrum_id":"CCMSLIB00017222237","spectrum_index":8362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 82.0755 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.334,"smiles":null,"spectrum_id":"CCMSLIB00017222239","spectrum_index":8363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxybenzoic acid (delta mass: 16.0307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017222241","spectrum_index":8364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Val (delta mass: 99.0682 Da; putative annotation: L-Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.186,"smiles":null,"spectrum_id":"CCMSLIB00017222243","spectrum_index":8365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 278.2247 Da; putative annotation: 9(10)-Epoxy-12Z-octadecenoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.451,"smiles":null,"spectrum_id":"CCMSLIB00017222244","spectrum_index":8366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 128.059 Da; putative annotation: L-Glutamine; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.203,"smiles":null,"spectrum_id":"CCMSLIB00017222247","spectrum_index":8367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [(2R,3S,4S,5R,6R)-6-[1,7-bis(4-hydroxyphenyl)-5-oxoheptan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate (delta mass: 268.078 Da; putative annotation: 4',5-Dihydroxy-7-methoxyflavanone; putative formula: C16H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":891.327,"smiles":null,"spectrum_id":"CCMSLIB00017222249","spectrum_index":8368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-C8:0 (delta mass: 173.0494 Da; putative annotation: Acetyl-L-methionine - 30.0 eV; putative formula: C7H11NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.251,"smiles":null,"spectrum_id":"CCMSLIB00017222250","spectrum_index":8369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 145.0539 Da; putative annotation: (2S)indoline-2-carboxylic acid CollisionEnergy:102040; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.114,"smiles":null,"spectrum_id":"CCMSLIB00017222253","spectrum_index":8370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 296.2714 Da; putative annotation: Methyl 12-hydroxystearate; putative formula: C19H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.308,"smiles":null,"spectrum_id":"CCMSLIB00017222255","spectrum_index":8371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 926.4906 Da; putative annotation: 3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E,6R)-6-[(1R,3R,6S,8R,12S,15R,16R)-13,17-dihydroxy-7,7,12,16-tetramethyl-6-{[(2R)-3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl]oxy}pentacyclo[9.7.0.0,.0,?.0,?]octadecan-15-yl]-2-methylhept-2-enoate; putative formula: C47H74O18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1107.56,"smiles":null,"spectrum_id":"CCMSLIB00017222256","spectrum_index":8372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of D-(+)-Arabitol (delta mass: 146.0579 Da; putative annotation: \"\"1,5-ANHYDRO-GLUCITOL\"\"; putative formula: C6H10O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.134,"smiles":null,"spectrum_id":"CCMSLIB00017222258","spectrum_index":8373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltopentaose from NIST14 (delta mass: 162.0524 Da; putative annotation: D-(+)-Mannose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":991.334,"smiles":null,"spectrum_id":"CCMSLIB00017222261","spectrum_index":8374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 297.1767 Da; putative annotation: N-[2-(3,4-Dihydroxyphenyl)ethyl]-1-adamantanecarboxamide; putative formula: C19H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.252,"smiles":null,"spectrum_id":"CCMSLIB00017222263","spectrum_index":8375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 124.0899 Da; putative annotation: 3-Methyl-1-cyclohexanecarboxylic acid; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.312,"smiles":null,"spectrum_id":"CCMSLIB00017222264","spectrum_index":8376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 132.0941 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017222266","spectrum_index":8377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 269.0487 Da; putative annotation: 1-[(4-Fluorophenyl)sulfonyl]piperidine-4-carboxylic acid; putative formula: C12H12FNO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.14,"smiles":null,"spectrum_id":"CCMSLIB00017222269","spectrum_index":8378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 465.2867 Da; putative annotation: (((3a)-3-hydroxy-24-oxocholan-24-yl)amino)ethanesulfonic acid; putative formula: C26H43NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.477,"smiles":null,"spectrum_id":"CCMSLIB00017222270","spectrum_index":8379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethylselegiline (delta mass: 101.0471 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.175,"smiles":null,"spectrum_id":"CCMSLIB00017222271","spectrum_index":8380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 60.0362 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.2,"smiles":null,"spectrum_id":"CCMSLIB00017222274","spectrum_index":8381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 273.2654 Da; putative annotation: N/A; putative formula: C12H31N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.633,"smiles":null,"spectrum_id":"CCMSLIB00017222276","spectrum_index":8382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 80.0627 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.102,"smiles":null,"spectrum_id":"CCMSLIB00017222277","spectrum_index":8383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.alpha.,17.alpha.-triol (delta mass: 88.0676 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.294,"smiles":null,"spectrum_id":"CCMSLIB00017222278","spectrum_index":8384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetraethylene glycol monomethyl ether (delta mass: 58.042 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.18,"smiles":null,"spectrum_id":"CCMSLIB00017222282","spectrum_index":8385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 53.0634 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.165,"smiles":null,"spectrum_id":"CCMSLIB00017222283","spectrum_index":8386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 167.1672 Da; putative annotation: N/A; putative formula: C11H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.352,"smiles":null,"spectrum_id":"CCMSLIB00017222284","spectrum_index":8387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 15.0183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.24,"smiles":null,"spectrum_id":"CCMSLIB00017222287","spectrum_index":8388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Altenuene (delta mass: 56.0989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.201,"smiles":null,"spectrum_id":"CCMSLIB00017222289","spectrum_index":8389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 152.062 Da; putative annotation: N/A; putative formula: C6H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.185,"smiles":null,"spectrum_id":"CCMSLIB00017222290","spectrum_index":8390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 67.99 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.05,"smiles":null,"spectrum_id":"CCMSLIB00017222291","spectrum_index":8391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 9.9846 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":125.06,"smiles":null,"spectrum_id":"CCMSLIB00017222295","spectrum_index":8392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.122,"smiles":null,"spectrum_id":"CCMSLIB00017222296","spectrum_index":8393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 59.0003 Da; putative annotation: N/A; putative formula: CHNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.087,"smiles":null,"spectrum_id":"CCMSLIB00017222297","spectrum_index":8394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.108,"smiles":null,"spectrum_id":"CCMSLIB00017222299","spectrum_index":8395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 26.9826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.054,"smiles":null,"spectrum_id":"CCMSLIB00017222302","spectrum_index":8396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 248.1565 Da; putative annotation: N/A; putative formula: C19H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.399,"smiles":null,"spectrum_id":"CCMSLIB00017222303","spectrum_index":8397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 133.0814 Da; putative annotation: N/A; putative formula: C3H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.143,"smiles":null,"spectrum_id":"CCMSLIB00017222304","spectrum_index":8398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 401.2782 Da; putative annotation: N/A; putative formula: C22H43NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.349,"smiles":null,"spectrum_id":"CCMSLIB00017222306","spectrum_index":8399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 313.2894 Da; putative annotation: N/A; putative formula: C19H40NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.326,"smiles":null,"spectrum_id":"CCMSLIB00017222309","spectrum_index":8400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4aR,5S)-9-Hydroxy-3,4a,5-trimethyl-4,5,6,7,8,8a,9,9a-octahydrobenzo[f][1]benzofuran-2-one (delta mass: 40.0312 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017222310","spectrum_index":8401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 298.0841 Da; putative annotation: N/A; putative formula: C17H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.149,"smiles":null,"spectrum_id":"CCMSLIB00017222313","spectrum_index":8402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-methoxyellipticine (delta mass: 42.0165 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.15,"smiles":null,"spectrum_id":"CCMSLIB00017222314","spectrum_index":8403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-CARBOXYBENZALDEHYDE (delta mass: 202.0113 Da; putative annotation: N/A; putative formula: C7H6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.05,"smiles":null,"spectrum_id":"CCMSLIB00017222315","spectrum_index":8404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.092,"smiles":null,"spectrum_id":"CCMSLIB00017222317","spectrum_index":8405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 320.1989 Da; putative annotation: N/A; putative formula: C19H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.41,"smiles":null,"spectrum_id":"CCMSLIB00017222320","spectrum_index":8406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 131.0038 Da; putative annotation: N/A; putative formula: C6H2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.07,"smiles":null,"spectrum_id":"CCMSLIB00017222322","spectrum_index":8407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 77.9208 Da; putative annotation: N/A; putative formula: H-2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.064,"smiles":null,"spectrum_id":"CCMSLIB00017222323","spectrum_index":8408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(3H)-Furanone, dihydro-3-(1-hydroxyhexyl)-4-(hydroxymethyl)- (delta mass: 36.0369 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.18,"smiles":null,"spectrum_id":"CCMSLIB00017222324","spectrum_index":8409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-Hydroxy-6'-methoxyacetophenone (delta mass: 168.1493 Da; putative annotation: N/A; putative formula: C7H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.22,"smiles":null,"spectrum_id":"CCMSLIB00017222327","spectrum_index":8410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 344.1281 Da; putative annotation: N/A; putative formula: C20H26O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.188,"smiles":null,"spectrum_id":"CCMSLIB00017222329","spectrum_index":8411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 77.0843 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.306,"smiles":null,"spectrum_id":"CCMSLIB00017222330","spectrum_index":8412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrotachysterol (delta mass: 68.0622 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.424,"smiles":null,"spectrum_id":"CCMSLIB00017222331","spectrum_index":8413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 108.0939 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.305,"smiles":null,"spectrum_id":"CCMSLIB00017222335","spectrum_index":8414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 48.0361 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.289,"smiles":null,"spectrum_id":"CCMSLIB00017222336","spectrum_index":8415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Hydroxydodecanoic acid CollisionEnergy:102040 (delta mass: 204.2243 Da; putative annotation: N/A; putative formula: C16H28O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.404,"smiles":null,"spectrum_id":"CCMSLIB00017222337","spectrum_index":8416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 113.0299 Da; putative annotation: N/A; putative formula: C5H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.116,"smiles":null,"spectrum_id":"CCMSLIB00017222339","spectrum_index":8417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 357.254 Da; putative annotation: N/A; putative formula: C18H36N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.528,"smiles":null,"spectrum_id":"CCMSLIB00017222341","spectrum_index":8418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 153.0789 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.175,"smiles":null,"spectrum_id":"CCMSLIB00017222342","spectrum_index":8419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,6-DIMETHOXYBENZOIC ACID CollisionEnergy:102040\"\" (delta mass: 13.0316 Da; putative annotation: N/A; putative formula: CH3NO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017222344","spectrum_index":8420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 61.9315 Da; putative annotation: N/A; putative formula: H-2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.007,"smiles":null,"spectrum_id":"CCMSLIB00017222347","spectrum_index":8421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 792.2478 Da; putative annotation: N/A; putative formula: C37H44O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1135.37,"smiles":null,"spectrum_id":"CCMSLIB00017222348","spectrum_index":8422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 48.0367 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.253,"smiles":null,"spectrum_id":"CCMSLIB00017222349","spectrum_index":8423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzenemethanol (delta mass: 174.079 Da; putative annotation: N/A; putative formula: C10H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.159,"smiles":null,"spectrum_id":"CCMSLIB00017222352","spectrum_index":8424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[4-(Benzyloxy)phenyl]ethanol (delta mass: 76.031 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.153,"smiles":null,"spectrum_id":"CCMSLIB00017222354","spectrum_index":8425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 211.149 Da; putative annotation: N/A; putative formula: C12H22NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.287,"smiles":null,"spectrum_id":"CCMSLIB00017222355","spectrum_index":8426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 571.12 Da; putative annotation: N/A; putative formula: C25H17N9O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.373,"smiles":null,"spectrum_id":"CCMSLIB00017222356","spectrum_index":8427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,16-Dimethylprostaglandin E1 (delta mass: 76.0673 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.346,"smiles":null,"spectrum_id":"CCMSLIB00017222359","spectrum_index":8428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 109.0478 Da; putative annotation: N/A; putative formula: C2H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.259,"smiles":null,"spectrum_id":"CCMSLIB00017222360","spectrum_index":8429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 270.2194 Da; putative annotation: N/A; putative formula: C16H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.462,"smiles":null,"spectrum_id":"CCMSLIB00017222361","spectrum_index":8430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 205.0807 Da; putative annotation: N/A; putative formula: C5H11N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.146,"smiles":null,"spectrum_id":"CCMSLIB00017222363","spectrum_index":8431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017222366","spectrum_index":8432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-Cyclohexyl-2-butenoic acid (delta mass: 174.0676 Da; putative annotation: N/A; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.19,"smiles":null,"spectrum_id":"CCMSLIB00017222367","spectrum_index":8433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 50.9847 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.087,"smiles":null,"spectrum_id":"CCMSLIB00017222368","spectrum_index":8434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 11.0874 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.137,"smiles":null,"spectrum_id":"CCMSLIB00017222371","spectrum_index":8435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 695.4943 Da; putative annotation: N/A; putative formula: C35H65N7O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1006.72,"smiles":null,"spectrum_id":"CCMSLIB00017222373","spectrum_index":8436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 125.0854 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.214,"smiles":null,"spectrum_id":"CCMSLIB00017222374","spectrum_index":8437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 408.2411 Da; putative annotation: N/A; putative formula: C25H32N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.318,"smiles":null,"spectrum_id":"CCMSLIB00017222375","spectrum_index":8438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Urobilin from NIST14 (delta mass: 97.9669 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.285,"smiles":null,"spectrum_id":"CCMSLIB00017222379","spectrum_index":8439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Cyclohexanecarbonylpentadecylamine from NIST14 (delta mass: 47.0131 Da; putative annotation: N/A; putative formula: C4HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.355,"smiles":null,"spectrum_id":"CCMSLIB00017222380","spectrum_index":8440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 37.9792 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.076,"smiles":null,"spectrum_id":"CCMSLIB00017222381","spectrum_index":8441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 130.117 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.37,"smiles":null,"spectrum_id":"CCMSLIB00017222383","spectrum_index":8442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 144.0942 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.181,"smiles":null,"spectrum_id":"CCMSLIB00017222386","spectrum_index":8443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 28.0298 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.143,"smiles":null,"spectrum_id":"CCMSLIB00017222387","spectrum_index":8444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE0; CorrDec (delta mass: 435.2732 Da; putative annotation: N/A; putative formula: C23H37N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.349,"smiles":null,"spectrum_id":"CCMSLIB00017222389","spectrum_index":8445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 13.0317 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.175,"smiles":null,"spectrum_id":"CCMSLIB00017222392","spectrum_index":8446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 299.1616 Da; putative annotation: N/A; putative formula: C13H17N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.253,"smiles":null,"spectrum_id":"CCMSLIB00017222393","spectrum_index":8447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,8-Difluoro-3-azabicyclo[3.2.1]octane (delta mass: 58.0452 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.138,"smiles":null,"spectrum_id":"CCMSLIB00017222395","spectrum_index":8448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 126.2446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.378,"smiles":null,"spectrum_id":"CCMSLIB00017222397","spectrum_index":8449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 249.158 Da; putative annotation: N/A; putative formula: C11H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.39,"smiles":null,"spectrum_id":"CCMSLIB00017222399","spectrum_index":8450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 47.0099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.149,"smiles":null,"spectrum_id":"CCMSLIB00017222401","spectrum_index":8451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid propyl ester (delta mass: 13.9141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017222403","spectrum_index":8452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 92.0471 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.263,"smiles":null,"spectrum_id":"CCMSLIB00017222404","spectrum_index":8453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 190.1363 Da; putative annotation: N/A; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.26,"smiles":null,"spectrum_id":"CCMSLIB00017222406","spectrum_index":8454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 180.0823 Da; putative annotation: N/A; putative formula: C9H13N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.158,"smiles":null,"spectrum_id":"CCMSLIB00017222408","spectrum_index":8455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP021902 Biotin|5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid (delta mass: 102.0534 Da; putative annotation: N/A; putative formula: C2H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.149,"smiles":null,"spectrum_id":"CCMSLIB00017222410","spectrum_index":8456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 188.1775 Da; putative annotation: N/A; putative formula: C7H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.258,"smiles":null,"spectrum_id":"CCMSLIB00017222412","spectrum_index":8457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17,21-triol-11,20-dione (delta mass: 158.0206 Da; putative annotation: N/A; putative formula: C3H-2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.253,"smiles":null,"spectrum_id":"CCMSLIB00017222414","spectrum_index":8458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanylglycol (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017222417","spectrum_index":8459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169594-02!8-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one (delta mass: 558.1093 Da; putative annotation: N/A; putative formula: C31H19N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1117.23,"smiles":null,"spectrum_id":"CCMSLIB00017222419","spectrum_index":8460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 103.93 Da; putative annotation: N/A; putative formula: C2HO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.011,"smiles":null,"spectrum_id":"CCMSLIB00017222420","spectrum_index":8461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid (delta mass: 23.0219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.08,"smiles":null,"spectrum_id":"CCMSLIB00017222422","spectrum_index":8462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 355.3592 Da; putative annotation: N/A; putative formula: C26H45NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.643,"smiles":null,"spectrum_id":"CCMSLIB00017222424","spectrum_index":8463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 319.308 Da; putative annotation: N/A; putative formula: C19H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.368,"smiles":null,"spectrum_id":"CCMSLIB00017222426","spectrum_index":8464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-6,10,14,18-tetraene-2,3,22,23-tetrol (delta mass: 92.099 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.508,"smiles":null,"spectrum_id":"CCMSLIB00017222428","spectrum_index":8465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austinoneol (delta mass: 431.2308 Da; putative annotation: N/A; putative formula: C24H33NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.442,"smiles":null,"spectrum_id":"CCMSLIB00017222430","spectrum_index":8466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 242.0379 Da; putative annotation: N/A; putative formula: C7H15O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.092,"smiles":null,"spectrum_id":"CCMSLIB00017222431","spectrum_index":8467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 59.0368 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.264,"smiles":null,"spectrum_id":"CCMSLIB00017222433","spectrum_index":8468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 36.3872 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.5,"smiles":null,"spectrum_id":"CCMSLIB00017222434","spectrum_index":8469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 185.572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.68,"smiles":null,"spectrum_id":"CCMSLIB00017222437","spectrum_index":8470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 35.9489 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.202,"smiles":null,"spectrum_id":"CCMSLIB00017222439","spectrum_index":8471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxo-taurocholenic acid or isomer  putative (delta mass: 18.513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.786,"smiles":null,"spectrum_id":"CCMSLIB00017222440","spectrum_index":8472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 158.0478 Da; putative annotation: N/A; putative formula: C9H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.134,"smiles":null,"spectrum_id":"CCMSLIB00017222442","spectrum_index":8473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 83.039 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.094,"smiles":null,"spectrum_id":"CCMSLIB00017222445","spectrum_index":8474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 507.3764 Da; putative annotation: N/A; putative formula: C31H49N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.437,"smiles":null,"spectrum_id":"CCMSLIB00017222446","spectrum_index":8475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleanolic acid methyl ester (delta mass: 126.0892 Da; putative annotation: N/A; putative formula: C5H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.472,"smiles":null,"spectrum_id":"CCMSLIB00017222448","spectrum_index":8476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 31.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.211,"smiles":null,"spectrum_id":"CCMSLIB00017222450","spectrum_index":8477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Acetyl-L-serine (delta mass: 84.0576 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017222452","spectrum_index":8478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6H-Indolo[2,3-b]quinoline (delta mass: 56.1083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.2,"smiles":null,"spectrum_id":"CCMSLIB00017222454","spectrum_index":8479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodecanedioic acid (delta mass: 38.0522 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.211,"smiles":null,"spectrum_id":"CCMSLIB00017222456","spectrum_index":8480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 193.0599 Da; putative annotation: N/A; putative formula: C7H7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.297,"smiles":null,"spectrum_id":"CCMSLIB00017222458","spectrum_index":8481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 116.0875 Da; putative annotation: N/A; putative formula: C5H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.2,"smiles":null,"spectrum_id":"CCMSLIB00017222461","spectrum_index":8482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 108.0946 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017222462","spectrum_index":8483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 100.0681 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.305,"smiles":null,"spectrum_id":"CCMSLIB00017222463","spectrum_index":8484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 120.0938 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.321,"smiles":null,"spectrum_id":"CCMSLIB00017222464","spectrum_index":8485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 104.0989 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.321,"smiles":null,"spectrum_id":"CCMSLIB00017222468","spectrum_index":8486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 154.1155 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.358,"smiles":null,"spectrum_id":"CCMSLIB00017222469","spectrum_index":8487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 40.031 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.315,"smiles":null,"spectrum_id":"CCMSLIB00017222470","spectrum_index":8488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 318.0614 Da; putative annotation: N/A; putative formula: C14H6N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.142,"smiles":null,"spectrum_id":"CCMSLIB00017222474","spectrum_index":8489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 110.5578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.629,"smiles":null,"spectrum_id":"CCMSLIB00017222475","spectrum_index":8490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 599.5073 Da; putative annotation: N/A; putative formula: C35H65N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":785.579,"smiles":null,"spectrum_id":"CCMSLIB00017222476","spectrum_index":8491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Cyclopentyloxy)benzoic acid (delta mass: 50.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.138,"smiles":null,"spectrum_id":"CCMSLIB00017222478","spectrum_index":8492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 103.0627 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.201,"smiles":null,"spectrum_id":"CCMSLIB00017222481","spectrum_index":8493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 284.2706 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.308,"smiles":null,"spectrum_id":"CCMSLIB00017222484","spectrum_index":8494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Thiophen-2-yl)piperazin-2-one (delta mass: 35.08 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017222486","spectrum_index":8495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 601.3514 Da; putative annotation: N/A; putative formula: C36H47N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":954.62,"smiles":null,"spectrum_id":"CCMSLIB00017222487","spectrum_index":8496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid; AIF; CE0; MS2Dec (delta mass: 72.0523 Da; putative annotation: N/A; putative formula: H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.123,"smiles":null,"spectrum_id":"CCMSLIB00017222489","spectrum_index":8497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 81.079 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.176,"smiles":null,"spectrum_id":"CCMSLIB00017222492","spectrum_index":8498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 130.1271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.292,"smiles":null,"spectrum_id":"CCMSLIB00017222493","spectrum_index":8499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 220.2193 Da; putative annotation: N/A; putative formula: C16H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.488,"smiles":null,"spectrum_id":"CCMSLIB00017222495","spectrum_index":8500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Isolongifolol (delta mass: 209.0538 Da; putative annotation: N/A; putative formula: C6H11NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.259,"smiles":null,"spectrum_id":"CCMSLIB00017222496","spectrum_index":8501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 348.1368 Da; putative annotation: N/A; putative formula: C14H26N2O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.197,"smiles":null,"spectrum_id":"CCMSLIB00017222500","spectrum_index":8502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 1131.5422 Da; putative annotation: N/A; putative formula: C62H77N5O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1312.61,"smiles":null,"spectrum_id":"CCMSLIB00017222501","spectrum_index":8503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 84.0758 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.141,"smiles":null,"spectrum_id":"CCMSLIB00017222502","spectrum_index":8504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxysebacic acid (delta mass: 112.1235 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.246,"smiles":null,"spectrum_id":"CCMSLIB00017222505","spectrum_index":8505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 14.0147 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.127,"smiles":null,"spectrum_id":"CCMSLIB00017222506","spectrum_index":8506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 28.876 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.962,"smiles":null,"spectrum_id":"CCMSLIB00017222507","spectrum_index":8507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Camptothecin (delta mass: 468.3167 Da; putative annotation: N/A; putative formula: C21H40N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":817.435,"smiles":null,"spectrum_id":"CCMSLIB00017222511","spectrum_index":8508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methylquinolin-2(1H)-one (delta mass: 149.092 Da; putative annotation: N/A; putative formula: C8H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.168,"smiles":null,"spectrum_id":"CCMSLIB00017222512","spectrum_index":8509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 168.1151 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.352,"smiles":null,"spectrum_id":"CCMSLIB00017222513","spectrum_index":8510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 40.031 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017222514","spectrum_index":8511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 1116.3584 Da; putative annotation: N/A; putative formula: C61H60N6O9S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1459.48,"smiles":null,"spectrum_id":"CCMSLIB00017222518","spectrum_index":8512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 896.3673 Da; putative annotation: N/A; putative formula: C56H52N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1155.49,"smiles":null,"spectrum_id":"CCMSLIB00017222519","spectrum_index":8513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ADENOSINE (delta mass: 142.0996 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.204,"smiles":null,"spectrum_id":"CCMSLIB00017222520","spectrum_index":8514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Palmitelaidic acid from NIST14 (delta mass: 196.2186 Da; putative annotation: N/A; putative formula: C14H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.451,"smiles":null,"spectrum_id":"CCMSLIB00017222523","spectrum_index":8515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-2-oxoacetic acid (delta mass: 50.0159 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.05,"smiles":null,"spectrum_id":"CCMSLIB00017222524","spectrum_index":8516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 80.1347 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017222525","spectrum_index":8517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-nitro-1H-imidazole-5-carboxylate (delta mass: 18.072 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017222528","spectrum_index":8518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Ketofusidic acid (delta mass: 62.0522 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.389,"smiles":null,"spectrum_id":"CCMSLIB00017222530","spectrum_index":8519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 168.1513 Da; putative annotation: N/A; putative formula: C11H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017222531","spectrum_index":8520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 200.2138 Da; putative annotation: N/A; putative formula: C9H24N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.279,"smiles":null,"spectrum_id":"CCMSLIB00017222532","spectrum_index":8521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 548.1143 Da; putative annotation: N/A; putative formula: C18H29O17P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":729.164,"smiles":null,"spectrum_id":"CCMSLIB00017222536","spectrum_index":8522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 10.0637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017222537","spectrum_index":8523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 232.1147 Da; putative annotation: N/A; putative formula: C12H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.217,"smiles":null,"spectrum_id":"CCMSLIB00017222538","spectrum_index":8524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 64.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.138,"smiles":null,"spectrum_id":"CCMSLIB00017222540","spectrum_index":8525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-trans-Myrtanol (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.164,"smiles":null,"spectrum_id":"CCMSLIB00017222543","spectrum_index":8526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-4-methylcoumarin (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.06,"smiles":null,"spectrum_id":"CCMSLIB00017222544","spectrum_index":8527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 72.0574 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.16,"smiles":null,"spectrum_id":"CCMSLIB00017222546","spectrum_index":8528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 114.1043 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017222549","spectrum_index":8529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 138.1047 Da; putative annotation: N/A; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.233,"smiles":null,"spectrum_id":"CCMSLIB00017222550","spectrum_index":8530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 132.0607 Da; putative annotation: N/A; putative formula: C6H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.126,"smiles":null,"spectrum_id":"CCMSLIB00017222552","spectrum_index":8531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 50.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.221,"smiles":null,"spectrum_id":"CCMSLIB00017222554","spectrum_index":8532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,3-Difluoroazetidin-1-yl)piperidine (delta mass: 154.0528 Da; putative annotation: N/A; putative formula: C10H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.173,"smiles":null,"spectrum_id":"CCMSLIB00017222555","spectrum_index":8533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.122,"smiles":null,"spectrum_id":"CCMSLIB00017222557","spectrum_index":8534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Methylgallic acid (delta mass: 164.097 Da; putative annotation: N/A; putative formula: C9H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.141,"smiles":null,"spectrum_id":"CCMSLIB00017222560","spectrum_index":8535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 128.9272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.003,"smiles":null,"spectrum_id":"CCMSLIB00017222561","spectrum_index":8536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trichoclin (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.102,"smiles":null,"spectrum_id":"CCMSLIB00017222562","spectrum_index":8537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 28.0003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.17,"smiles":null,"spectrum_id":"CCMSLIB00017222566","spectrum_index":8538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 186.1312 Da; putative annotation: N/A; putative formula: C8H18N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.302,"smiles":null,"spectrum_id":"CCMSLIB00017222567","spectrum_index":8539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 60.0359 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.216,"smiles":null,"spectrum_id":"CCMSLIB00017222569","spectrum_index":8540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Thr (delta mass: 285.0276 Da; putative annotation: N/A; putative formula: C7H15N3O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.194,"smiles":null,"spectrum_id":"CCMSLIB00017222570","spectrum_index":8541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 41.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017222573","spectrum_index":8542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 806.3294 Da; putative annotation: N/A; putative formula: C44H50N6O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1051.42,"smiles":null,"spectrum_id":"CCMSLIB00017222575","spectrum_index":8543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-cis-Verbenol (delta mass: 38.0553 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.183,"smiles":null,"spectrum_id":"CCMSLIB00017222576","spectrum_index":8544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 755.3145 Da; putative annotation: N/A; putative formula: C52H41N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1014.44,"smiles":null,"spectrum_id":"CCMSLIB00017222579","spectrum_index":8545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 45.9368 Da; putative annotation: N/A; putative formula: H-2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.007,"smiles":null,"spectrum_id":"CCMSLIB00017222581","spectrum_index":8546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 12.0355 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.174,"smiles":null,"spectrum_id":"CCMSLIB00017222582","spectrum_index":8547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 91.0421 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.097,"smiles":null,"spectrum_id":"CCMSLIB00017222583","spectrum_index":8548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 85.0518 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.101,"smiles":null,"spectrum_id":"CCMSLIB00017222587","spectrum_index":8549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 32.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017222588","spectrum_index":8550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369606 Salicylic acid|2-hydroxybenzoic acid (delta mass: 115.0259 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.065,"smiles":null,"spectrum_id":"CCMSLIB00017222589","spectrum_index":8551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Sialylgalactose (delta mass: 146.041 Da; putative annotation: N/A; putative formula: C6H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.207,"smiles":null,"spectrum_id":"CCMSLIB00017222593","spectrum_index":8552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 130.0622 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.18,"smiles":null,"spectrum_id":"CCMSLIB00017222594","spectrum_index":8553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 551.4258 Da; putative annotation: N/A; putative formula: C27H53N9O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.486,"smiles":null,"spectrum_id":"CCMSLIB00017222595","spectrum_index":8554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Fluorohexahydro-1H-azepine (delta mass: 63.0246 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.127,"smiles":null,"spectrum_id":"CCMSLIB00017222597","spectrum_index":8555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 89.0111 Da; putative annotation: N/A; putative formula: C2H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.087,"smiles":null,"spectrum_id":"CCMSLIB00017222600","spectrum_index":8556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 31.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017222601","spectrum_index":8557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Chlorophenyl)-1H-pyrazol-5-amine (delta mass: 208.1775 Da; putative annotation: N/A; putative formula: C10H20N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.225,"smiles":null,"spectrum_id":"CCMSLIB00017222603","spectrum_index":8558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 91.0502 Da; putative annotation: N/A; putative formula: H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.132,"smiles":null,"spectrum_id":"CCMSLIB00017222605","spectrum_index":8559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 127.082 Da; putative annotation: N/A; putative formula: C7H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.147,"smiles":null,"spectrum_id":"CCMSLIB00017222606","spectrum_index":8560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 544.192 Da; putative annotation: N/A; putative formula: C32H32O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.299,"smiles":null,"spectrum_id":"CCMSLIB00017222608","spectrum_index":8561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 423.331 Da; putative annotation: N/A; putative formula: C21H41N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.584,"smiles":null,"spectrum_id":"CCMSLIB00017222611","spectrum_index":8562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 274.2145 Da; putative annotation: N/A; putative formula: C15H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.28,"smiles":null,"spectrum_id":"CCMSLIB00017222612","spectrum_index":8563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 329.2529 Da; putative annotation: N/A; putative formula: C14H31N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.354,"smiles":null,"spectrum_id":"CCMSLIB00017222613","spectrum_index":8564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentazocine (delta mass: 81.0878 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.304,"smiles":null,"spectrum_id":"CCMSLIB00017222615","spectrum_index":8565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 173.1064 Da; putative annotation: N/A; putative formula: C9H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.213,"smiles":null,"spectrum_id":"CCMSLIB00017222618","spectrum_index":8566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 114.0402 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.158,"smiles":null,"spectrum_id":"CCMSLIB00017222619","spectrum_index":8567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Retinoic acid (delta mass: 17.9738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017222621","spectrum_index":8568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 265.188 Da; putative annotation: N/A; putative formula: C9H19N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.3,"smiles":null,"spectrum_id":"CCMSLIB00017222623","spectrum_index":8569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 197.1775 Da; putative annotation: N/A; putative formula: C12H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.446,"smiles":null,"spectrum_id":"CCMSLIB00017222625","spectrum_index":8570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100449 D(-)-Threose|D-Threo-tetrose|D-threo-Aldose (delta mass: 60.0364 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.086,"smiles":null,"spectrum_id":"CCMSLIB00017222628","spectrum_index":8571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP012802 Benzoic acid (delta mass: 82.0422 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017222629","spectrum_index":8572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 294.1631 Da; putative annotation: N/A; putative formula: C13H22N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.234,"smiles":null,"spectrum_id":"CCMSLIB00017222630","spectrum_index":8573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS001048919-01!(E)-N-[2-(1H-imidazol-5-yl)ethyl]-3-phenylprop-2-enamide (delta mass: 84.0414 Da; putative annotation: N/A; putative formula: C5H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.17,"smiles":null,"spectrum_id":"CCMSLIB00017222632","spectrum_index":8574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Palmitelaidic acid from NIST14 (delta mass: 114.9981 Da; putative annotation: N/A; putative formula: C4H6NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.23,"smiles":null,"spectrum_id":"CCMSLIB00017222635","spectrum_index":8575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethoxy)benzaldehyde (delta mass: 42.047 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017222636","spectrum_index":8576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodecanedioic acid (delta mass: 78.083 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.242,"smiles":null,"spectrum_id":"CCMSLIB00017222638","spectrum_index":8577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 70.0423 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.118,"smiles":null,"spectrum_id":"CCMSLIB00017222641","spectrum_index":8578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 318.2205 Da; putative annotation: N/A; putative formula: C21H26N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.349,"smiles":null,"spectrum_id":"CCMSLIB00017222642","spectrum_index":8579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 160.0082 Da; putative annotation: N/A; putative formula: C9H5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.062,"smiles":null,"spectrum_id":"CCMSLIB00017222644","spectrum_index":8580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 208.0362 Da; putative annotation: N/A; putative formula: C4H9N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.096,"smiles":null,"spectrum_id":"CCMSLIB00017222646","spectrum_index":8581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 45.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.26,"smiles":null,"spectrum_id":"CCMSLIB00017222648","spectrum_index":8582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 287.148 Da; putative annotation: N/A; putative formula: C12H21N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.228,"smiles":null,"spectrum_id":"CCMSLIB00017222649","spectrum_index":8583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 27.1999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.275,"smiles":null,"spectrum_id":"CCMSLIB00017222652","spectrum_index":8584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 62.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.149,"smiles":null,"spectrum_id":"CCMSLIB00017222654","spectrum_index":8585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 321.2111 Da; putative annotation: N/A; putative formula: C15H27N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.313,"smiles":null,"spectrum_id":"CCMSLIB00017222655","spectrum_index":8586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385110-01_C20H38O2_(2R)-1-(5-Hydroxy-3-methylpentyl)-2,5,5,8a-tetramethyldecahydro-2-naphthalenol (delta mass: 39.9211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.216,"smiles":null,"spectrum_id":"CCMSLIB00017222658","spectrum_index":8587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 89.0248 Da; putative annotation: N/A; putative formula: H4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.096,"smiles":null,"spectrum_id":"CCMSLIB00017222660","spectrum_index":8588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxyquinoline-2-carboxylic acid CollisionEnergy:102040 (delta mass: 135.0691 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.135,"smiles":null,"spectrum_id":"CCMSLIB00017222661","spectrum_index":8589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 381.1694 Da; putative annotation: N/A; putative formula: C14H23N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.308,"smiles":null,"spectrum_id":"CCMSLIB00017222664","spectrum_index":8590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoyl-rac-glycerol (delta mass: 876.5104 Da; putative annotation: N/A; putative formula: C46H76N4O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1446.02,"smiles":null,"spectrum_id":"CCMSLIB00017222666","spectrum_index":8591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.4]nonane-2,4-dione (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.077,"smiles":null,"spectrum_id":"CCMSLIB00017222667","spectrum_index":8592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 74.037 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.097,"smiles":null,"spectrum_id":"CCMSLIB00017222668","spectrum_index":8593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 62.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017222672","spectrum_index":8594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trolox (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017222673","spectrum_index":8595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxyvalerenic acid (delta mass: 420.3401 Da; putative annotation: N/A; putative formula: C23H44N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.504,"smiles":null,"spectrum_id":"CCMSLIB00017222674","spectrum_index":8596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 273.1306 Da; putative annotation: N/A; putative formula: C15H19N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.233,"smiles":null,"spectrum_id":"CCMSLIB00017222677","spectrum_index":8597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Picrinine (delta mass: 207.09 Da; putative annotation: N/A; putative formula: C11H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.26,"smiles":null,"spectrum_id":"CCMSLIB00017222679","spectrum_index":8598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 12-hydroxyoctadecanoate (delta mass: 70.078 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.367,"smiles":null,"spectrum_id":"CCMSLIB00017222680","spectrum_index":8599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylpiperazine (delta mass: 71.0992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.222,"smiles":null,"spectrum_id":"CCMSLIB00017222683","spectrum_index":8600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 157.11 Da; putative annotation: N/A; putative formula: C8H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.201,"smiles":null,"spectrum_id":"CCMSLIB00017222685","spectrum_index":8601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 77.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017222686","spectrum_index":8602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4,6-difluoro-1H-indole-2-carboxylate (delta mass: 101.0845 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.136,"smiles":null,"spectrum_id":"CCMSLIB00017222688","spectrum_index":8603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]cyclopropanecarboxamide (delta mass: 140.0559 Da; putative annotation: N/A; putative formula: C2H4N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.2,"smiles":null,"spectrum_id":"CCMSLIB00017222690","spectrum_index":8604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 253.1171 Da; putative annotation: N/A; putative formula: C10H15N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.365,"smiles":null,"spectrum_id":"CCMSLIB00017222692","spectrum_index":8605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 14.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.159,"smiles":null,"spectrum_id":"CCMSLIB00017222694","spectrum_index":8606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 50.9972 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.11,"smiles":null,"spectrum_id":"CCMSLIB00017222697","spectrum_index":8607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Undulatoside A (delta mass: 162.0518 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.154,"smiles":null,"spectrum_id":"CCMSLIB00017222698","spectrum_index":8608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 324.0633 Da; putative annotation: N/A; putative formula: C18H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.187,"smiles":null,"spectrum_id":"CCMSLIB00017222700","spectrum_index":8609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Furan-3-yl)-7,8-dihydroxy-6a,7,10b-trimethyl-2,4a,5,6,8,9,10,10a-octahydro-1H-benzo[f]isochromen-4-one (delta mass: 326.1213 Da; putative annotation: N/A; putative formula: C12H22O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.322,"smiles":null,"spectrum_id":"CCMSLIB00017222703","spectrum_index":8610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Glu (delta mass: 226.1665 Da; putative annotation: N/A; putative formula: C8H18N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.286,"smiles":null,"spectrum_id":"CCMSLIB00017222706","spectrum_index":8611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 1-PHOSPHATE (delta mass: 196.253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.29,"smiles":null,"spectrum_id":"CCMSLIB00017222709","spectrum_index":8612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-((S)-10-(((S)-1-(3,4-dihydro-1H-pyrido[3,4-b]indol-2(9H)-yl)-1-oxopropan-2-yl)amino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide (delta mass: 3.2136 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.5,"smiles":null,"spectrum_id":"CCMSLIB00017222711","spectrum_index":8613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Amino-1-cyclobutanecarboxylic acid (delta mass: 16.0315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.102,"smiles":null,"spectrum_id":"CCMSLIB00017222712","spectrum_index":8614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 44.0886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.155,"smiles":null,"spectrum_id":"CCMSLIB00017222715","spectrum_index":8615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 237.198 Da; putative annotation: N/A; putative formula: C2H19N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.332,"smiles":null,"spectrum_id":"CCMSLIB00017222717","spectrum_index":8616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 102.0116 Da; putative annotation: N/A; putative formula: H2N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.113,"smiles":null,"spectrum_id":"CCMSLIB00017222718","spectrum_index":8617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 399.0299 Da; putative annotation: N/A; putative formula: C15H18N3O2PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.09,"smiles":null,"spectrum_id":"CCMSLIB00017222721","spectrum_index":8618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-7,12-Dihydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 86.0516 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.258,"smiles":null,"spectrum_id":"CCMSLIB00017222723","spectrum_index":8619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 30.0103 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.097,"smiles":null,"spectrum_id":"CCMSLIB00017222724","spectrum_index":8620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 539.1782 Da; putative annotation: N/A; putative formula: C22H30N5O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.222,"smiles":null,"spectrum_id":"CCMSLIB00017222725","spectrum_index":8621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 138.0532 Da; putative annotation: N/A; putative formula: C5H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.088,"smiles":null,"spectrum_id":"CCMSLIB00017222729","spectrum_index":8622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 178.6474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.771,"smiles":null,"spectrum_id":"CCMSLIB00017222730","spectrum_index":8623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 600.9485 Da; putative annotation: N/A; putative formula: C13H19NO18P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.03,"smiles":null,"spectrum_id":"CCMSLIB00017222732","spectrum_index":8624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 199.1188 Da; putative annotation: N/A; putative formula: C10H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.314,"smiles":null,"spectrum_id":"CCMSLIB00017222734","spectrum_index":8625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 113.0584 Da; putative annotation: N/A; putative formula: C4H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.398,"smiles":null,"spectrum_id":"CCMSLIB00017222735","spectrum_index":8626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 118.0783 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017222737","spectrum_index":8627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 239.1154 Da; putative annotation: N/A; putative formula: C12H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.254,"smiles":null,"spectrum_id":"CCMSLIB00017222738","spectrum_index":8628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 328.2386 Da; putative annotation: N/A; putative formula: C16H33N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.601,"smiles":null,"spectrum_id":"CCMSLIB00017222742","spectrum_index":8629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 531.4638 Da; putative annotation: N/A; putative formula: C30H57N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.55,"smiles":null,"spectrum_id":"CCMSLIB00017222743","spectrum_index":8630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 415.2932 Da; putative annotation: N/A; putative formula: C22H41NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.395,"smiles":null,"spectrum_id":"CCMSLIB00017222744","spectrum_index":8631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 43.0402 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.121,"smiles":null,"spectrum_id":"CCMSLIB00017222747","spectrum_index":8632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 90.1769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.299,"smiles":null,"spectrum_id":"CCMSLIB00017222749","spectrum_index":8633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 81.0578 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.181,"smiles":null,"spectrum_id":"CCMSLIB00017222750","spectrum_index":8634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 598.23 Da; putative annotation: N/A; putative formula: C31H26N12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":927.499,"smiles":null,"spectrum_id":"CCMSLIB00017222753","spectrum_index":8635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 81.0664 Da; putative annotation: N/A; putative formula: C4H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.109,"smiles":null,"spectrum_id":"CCMSLIB00017222755","spectrum_index":8636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-(Dimethylamino)propyl]tetradecanamide (delta mass: 56.063 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.384,"smiles":null,"spectrum_id":"CCMSLIB00017222756","spectrum_index":8637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 272.0676 Da; putative annotation: N/A; putative formula: C9H13N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.138,"smiles":null,"spectrum_id":"CCMSLIB00017222758","spectrum_index":8638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 395.1407 Da; putative annotation: N/A; putative formula: C20H29NOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.243,"smiles":null,"spectrum_id":"CCMSLIB00017222761","spectrum_index":8639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 510.3398 Da; putative annotation: N/A; putative formula: C38H42N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.379,"smiles":null,"spectrum_id":"CCMSLIB00017222762","spectrum_index":8640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017222763","spectrum_index":8641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 71.0372 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.124,"smiles":null,"spectrum_id":"CCMSLIB00017222767","spectrum_index":8642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 154.0028 Da; putative annotation: N/A; putative formula: C6H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.287,"smiles":null,"spectrum_id":"CCMSLIB00017222768","spectrum_index":8643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Ala (delta mass: 71.0369 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.151,"smiles":null,"spectrum_id":"CCMSLIB00017222769","spectrum_index":8644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxybenzoic acid (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.049,"smiles":null,"spectrum_id":"CCMSLIB00017222772","spectrum_index":8645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 248.0898 Da; putative annotation: N/A; putative formula: C10H16O7)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.16,"smiles":null,"spectrum_id":"CCMSLIB00017222773","spectrum_index":8646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(9H-Carbazol-9-yl)-3-(4-chlorophenoxy)-2-propanol (delta mass: 17.0243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.134,"smiles":null,"spectrum_id":"CCMSLIB00017222775","spectrum_index":8647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-3.alpha.-ol-11,20-dione (delta mass: 102.0832 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.326,"smiles":null,"spectrum_id":"CCMSLIB00017222777","spectrum_index":8648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 188.1025 Da; putative annotation: N/A; putative formula: C13H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.35,"smiles":null,"spectrum_id":"CCMSLIB00017222778","spectrum_index":8649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 147.0255 Da; putative annotation: N/A; putative formula: C7H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.112,"smiles":null,"spectrum_id":"CCMSLIB00017222780","spectrum_index":8650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Cycloisolongifol-5-ol (delta mass: 306.0952 Da; putative annotation: N/A; putative formula: C12H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.285,"smiles":null,"spectrum_id":"CCMSLIB00017222783","spectrum_index":8651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 262.2297 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.29,"smiles":null,"spectrum_id":"CCMSLIB00017222784","spectrum_index":8652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 89.0478 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.171,"smiles":null,"spectrum_id":"CCMSLIB00017222785","spectrum_index":8653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 88.0182 Da; putative annotation: N/A; putative formula: C2H5N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.094,"smiles":null,"spectrum_id":"CCMSLIB00017222789","spectrum_index":8654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,5,7,8-Pentamethyl-6-hydroxychroman (delta mass: 116.0834 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.237,"smiles":null,"spectrum_id":"CCMSLIB00017222790","spectrum_index":8655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 263.137 Da; putative annotation: N/A; putative formula: C11H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.197,"smiles":null,"spectrum_id":"CCMSLIB00017222791","spectrum_index":8656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381317-01!(E)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-methyldec-8-ene-1,3-dione [IIN-based on: CCMSLIB00000846613] (delta mass: 238.2292 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.436,"smiles":null,"spectrum_id":"CCMSLIB00017222792","spectrum_index":8657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 280.1228 Da; putative annotation: N/A; putative formula: C15H21O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.22,"smiles":null,"spectrum_id":"CCMSLIB00017222796","spectrum_index":8658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 277.1062 Da; putative annotation: N/A; putative formula: C13H15N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.193,"smiles":null,"spectrum_id":"CCMSLIB00017222797","spectrum_index":8659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Eicosenoic acid (delta mass: 179.0797 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.374,"smiles":null,"spectrum_id":"CCMSLIB00017222798","spectrum_index":8660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 111.0685 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.16,"smiles":null,"spectrum_id":"CCMSLIB00017222802","spectrum_index":8661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 38.014 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.194,"smiles":null,"spectrum_id":"CCMSLIB00017222803","spectrum_index":8662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-C5:0 (delta mass: 27.9954 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.15,"smiles":null,"spectrum_id":"CCMSLIB00017222804","spectrum_index":8663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 300.1295 Da; putative annotation: N/A; putative formula: C9H16N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.409,"smiles":null,"spectrum_id":"CCMSLIB00017222807","spectrum_index":8664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Cyclohexanecarbonylpentadecylamine from NIST14 (delta mass: 40.8101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.152,"smiles":null,"spectrum_id":"CCMSLIB00017222808","spectrum_index":8665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 159.0349 Da; putative annotation: N/A; putative formula: C8H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.142,"smiles":null,"spectrum_id":"CCMSLIB00017222809","spectrum_index":8666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 129.0734 Da; putative annotation: N/A; putative formula: C5H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.16,"smiles":null,"spectrum_id":"CCMSLIB00017222811","spectrum_index":8667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 428.2743 Da; putative annotation: N/A; putative formula: C29H37N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.496,"smiles":null,"spectrum_id":"CCMSLIB00017222814","spectrum_index":8668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 17.9167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.102,"smiles":null,"spectrum_id":"CCMSLIB00017222815","spectrum_index":8669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-15-ketoprostaglandin D1 (delta mass: 78.0467 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.295,"smiles":null,"spectrum_id":"CCMSLIB00017222817","spectrum_index":8670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 664.5938 Da; putative annotation: N/A; putative formula: C41H80N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.707,"smiles":null,"spectrum_id":"CCMSLIB00017222818","spectrum_index":8671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 45.0332 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.105,"smiles":null,"spectrum_id":"CCMSLIB00017222822","spectrum_index":8672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cinchonidine (delta mass: 43.0195 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.2,"smiles":null,"spectrum_id":"CCMSLIB00017222823","spectrum_index":8673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 128.0992 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.295,"smiles":null,"spectrum_id":"CCMSLIB00017222824","spectrum_index":8674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 241.1675 Da; putative annotation: N/A; putative formula: C13H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.238,"smiles":null,"spectrum_id":"CCMSLIB00017222827","spectrum_index":8675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 348.2299 Da; putative annotation: N/A; putative formula: C21H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.301,"smiles":null,"spectrum_id":"CCMSLIB00017222829","spectrum_index":8676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 350.2469 Da; putative annotation: N/A; putative formula: C22H30N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.318,"smiles":null,"spectrum_id":"CCMSLIB00017222830","spectrum_index":8677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-indol-3-yl)ethanamine (delta mass: 56.002 Da; putative annotation: N/A; putative formula: CN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.109,"smiles":null,"spectrum_id":"CCMSLIB00017222831","spectrum_index":8678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 62.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.253,"smiles":null,"spectrum_id":"CCMSLIB00017222835","spectrum_index":8679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 119.0579 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.17,"smiles":null,"spectrum_id":"CCMSLIB00017222836","spectrum_index":8680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cresotinic acid (delta mass: 40.0678 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017222837","spectrum_index":8681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369605 Salicylic acid|2-hydroxybenzoic acid (delta mass: 56.0242 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.063,"smiles":null,"spectrum_id":"CCMSLIB00017222838","spectrum_index":8682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310841 LPC 18:3 (delta mass: 92.0473 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.371,"smiles":null,"spectrum_id":"CCMSLIB00017222842","spectrum_index":8683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 173.0314 Da; putative annotation: N/A; putative formula: C6H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.129,"smiles":null,"spectrum_id":"CCMSLIB00017222843","spectrum_index":8684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 709.4405 Da; putative annotation: N/A; putative formula: C38H63NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.511,"smiles":null,"spectrum_id":"CCMSLIB00017222844","spectrum_index":8685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxo-5Z,8Z,10E,14Z-eicosatetraenoic acid (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.263,"smiles":null,"spectrum_id":"CCMSLIB00017222846","spectrum_index":8686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 410.0906 Da; putative annotation: N/A; putative formula: C17H22N4O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.182,"smiles":null,"spectrum_id":"CCMSLIB00017222849","spectrum_index":8687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 919.5135 Da; putative annotation: N/A; putative formula: C58H69N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1100.58,"smiles":null,"spectrum_id":"CCMSLIB00017222850","spectrum_index":8688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 121.0537 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.198,"smiles":null,"spectrum_id":"CCMSLIB00017222852","spectrum_index":8689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 501.285 Da; putative annotation: N/A; putative formula: C28H35N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":997.625,"smiles":null,"spectrum_id":"CCMSLIB00017222854","spectrum_index":8690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 193.0589 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.14,"smiles":null,"spectrum_id":"CCMSLIB00017222855","spectrum_index":8691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Methylgallic acid (delta mass: 235.1062 Da; putative annotation: N/A; putative formula: C10H21NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.151,"smiles":null,"spectrum_id":"CCMSLIB00017222857","spectrum_index":8692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 130.0476 Da; putative annotation: N/A; putative formula: C6H12O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.201,"smiles":null,"spectrum_id":"CCMSLIB00017222860","spectrum_index":8693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 315.2235 Da; putative annotation: N/A; putative formula: C17H33NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.435,"smiles":null,"spectrum_id":"CCMSLIB00017222862","spectrum_index":8694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 301.1966 Da; putative annotation: N/A; putative formula: C19H28NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.408,"smiles":null,"spectrum_id":"CCMSLIB00017222863","spectrum_index":8695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 49.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.238,"smiles":null,"spectrum_id":"CCMSLIB00017222866","spectrum_index":8696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 636.2679 Da; putative annotation: N/A; putative formula: C32H36N12O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.385,"smiles":null,"spectrum_id":"CCMSLIB00017222868","spectrum_index":8697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 63.0328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.103,"smiles":null,"spectrum_id":"CCMSLIB00017222869","spectrum_index":8698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminoadipic acid (delta mass: 278.0404 Da; putative annotation: N/A; putative formula: C10H18N2O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.116,"smiles":null,"spectrum_id":"CCMSLIB00017222871","spectrum_index":8699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 257.2087 Da; putative annotation: N/A; putative formula: C9H23N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.243,"smiles":null,"spectrum_id":"CCMSLIB00017222874","spectrum_index":8700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-hydroxy-4-methoxybenzoate (delta mass: 196.0372 Da; putative annotation: N/A; putative formula: C9H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.102,"smiles":null,"spectrum_id":"CCMSLIB00017222875","spectrum_index":8701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 777.6029 Da; putative annotation: N/A; putative formula: C46H84NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":958.674,"smiles":null,"spectrum_id":"CCMSLIB00017222877","spectrum_index":8702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 311.157 Da; putative annotation: N/A; putative formula: C17H21N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.379,"smiles":null,"spectrum_id":"CCMSLIB00017222879","spectrum_index":8703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Myristoleic acid from NIST14 (delta mass: 238.2672 Da; putative annotation: N/A; putative formula: C17H34)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.468,"smiles":null,"spectrum_id":"CCMSLIB00017222880","spectrum_index":8704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PETROSELINIC ACID (delta mass: 210.2354 Da; putative annotation: N/A; putative formula: C15H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.499,"smiles":null,"spectrum_id":"CCMSLIB00017222882","spectrum_index":8705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 303.2774 Da; putative annotation: N/A; putative formula: C18H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.494,"smiles":null,"spectrum_id":"CCMSLIB00017222885","spectrum_index":8706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 499.3493 Da; putative annotation: N/A; putative formula: C24H41N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.42,"smiles":null,"spectrum_id":"CCMSLIB00017222886","spectrum_index":8707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 103.0635 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.144,"smiles":null,"spectrum_id":"CCMSLIB00017222888","spectrum_index":8708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 97.0523 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.112,"smiles":null,"spectrum_id":"CCMSLIB00017222891","spectrum_index":8709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 125.0476 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.139,"smiles":null,"spectrum_id":"CCMSLIB00017222892","spectrum_index":8710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 131.022 Da; putative annotation: N/A; putative formula: C4H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017222895","spectrum_index":8711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-3-Methyl-5-(1,2,5,5-tetramethyl-7-oxo-3,4,4a,6-tetrahydro-2H-naphthalen-1-yl)pent-2-enoic acid (delta mass: 104.0993 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017222897","spectrum_index":8712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,10-Bisaboladiene-1,4-diol (delta mass: 161.1294 Da; putative annotation: N/A; putative formula: C5H15N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.33,"smiles":null,"spectrum_id":"CCMSLIB00017222899","spectrum_index":8713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-benzyl-4-azabicyclo[4.4.0]decan-1-ol CollisionEnergy:102040 (delta mass: 136.1213 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.306,"smiles":null,"spectrum_id":"CCMSLIB00017222901","spectrum_index":8714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 55.0422 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.144,"smiles":null,"spectrum_id":"CCMSLIB00017222903","spectrum_index":8715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 70.0819 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.319,"smiles":null,"spectrum_id":"CCMSLIB00017222905","spectrum_index":8716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylsyringic acid (delta mass: 124.0157 Da; putative annotation: N/A; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.086,"smiles":null,"spectrum_id":"CCMSLIB00017222908","spectrum_index":8717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 186.1619 Da; putative annotation: N/A; putative formula: C11H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017222909","spectrum_index":8718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 36.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.372,"smiles":null,"spectrum_id":"CCMSLIB00017222911","spectrum_index":8719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxybenzoic acid (delta mass: 218.094 Da; putative annotation: N/A; putative formula: C13H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.17,"smiles":null,"spectrum_id":"CCMSLIB00017222914","spectrum_index":8720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 54.047 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.295,"smiles":null,"spectrum_id":"CCMSLIB00017222916","spectrum_index":8721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 202.0951 Da; putative annotation: N/A; putative formula: C8H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.28,"smiles":null,"spectrum_id":"CCMSLIB00017222918","spectrum_index":8722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01042 Hexahydrocurcumin (delta mass: 146.0336 Da; putative annotation: N/A; putative formula: C5H10N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.214,"smiles":null,"spectrum_id":"CCMSLIB00017222921","spectrum_index":8723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 625.5121 Da; putative annotation: N/A; putative formula: C37H73NO2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":904.744,"smiles":null,"spectrum_id":"CCMSLIB00017222923","spectrum_index":8724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 106.0783 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.331,"smiles":null,"spectrum_id":"CCMSLIB00017222925","spectrum_index":8725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 291.1838 Da; putative annotation: N/A; putative formula: C17H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.28,"smiles":null,"spectrum_id":"CCMSLIB00017222927","spectrum_index":8726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 161.0683 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.139,"smiles":null,"spectrum_id":"CCMSLIB00017222929","spectrum_index":8727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 119.0802 Da; putative annotation: N/A; putative formula: C2H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.161,"smiles":null,"spectrum_id":"CCMSLIB00017222931","spectrum_index":8728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 57.0215 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017222933","spectrum_index":8729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxybenzene-1,2-dicarboxylic acid (delta mass: 80.0258 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.049,"smiles":null,"spectrum_id":"CCMSLIB00017222935","spectrum_index":8730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 72.0209 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.097,"smiles":null,"spectrum_id":"CCMSLIB00017222936","spectrum_index":8731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 170.0941 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.133,"smiles":null,"spectrum_id":"CCMSLIB00017222937","spectrum_index":8732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 290.2607 Da; putative annotation: N/A; putative formula: C20H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.536,"smiles":null,"spectrum_id":"CCMSLIB00017222940","spectrum_index":8733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hexadec-15-en-7-ynyl-4-hydroxy-5-methyloxolan-2-one (delta mass: 488.3519 Da; putative annotation: N/A; putative formula: C31H44N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":823.61,"smiles":null,"spectrum_id":"CCMSLIB00017222942","spectrum_index":8734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Erythrodiol (delta mass: 562.4289 Da; putative annotation: N/A; putative formula: C40H54N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1005.82,"smiles":null,"spectrum_id":"CCMSLIB00017222943","spectrum_index":8735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 386.1364 Da; putative annotation: N/A; putative formula: C16H27N4OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.207,"smiles":null,"spectrum_id":"CCMSLIB00017222946","spectrum_index":8736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 42.0057 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.29,"smiles":null,"spectrum_id":"CCMSLIB00017222948","spectrum_index":8737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 132.0883 Da; putative annotation: N/A; putative formula: CH8N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.31,"smiles":null,"spectrum_id":"CCMSLIB00017222950","spectrum_index":8738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxy-7-[2-(2-hydroxy-5-oxo-2H-furan-3-yl)ethyl]-7,8-dimethyl-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-3-one (delta mass: 62.0559 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.236,"smiles":null,"spectrum_id":"CCMSLIB00017222952","spectrum_index":8739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 73.0534 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017222953","spectrum_index":8740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 144.0683 Da; putative annotation: N/A; putative formula: C9H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.128,"smiles":null,"spectrum_id":"CCMSLIB00017222956","spectrum_index":8741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(11),(5.alpha.)-Androsten-3.beta.-ol-17-one (delta mass: 174.0894 Da; putative annotation: N/A; putative formula: C8H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.306,"smiles":null,"spectrum_id":"CCMSLIB00017222958","spectrum_index":8742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydro-11-deoxycorticosterone (delta mass: 80.0635 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.322,"smiles":null,"spectrum_id":"CCMSLIB00017222959","spectrum_index":8743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(8Z,11Z,14Z-Eicosatrienoyl)ethanolamine (delta mass: 148.1256 Da; putative annotation: N/A; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.431,"smiles":null,"spectrum_id":"CCMSLIB00017222962","spectrum_index":8744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 27.4899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.555,"smiles":null,"spectrum_id":"CCMSLIB00017222964","spectrum_index":8745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxygypsogenic acid (delta mass: 114.084 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.421,"smiles":null,"spectrum_id":"CCMSLIB00017222965","spectrum_index":8746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 262.1049 Da; putative annotation: N/A; putative formula: C11H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.389,"smiles":null,"spectrum_id":"CCMSLIB00017222967","spectrum_index":8747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-5-oxopentanoic acid CollisionEnergy:102040 (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.086,"smiles":null,"spectrum_id":"CCMSLIB00017222970","spectrum_index":8748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(18)-Epoxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid (delta mass: 98.0554 Da; putative annotation: N/A; putative formula: C6H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.282,"smiles":null,"spectrum_id":"CCMSLIB00017222971","spectrum_index":8749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 52.0671 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.32,"smiles":null,"spectrum_id":"CCMSLIB00017222972","spectrum_index":8750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 36.0355 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.262,"smiles":null,"spectrum_id":"CCMSLIB00017222976","spectrum_index":8751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 76.0678 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.154,"smiles":null,"spectrum_id":"CCMSLIB00017222977","spectrum_index":8752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 18.0191 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017222978","spectrum_index":8753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 78.0466 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.127,"smiles":null,"spectrum_id":"CCMSLIB00017222979","spectrum_index":8754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 23.0043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.055,"smiles":null,"spectrum_id":"CCMSLIB00017222983","spectrum_index":8755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-5-Phenylpent-2-enoic acid (delta mass: 56.063 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.154,"smiles":null,"spectrum_id":"CCMSLIB00017222984","spectrum_index":8756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxyresveratrol (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017222985","spectrum_index":8757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 233.9694 Da; putative annotation: N/A; putative formula: C3H8O8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.254,"smiles":null,"spectrum_id":"CCMSLIB00017222989","spectrum_index":8758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 223.0607 Da; putative annotation: N/A; putative formula: C10H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.116,"smiles":null,"spectrum_id":"CCMSLIB00017222990","spectrum_index":8759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 94.0786 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017222991","spectrum_index":8760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 111.0548 Da; putative annotation: N/A; putative formula: C3H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.143,"smiles":null,"spectrum_id":"CCMSLIB00017222995","spectrum_index":8761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.175,"smiles":null,"spectrum_id":"CCMSLIB00017222996","spectrum_index":8762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 60.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.248,"smiles":null,"spectrum_id":"CCMSLIB00017222998","spectrum_index":8763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lavandulol (delta mass: 66.0474 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.19,"smiles":null,"spectrum_id":"CCMSLIB00017223001","spectrum_index":8764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 78.0443 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.151,"smiles":null,"spectrum_id":"CCMSLIB00017223002","spectrum_index":8765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclohexen-1-one, 4-[(1E)-3-(.beta.-D-glucopyranosyloxy)-1-buten-1-yl]-4-hydroxy-3,5,5-trimethyl-, (4S)- (delta mass: 128.0479 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.249,"smiles":null,"spectrum_id":"CCMSLIB00017223004","spectrum_index":8766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 307.1422 Da; putative annotation: N/A; putative formula: C16H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.202,"smiles":null,"spectrum_id":"CCMSLIB00017223007","spectrum_index":8767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 130.0785 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.43,"smiles":null,"spectrum_id":"CCMSLIB00017223009","spectrum_index":8768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 350.3553 Da; putative annotation: N/A; putative formula: C24H46O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.566,"smiles":null,"spectrum_id":"CCMSLIB00017223011","spectrum_index":8769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 115.0997 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.175,"smiles":null,"spectrum_id":"CCMSLIB00017223014","spectrum_index":8770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.107,"smiles":null,"spectrum_id":"CCMSLIB00017223015","spectrum_index":8771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vindolinine (delta mass: 29.9738 Da; putative annotation: N/A; putative formula: H-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.165,"smiles":null,"spectrum_id":"CCMSLIB00017223017","spectrum_index":8772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00067 (+)-Cinchonine (delta mass: 76.0163 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.197,"smiles":null,"spectrum_id":"CCMSLIB00017223020","spectrum_index":8773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 30.0096 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.289,"smiles":null,"spectrum_id":"CCMSLIB00017223022","spectrum_index":8774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Hydroxy-6-ketocholesterol (delta mass: 166.115 Da; putative annotation: N/A; putative formula: C14H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.467,"smiles":null,"spectrum_id":"CCMSLIB00017223026","spectrum_index":8775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 145.0526 Da; putative annotation: 3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.144,"smiles":null,"spectrum_id":"CCMSLIB00017223028","spectrum_index":8776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 139.0632 Da; putative annotation: N-ACETYLPROLINE; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.134,"smiles":null,"spectrum_id":"CCMSLIB00017223030","spectrum_index":8777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2,2,6,6-tetramethyl-4-[3-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]butyl]cyclohex-4-ene-1,3-dione (delta mass: 428.2278 Da; putative annotation: 5-Hydroxy-2,2,6,6-tetramethyl-4-[3-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]butyl]cyclohex-4-ene-1,3-dione; putative formula: C25H32O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.466,"smiles":null,"spectrum_id":"CCMSLIB00017223033","spectrum_index":8778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 365.1349 Da; putative annotation: 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose; putative formula: C14H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.285,"smiles":null,"spectrum_id":"CCMSLIB00017223034","spectrum_index":8779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 282.198 Da; putative annotation: 4,5.alpha.-Dihydronorethisterone; putative formula: C20H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.414,"smiles":null,"spectrum_id":"CCMSLIB00017223036","spectrum_index":8780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 260.2155 Da; putative annotation: gamma-linolenic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.474,"smiles":null,"spectrum_id":"CCMSLIB00017223038","spectrum_index":8781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 246.1621 Da; putative annotation: Dinor-12-oxophytodienoic acid; putative formula: C16H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.431,"smiles":null,"spectrum_id":"CCMSLIB00017223041","spectrum_index":8782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 238.1931 Da; putative annotation: 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol; putative formula: C15H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.441,"smiles":null,"spectrum_id":"CCMSLIB00017223043","spectrum_index":8783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 326.3176 Da; putative annotation: Spectral Match to Batyl alcohol from NIST14; putative formula: C21H42O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.355,"smiles":null,"spectrum_id":"CCMSLIB00017223045","spectrum_index":8784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 210.1253 Da; putative annotation: 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.352,"smiles":null,"spectrum_id":"CCMSLIB00017223048","spectrum_index":8785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 156.1157 Da; putative annotation: 9-Hydroxynonanoic acid; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.342,"smiles":null,"spectrum_id":"CCMSLIB00017223050","spectrum_index":8786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 132.095 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.442,"smiles":null,"spectrum_id":"CCMSLIB00017223051","spectrum_index":8787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 75.0471 Da; putative annotation: Aniline; AIF; CE30; CorrDec; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.138,"smiles":null,"spectrum_id":"CCMSLIB00017223055","spectrum_index":8788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 280.2034 Da; putative annotation: Nephrosteranic acid; putative formula: C17H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.482,"smiles":null,"spectrum_id":"CCMSLIB00017223056","spectrum_index":8789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dimethylnicotinic acid (delta mass: 103.0781 Da; putative annotation: Phenylethylamine; putative formula: C8H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.149,"smiles":null,"spectrum_id":"CCMSLIB00017223058","spectrum_index":8790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 114.0575 Da; putative annotation: 7-Amino-1H-indole; putative formula: C8H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.217,"smiles":null,"spectrum_id":"CCMSLIB00017223061","spectrum_index":8791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 574.4964 Da; putative annotation: 1-Palmitoyl-2-linoleoyl-rac-glycerol; putative formula: C37H66O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.723,"smiles":null,"spectrum_id":"CCMSLIB00017223063","spectrum_index":8792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 323.2839 Da; putative annotation: Gly-C18:0; putative formula: C20H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.547,"smiles":null,"spectrum_id":"CCMSLIB00017223066","spectrum_index":8793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 170.1283 Da; putative annotation: N/A; putative formula: C6H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.241,"smiles":null,"spectrum_id":"CCMSLIB00017223068","spectrum_index":8794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 261.2286 Da; putative annotation: N/A; putative formula: C15H27N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.596,"smiles":null,"spectrum_id":"CCMSLIB00017223069","spectrum_index":8795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 313.2616 Da; putative annotation: N/A; putative formula: C18H35NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.629,"smiles":null,"spectrum_id":"CCMSLIB00017223073","spectrum_index":8796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid methyl ester (delta mass: 292.2109 Da; putative annotation: N/A; putative formula: C12H28N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.594,"smiles":null,"spectrum_id":"CCMSLIB00017223074","spectrum_index":8797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 110.0482 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.193,"smiles":null,"spectrum_id":"CCMSLIB00017223075","spectrum_index":8798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 182.0109 Da; putative annotation: N/A; putative formula: C2H6N4O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.092,"smiles":null,"spectrum_id":"CCMSLIB00017223078","spectrum_index":8799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 144.0409 Da; putative annotation: N/A; putative formula: C10H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.147,"smiles":null,"spectrum_id":"CCMSLIB00017223079","spectrum_index":8800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of VANILLIN (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017223080","spectrum_index":8801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 184.0374 Da; putative annotation: N/A; putative formula: C8H8O5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.103,"smiles":null,"spectrum_id":"CCMSLIB00017223081","spectrum_index":8802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 429.3604 Da; putative annotation: N/A; putative formula: C28H47NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.426,"smiles":null,"spectrum_id":"CCMSLIB00017223085","spectrum_index":8803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 113.048 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.087,"smiles":null,"spectrum_id":"CCMSLIB00017223086","spectrum_index":8804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 41.0728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017223087","spectrum_index":8805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 142.0301 Da; putative annotation: N/A; putative formula: C5H7N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.148,"smiles":null,"spectrum_id":"CCMSLIB00017223089","spectrum_index":8806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 110.9686 Da; putative annotation: N/A; putative formula: C4H2NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.201,"smiles":null,"spectrum_id":"CCMSLIB00017223092","spectrum_index":8807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 104.0998 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.342,"smiles":null,"spectrum_id":"CCMSLIB00017223093","spectrum_index":8808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 95.095 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.306,"smiles":null,"spectrum_id":"CCMSLIB00017223094","spectrum_index":8809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 142.0878 Da; putative annotation: N/A; putative formula: C10H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.325,"smiles":null,"spectrum_id":"CCMSLIB00017223098","spectrum_index":8810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 36.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017223099","spectrum_index":8811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 1017.4985 Da; putative annotation: N/A; putative formula: C56H59N17O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1370.77,"smiles":null,"spectrum_id":"CCMSLIB00017223100","spectrum_index":8812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 924.4805 Da; putative annotation: N/A; putative formula: C42H68N8O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1119.54,"smiles":null,"spectrum_id":"CCMSLIB00017223102","spectrum_index":8813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 147.0495 Da; putative annotation: N/A; putative formula: CH5N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.12,"smiles":null,"spectrum_id":"CCMSLIB00017223105","spectrum_index":8814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 43.9911 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.156,"smiles":null,"spectrum_id":"CCMSLIB00017223106","spectrum_index":8815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Methoxycamptothecine (delta mass: 78.0173 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.146,"smiles":null,"spectrum_id":"CCMSLIB00017223108","spectrum_index":8816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 68.063 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017223110","spectrum_index":8817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.107,"smiles":null,"spectrum_id":"CCMSLIB00017223112","spectrum_index":8818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 137.1055 Da; putative annotation: N/A; putative formula: C6H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.337,"smiles":null,"spectrum_id":"CCMSLIB00017223114","spectrum_index":8819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heneicosapentaenoic acid (delta mass: 106.0814 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.329,"smiles":null,"spectrum_id":"CCMSLIB00017223116","spectrum_index":8820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 4.4188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.5,"smiles":null,"spectrum_id":"CCMSLIB00017223117","spectrum_index":8821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 420.3474 Da; putative annotation: N/A; putative formula: C24H44N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.486,"smiles":null,"spectrum_id":"CCMSLIB00017223120","spectrum_index":8822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,1'-Biphenyl-4-ylcarbonyl)benzoic acid (delta mass: 110.0436 Da; putative annotation: N/A; putative formula: CH2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.145,"smiles":null,"spectrum_id":"CCMSLIB00017223122","spectrum_index":8823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 167.0258 Da; putative annotation: N/A; putative formula: C4H9NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.127,"smiles":null,"spectrum_id":"CCMSLIB00017223124","spectrum_index":8824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZOIC ACID CollisionEnergy:205060 (delta mass: 55.1149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.154,"smiles":null,"spectrum_id":"CCMSLIB00017223125","spectrum_index":8825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Hydroxy-15-kauren-19-oic acid (delta mass: 50.0527 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.28,"smiles":null,"spectrum_id":"CCMSLIB00017223127","spectrum_index":8826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 118.1147 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.373,"smiles":null,"spectrum_id":"CCMSLIB00017223129","spectrum_index":8827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 28.1042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.164,"smiles":null,"spectrum_id":"CCMSLIB00017223131","spectrum_index":8828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 71.0036 Da; putative annotation: N/A; putative formula: CH2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017223133","spectrum_index":8829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 231.1102 Da; putative annotation: N/A; putative formula: C10H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.259,"smiles":null,"spectrum_id":"CCMSLIB00017223135","spectrum_index":8830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,7,10,13,16,19-Docosahexaenoic acid (delta mass: 74.0373 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.285,"smiles":null,"spectrum_id":"CCMSLIB00017223137","spectrum_index":8831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 388.1162 Da; putative annotation: N/A; putative formula: C15H17N8O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.176,"smiles":null,"spectrum_id":"CCMSLIB00017223139","spectrum_index":8832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 662.4451 Da; putative annotation: N/A; putative formula: C37H58N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1197.72,"smiles":null,"spectrum_id":"CCMSLIB00017223141","spectrum_index":8833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 208.1209 Da; putative annotation: N/A; putative formula: C11H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.186,"smiles":null,"spectrum_id":"CCMSLIB00017223143","spectrum_index":8834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 106.0623 Da; putative annotation: N/A; putative formula: H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.305,"smiles":null,"spectrum_id":"CCMSLIB00017223145","spectrum_index":8835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 667.5334 Da; putative annotation: N/A; putative formula: C39H77N3O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":962.76,"smiles":null,"spectrum_id":"CCMSLIB00017223147","spectrum_index":8836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 114.0689 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.156,"smiles":null,"spectrum_id":"CCMSLIB00017223148","spectrum_index":8837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-ol (delta mass: 72.021 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.222,"smiles":null,"spectrum_id":"CCMSLIB00017223151","spectrum_index":8838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z-octadecadienoic acid (delta mass: 670.5576 Da; putative annotation: N/A; putative formula: C41H82S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":965.784,"smiles":null,"spectrum_id":"CCMSLIB00017223153","spectrum_index":8839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 58.042 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.321,"smiles":null,"spectrum_id":"CCMSLIB00017223154","spectrum_index":8840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 49.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.332,"smiles":null,"spectrum_id":"CCMSLIB00017223157","spectrum_index":8841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Cyclohexanecarbonylpentadecylamine from NIST14 (delta mass: 59.0367 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.378,"smiles":null,"spectrum_id":"CCMSLIB00017223159","spectrum_index":8842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 40.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.159,"smiles":null,"spectrum_id":"CCMSLIB00017223160","spectrum_index":8843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.,12.alpha.-Dihydroxy-5.beta.-cholestan-3-one (delta mass: 178.108 Da; putative annotation: N/A; putative formula: C6H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.46,"smiles":null,"spectrum_id":"CCMSLIB00017223162","spectrum_index":8844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heptanoic acid (delta mass: 9.9841 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.091,"smiles":null,"spectrum_id":"CCMSLIB00017223165","spectrum_index":8845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-quinolin-4-yl(5-vinylquinuclidin-2-yl)methanol (delta mass: 246.0988 Da; putative annotation: N/A; putative formula: C7H15N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.279,"smiles":null,"spectrum_id":"CCMSLIB00017223166","spectrum_index":8846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 81.0789 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.133,"smiles":null,"spectrum_id":"CCMSLIB00017223168","spectrum_index":8847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 76.0678 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017223171","spectrum_index":8848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)propane-1,2-diol (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017223172","spectrum_index":8849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mandelic acid (delta mass: 37.9784 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.033,"smiles":null,"spectrum_id":"CCMSLIB00017223173","spectrum_index":8850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Arachidonoyl-L-serine (delta mass: 154.0033 Da; putative annotation: N/A; putative formula: C3H7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.283,"smiles":null,"spectrum_id":"CCMSLIB00017223177","spectrum_index":8851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 12.0362 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.143,"smiles":null,"spectrum_id":"CCMSLIB00017223178","spectrum_index":8852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 101.0472 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.113,"smiles":null,"spectrum_id":"CCMSLIB00017223179","spectrum_index":8853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (delta mass: 386.1212 Da; putative annotation: N/A; putative formula: C17H22O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.265,"smiles":null,"spectrum_id":"CCMSLIB00017223182","spectrum_index":8854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epigallocatechin gallate (delta mass: 152.0109 Da; putative annotation: N/A; putative formula: C7H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.103,"smiles":null,"spectrum_id":"CCMSLIB00017223184","spectrum_index":8855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Methylpentadecanoic acid (delta mass: 41.8625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.11,"smiles":null,"spectrum_id":"CCMSLIB00017223185","spectrum_index":8856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 211.158 Da; putative annotation: N/A; putative formula: C12H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.202,"smiles":null,"spectrum_id":"CCMSLIB00017223187","spectrum_index":8857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.108,"smiles":null,"spectrum_id":"CCMSLIB00017223190","spectrum_index":8858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 200.1564 Da; putative annotation: N/A; putative formula: C15H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.227,"smiles":null,"spectrum_id":"CCMSLIB00017223191","spectrum_index":8859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 81.057 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.169,"smiles":null,"spectrum_id":"CCMSLIB00017223193","spectrum_index":8860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 17.1196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.289,"smiles":null,"spectrum_id":"CCMSLIB00017223196","spectrum_index":8861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 255.147 Da; putative annotation: N/A; putative formula: C13H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.249,"smiles":null,"spectrum_id":"CCMSLIB00017223197","spectrum_index":8862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 280.2844 Da; putative annotation: N/A; putative formula: C18H36N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.371,"smiles":null,"spectrum_id":"CCMSLIB00017223199","spectrum_index":8863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 50.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017223202","spectrum_index":8864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 104.0976 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.203,"smiles":null,"spectrum_id":"CCMSLIB00017223203","spectrum_index":8865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Virginiaebutanolide C (delta mass: 62.0523 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.196,"smiles":null,"spectrum_id":"CCMSLIB00017223205","spectrum_index":8866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 32.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017223207","spectrum_index":8867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Chlro-1-tetrahydronorharmanone CollisionEnergy:102040 (delta mass: 426.1627 Da; putative annotation: N/A; putative formula: C24H22N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.21,"smiles":null,"spectrum_id":"CCMSLIB00017223208","spectrum_index":8868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 115.1009 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.255,"smiles":null,"spectrum_id":"CCMSLIB00017223210","spectrum_index":8869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 224.1075 Da; putative annotation: N/A; putative formula: C11H17N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.172,"smiles":null,"spectrum_id":"CCMSLIB00017223212","spectrum_index":8870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 156.0338 Da; putative annotation: N/A; putative formula: C7H9O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.109,"smiles":null,"spectrum_id":"CCMSLIB00017223213","spectrum_index":8871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylene glycol monomethyl ether (delta mass: 62.016 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017223215","spectrum_index":8872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 45.0211 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.071,"smiles":null,"spectrum_id":"CCMSLIB00017223218","spectrum_index":8873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_prop_2_en_1_yl__1H_indole_3_carboxylic_acid (delta mass: 28.005 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.091,"smiles":null,"spectrum_id":"CCMSLIB00017223219","spectrum_index":8874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 35.9492 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.989,"smiles":null,"spectrum_id":"CCMSLIB00017223220","spectrum_index":8875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Syringic acid from NIST14 (delta mass: 28.6303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.69,"smiles":null,"spectrum_id":"CCMSLIB00017223222","spectrum_index":8876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 246.1628 Da; putative annotation: N/A; putative formula: C16H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.259,"smiles":null,"spectrum_id":"CCMSLIB00017223225","spectrum_index":8877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eicosapentaenoyl ethanolamide (delta mass: 84.0198 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.294,"smiles":null,"spectrum_id":"CCMSLIB00017223226","spectrum_index":8878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 526.0947 Da; putative annotation: N/A; putative formula: C27H18N4O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.134,"smiles":null,"spectrum_id":"CCMSLIB00017223228","spectrum_index":8879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 277.1534 Da; putative annotation: N/A; putative formula: C13H27NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.266,"smiles":null,"spectrum_id":"CCMSLIB00017223231","spectrum_index":8880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 138.1345 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.314,"smiles":null,"spectrum_id":"CCMSLIB00017223232","spectrum_index":8881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 76.0999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.154,"smiles":null,"spectrum_id":"CCMSLIB00017223234","spectrum_index":8882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 1072.5424 Da; putative annotation: N/A; putative formula: C63H84N4O3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1253.61,"smiles":null,"spectrum_id":"CCMSLIB00017223237","spectrum_index":8883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 195.0889 Da; putative annotation: N/A; putative formula: C10H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.159,"smiles":null,"spectrum_id":"CCMSLIB00017223239","spectrum_index":8884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 15-OxoEDE from NIST14 (delta mass: 179.0791 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.337,"smiles":null,"spectrum_id":"CCMSLIB00017223240","spectrum_index":8885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1043.3527 Da; putative annotation: N/A; putative formula: C57H61N3O10S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1206.41,"smiles":null,"spectrum_id":"CCMSLIB00017223242","spectrum_index":8886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 118.0827 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.32,"smiles":null,"spectrum_id":"CCMSLIB00017223245","spectrum_index":8887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Hyodeoxycholic acid (delta mass: 52.0329 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.333,"smiles":null,"spectrum_id":"CCMSLIB00017223247","spectrum_index":8888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 312.1799 Da; putative annotation: N/A; putative formula: C14H24N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.24,"smiles":null,"spectrum_id":"CCMSLIB00017223248","spectrum_index":8889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [6,10a-Dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl-9-oxo-1,2,3,4a,5,6,6a,7,11,11a-decahydronaphtho[2,1-f][1]benzofuran-5-yl] acetate (delta mass: 88.0685 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.291,"smiles":null,"spectrum_id":"CCMSLIB00017223249","spectrum_index":8890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 12.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":122.097,"smiles":null,"spectrum_id":"CCMSLIB00017223252","spectrum_index":8891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 230.0792 Da; putative annotation: N/A; putative formula: C10H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.134,"smiles":null,"spectrum_id":"CCMSLIB00017223254","spectrum_index":8892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU278502 1-(3-carboxypropyl)-3,7-dimethylxanthine|4-(3,7-dimethyl-2,6-dioxopurin-1-yl)butanoic acid (delta mass: 14.0151 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.124,"smiles":null,"spectrum_id":"CCMSLIB00017223255","spectrum_index":8893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 102.008 Da; putative annotation: N/A; putative formula: C3H-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.104,"smiles":null,"spectrum_id":"CCMSLIB00017223257","spectrum_index":8894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 345.3239 Da; putative annotation: N/A; putative formula: C21H39N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.535,"smiles":null,"spectrum_id":"CCMSLIB00017223260","spectrum_index":8895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 27.9843 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.129,"smiles":null,"spectrum_id":"CCMSLIB00017223261","spectrum_index":8896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 92.1351 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.351,"smiles":null,"spectrum_id":"CCMSLIB00017223263","spectrum_index":8897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (Z,E)-Tetradeca-9,12-dienol from NIST14 (delta mass: 46.006 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.212,"smiles":null,"spectrum_id":"CCMSLIB00017223266","spectrum_index":8898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 69.0579 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.165,"smiles":null,"spectrum_id":"CCMSLIB00017223267","spectrum_index":8899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 264.2455 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.358,"smiles":null,"spectrum_id":"CCMSLIB00017223269","spectrum_index":8900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 224.7774 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.837,"smiles":null,"spectrum_id":"CCMSLIB00017223272","spectrum_index":8901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 423.1227 Da; putative annotation: N/A; putative formula: C26H21N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.308,"smiles":null,"spectrum_id":"CCMSLIB00017223273","spectrum_index":8902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 192.0269 Da; putative annotation: N/A; putative formula: C6H8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.28,"smiles":null,"spectrum_id":"CCMSLIB00017223274","spectrum_index":8903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 221.0686 Da; putative annotation: N/A; putative formula: C11H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.134,"smiles":null,"spectrum_id":"CCMSLIB00017223277","spectrum_index":8904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylpiperazine (delta mass: 70.8989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.022,"smiles":null,"spectrum_id":"CCMSLIB00017223278","spectrum_index":8905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 138.0843 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.452,"smiles":null,"spectrum_id":"CCMSLIB00017223279","spectrum_index":8906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 162.1419 Da; putative annotation: N/A; putative formula: C12H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.353,"smiles":null,"spectrum_id":"CCMSLIB00017223283","spectrum_index":8907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 130.1155 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.353,"smiles":null,"spectrum_id":"CCMSLIB00017223284","spectrum_index":8908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethyl-4-hydroxybenzaldehyde (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.101,"smiles":null,"spectrum_id":"CCMSLIB00017223285","spectrum_index":8909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 41.8787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.985,"smiles":null,"spectrum_id":"CCMSLIB00017223288","spectrum_index":8910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 95.9743 Da; putative annotation: N/A; putative formula: C4HOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.05,"smiles":null,"spectrum_id":"CCMSLIB00017223289","spectrum_index":8911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 169.1189 Da; putative annotation: N/A; putative formula: C4H11N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.217,"smiles":null,"spectrum_id":"CCMSLIB00017223291","spectrum_index":8912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxy-16-methoxyoctadeca-9,12-dienoic acid (delta mass: 318.2573 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.51,"smiles":null,"spectrum_id":"CCMSLIB00017223294","spectrum_index":8913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-3-carboxylic acid (delta mass: 138.0351 Da; putative annotation: N/A; putative formula: C6H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.069,"smiles":null,"spectrum_id":"CCMSLIB00017223295","spectrum_index":8914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (((3a,7a)-3,7-trihydroxy-24-oxocholan-22-en-24-yl)amino)ethanesulfonic acid (delta mass: 116.1014 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.39,"smiles":null,"spectrum_id":"CCMSLIB00017223296","spectrum_index":8915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 35.0364 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.268,"smiles":null,"spectrum_id":"CCMSLIB00017223300","spectrum_index":8916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(S)-Hydroxy-16-heptadecynoic acid (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.253,"smiles":null,"spectrum_id":"CCMSLIB00017223301","spectrum_index":8917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 393.1356 Da; putative annotation: N/A; putative formula: C20H20N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.29,"smiles":null,"spectrum_id":"CCMSLIB00017223302","spectrum_index":8918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminobenzoic acid - 30.0 eV (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017223304","spectrum_index":8919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,6-Tetrahydrobenzylalcohol (delta mass: 77.0482 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.144,"smiles":null,"spectrum_id":"CCMSLIB00017223307","spectrum_index":8920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 212.1047 Da; putative annotation: N/A; putative formula: C11H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017223308","spectrum_index":8921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 34.0053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.253,"smiles":null,"spectrum_id":"CCMSLIB00017223309","spectrum_index":8922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 78.032 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.092,"smiles":null,"spectrum_id":"CCMSLIB00017223312","spectrum_index":8923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 79.0663 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.17,"smiles":null,"spectrum_id":"CCMSLIB00017223314","spectrum_index":8924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 130.0267 Da; putative annotation: N/A; putative formula: C5H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.097,"smiles":null,"spectrum_id":"CCMSLIB00017223315","spectrum_index":8925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 159.0897 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.192,"smiles":null,"spectrum_id":"CCMSLIB00017223317","spectrum_index":8926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 169.2041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.28,"smiles":null,"spectrum_id":"CCMSLIB00017223320","spectrum_index":8927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 284.1262 Da; putative annotation: N/A; putative formula: C14H20O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.342,"smiles":null,"spectrum_id":"CCMSLIB00017223321","spectrum_index":8928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 142.0785 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.212,"smiles":null,"spectrum_id":"CCMSLIB00017223323","spectrum_index":8929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl syringate (delta mass: 162.0486 Da; putative annotation: N/A; putative formula: C4H11N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.14,"smiles":null,"spectrum_id":"CCMSLIB00017223325","spectrum_index":8930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 28.0321 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.17,"smiles":null,"spectrum_id":"CCMSLIB00017223327","spectrum_index":8931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 832.3327 Da; putative annotation: N/A; putative formula: C39H48N10O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1091.45,"smiles":null,"spectrum_id":"CCMSLIB00017223328","spectrum_index":8932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 118.0268 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.17,"smiles":null,"spectrum_id":"CCMSLIB00017223332","spectrum_index":8933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Thiophen-2-yl)piperazin-2-one (delta mass: 26.9813 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.04,"smiles":null,"spectrum_id":"CCMSLIB00017223333","spectrum_index":8934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 52.9766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.068,"smiles":null,"spectrum_id":"CCMSLIB00017223335","spectrum_index":8935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 184.121 Da; putative annotation: N/A; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.276,"smiles":null,"spectrum_id":"CCMSLIB00017223337","spectrum_index":8936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 69.0453 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.112,"smiles":null,"spectrum_id":"CCMSLIB00017223338","spectrum_index":8937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 509.3439 Da; putative annotation: N/A; putative formula: C31H47N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1005.68,"smiles":null,"spectrum_id":"CCMSLIB00017223339","spectrum_index":8938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 392.2039 Da; putative annotation: N/A; putative formula: C23H28N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.28,"smiles":null,"spectrum_id":"CCMSLIB00017223343","spectrum_index":8939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.18,"smiles":null,"spectrum_id":"CCMSLIB00017223344","spectrum_index":8940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 226.1183 Da; putative annotation: N/A; putative formula: C16H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.34,"smiles":null,"spectrum_id":"CCMSLIB00017223345","spectrum_index":8941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 88.9489 Da; putative annotation: N/A; putative formula: CNPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.035,"smiles":null,"spectrum_id":"CCMSLIB00017223346","spectrum_index":8942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-6-carboxaldehyde (delta mass: 63.0082 Da; putative annotation: N/A; putative formula: C4HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.068,"smiles":null,"spectrum_id":"CCMSLIB00017223350","spectrum_index":8943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 120.0573 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.117,"smiles":null,"spectrum_id":"CCMSLIB00017223351","spectrum_index":8944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 309.1908 Da; putative annotation: N/A; putative formula: C13H23N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.308,"smiles":null,"spectrum_id":"CCMSLIB00017223352","spectrum_index":8945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 38.0154 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.227,"smiles":null,"spectrum_id":"CCMSLIB00017223356","spectrum_index":8946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 104.1007 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.333,"smiles":null,"spectrum_id":"CCMSLIB00017223357","spectrum_index":8947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 192.5729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.644,"smiles":null,"spectrum_id":"CCMSLIB00017223358","spectrum_index":8948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 71.0991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.158,"smiles":null,"spectrum_id":"CCMSLIB00017223360","spectrum_index":8949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Poliumoside (delta mass: 478.1514 Da; putative annotation: N/A; putative formula: C21H34O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1249.42,"smiles":null,"spectrum_id":"CCMSLIB00017223363","spectrum_index":8950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 9.9845 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.034,"smiles":null,"spectrum_id":"CCMSLIB00017223364","spectrum_index":8951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 153.1163 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.24,"smiles":null,"spectrum_id":"CCMSLIB00017223366","spectrum_index":8952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 424.1457 Da; putative annotation: N/A; putative formula: C23H24N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.187,"smiles":null,"spectrum_id":"CCMSLIB00017223368","spectrum_index":8953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 27.9989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.231,"smiles":null,"spectrum_id":"CCMSLIB00017223369","spectrum_index":8954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 135.1061 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.192,"smiles":null,"spectrum_id":"CCMSLIB00017223372","spectrum_index":8955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 41.0629 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017223374","spectrum_index":8956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole; AIF; CE0; MS2Dec (delta mass: 32.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.087,"smiles":null,"spectrum_id":"CCMSLIB00017223375","spectrum_index":8957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU211802 Nordeprenyl|Desmethylselegiline|1-phenyl-N-prop-2-ynylpropan-2-amine (delta mass: 357.3043 Da; putative annotation: N/A; putative formula: C17H39N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.432,"smiles":null,"spectrum_id":"CCMSLIB00017223377","spectrum_index":8958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.305,"smiles":null,"spectrum_id":"CCMSLIB00017223380","spectrum_index":8959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 18.0119 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.27,"smiles":null,"spectrum_id":"CCMSLIB00017223381","spectrum_index":8960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 176.0813 Da; putative annotation: N/A; putative formula: C11H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.334,"smiles":null,"spectrum_id":"CCMSLIB00017223383","spectrum_index":8961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.102,"smiles":null,"spectrum_id":"CCMSLIB00017223386","spectrum_index":8962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 142.0998 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.165,"smiles":null,"spectrum_id":"CCMSLIB00017223387","spectrum_index":8963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 287.2831 Da; putative annotation: N/A; putative formula: C13H33N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.364,"smiles":null,"spectrum_id":"CCMSLIB00017223389","spectrum_index":8964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE10; MS2Dec (delta mass: 24.0363 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.102,"smiles":null,"spectrum_id":"CCMSLIB00017223390","spectrum_index":8965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 28.9981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.1,"smiles":null,"spectrum_id":"CCMSLIB00017223393","spectrum_index":8966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00178646-02!2,4-dihydroxyheptadecyl acetate [IIN-based: Match] (delta mass: 157.1111 Da; putative annotation: N/A; putative formula: C8H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.395,"smiles":null,"spectrum_id":"CCMSLIB00017223395","spectrum_index":8967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 127.0271 Da; putative annotation: N/A; putative formula: C5H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.124,"smiles":null,"spectrum_id":"CCMSLIB00017223396","spectrum_index":8968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 102.084 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.306,"smiles":null,"spectrum_id":"CCMSLIB00017223400","spectrum_index":8969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 96.0212 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017223401","spectrum_index":8970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin - 30.0 eV (delta mass: 299.043 Da; putative annotation: N/A; putative formula: C15H9NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.138,"smiles":null,"spectrum_id":"CCMSLIB00017223402","spectrum_index":8971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-Hydroxybenzaldehyde from NIST14 (delta mass: 62.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017223405","spectrum_index":8972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-5,8a-dimethyl-3-methylidene-3a,4,4a,8,9,9a-hexahydrobenzo[f][1]benzofuran-2,7-dione (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017223407","spectrum_index":8973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 396.1528 Da; putative annotation: N/A; putative formula: C20H29O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.233,"smiles":null,"spectrum_id":"CCMSLIB00017223408","spectrum_index":8974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 219.0999 Da; putative annotation: N/A; putative formula: C11H13N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.197,"smiles":null,"spectrum_id":"CCMSLIB00017223410","spectrum_index":8975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 264.0779 Da; putative annotation: N/A; putative formula: C9H16N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.216,"smiles":null,"spectrum_id":"CCMSLIB00017223413","spectrum_index":8976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 155.1163 Da; putative annotation: N/A; putative formula: C6H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.327,"smiles":null,"spectrum_id":"CCMSLIB00017223414","spectrum_index":8977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 227.0234 Da; putative annotation: N/A; putative formula: C9H9NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.095,"smiles":null,"spectrum_id":"CCMSLIB00017223416","spectrum_index":8978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Coniine (delta mass: 563.395 Da; putative annotation: N/A; putative formula: C29H58NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.538,"smiles":null,"spectrum_id":"CCMSLIB00017223418","spectrum_index":8979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 60.3333 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.441,"smiles":null,"spectrum_id":"CCMSLIB00017223419","spectrum_index":8980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11(12)-Epoxy-5Z,8Z,14Z-eicosatrienoic acid (delta mass: 103.0261 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.268,"smiles":null,"spectrum_id":"CCMSLIB00017223421","spectrum_index":8981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 34.0243 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.246,"smiles":null,"spectrum_id":"CCMSLIB00017223423","spectrum_index":8982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Allyl-4-hydroxy-5-methoxybenzaldehyde (delta mass: 244.0712 Da; putative annotation: N/A; putative formula: C18H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.157,"smiles":null,"spectrum_id":"CCMSLIB00017223425","spectrum_index":8983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 336.0324 Da; putative annotation: N/A; putative formula: C11H12O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":807.379,"smiles":null,"spectrum_id":"CCMSLIB00017223427","spectrum_index":8984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Euscaphic acid (delta mass: 265.0809 Da; putative annotation: N/A; putative formula: C10H11N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.438,"smiles":null,"spectrum_id":"CCMSLIB00017223429","spectrum_index":8985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 606.0857 Da; putative annotation: N/A; putative formula: C26H22O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.146,"smiles":null,"spectrum_id":"CCMSLIB00017223431","spectrum_index":8986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 687.3117 Da; putative annotation: N/A; putative formula: C33H45N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.372,"smiles":null,"spectrum_id":"CCMSLIB00017223433","spectrum_index":8987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12-Ketodeoxycholic acid from NIST14 (delta mass: 15.9978 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.282,"smiles":null,"spectrum_id":"CCMSLIB00017223435","spectrum_index":8988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 97.0753 Da; putative annotation: N/A; putative formula: C3H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.188,"smiles":null,"spectrum_id":"CCMSLIB00017223437","spectrum_index":8989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101901 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 175.044 Da; putative annotation: N/A; putative formula: C4H10N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.13,"smiles":null,"spectrum_id":"CCMSLIB00017223440","spectrum_index":8990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Noretiocholanolone (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.299,"smiles":null,"spectrum_id":"CCMSLIB00017223442","spectrum_index":8991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dihydroxy-5Z,8Z,14Z-eicosatrienoic acid (delta mass: 36.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.274,"smiles":null,"spectrum_id":"CCMSLIB00017223443","spectrum_index":8992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 53.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017223445","spectrum_index":8993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 122.0725 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.279,"smiles":null,"spectrum_id":"CCMSLIB00017223448","spectrum_index":8994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 79.9564 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.22,"smiles":null,"spectrum_id":"CCMSLIB00017223449","spectrum_index":8995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 58.0424 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.085,"smiles":null,"spectrum_id":"CCMSLIB00017223450","spectrum_index":8996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 92.0809 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.161,"smiles":null,"spectrum_id":"CCMSLIB00017223454","spectrum_index":8997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU278502 1-(3-carboxypropyl)-3,7-dimethylxanthine|4-(3,7-dimethyl-2,6-dioxopurin-1-yl)butanoic acid (delta mass: 14.0873 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.196,"smiles":null,"spectrum_id":"CCMSLIB00017223455","spectrum_index":8998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 114.0324 Da; putative annotation: N/A; putative formula: C6H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.145,"smiles":null,"spectrum_id":"CCMSLIB00017223456","spectrum_index":8999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroferulic acid (delta mass: 73.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.17,"smiles":null,"spectrum_id":"CCMSLIB00017223457","spectrum_index":9000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 129.0422 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017223461","spectrum_index":9001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 41.0625 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.211,"smiles":null,"spectrum_id":"CCMSLIB00017223462","spectrum_index":9002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 539.7101 Da; putative annotation: N/A; putative formula: C7H12P4S10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.791,"smiles":null,"spectrum_id":"CCMSLIB00017223463","spectrum_index":9003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 14.0849 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.244,"smiles":null,"spectrum_id":"CCMSLIB00017223466","spectrum_index":9004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 17.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.41,"smiles":null,"spectrum_id":"CCMSLIB00017223468","spectrum_index":9005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,9a,9b-octahydrobenzo[g][1]benzofuran-2-one (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017223469","spectrum_index":9006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 94.0781 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017223471","spectrum_index":9007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 144.09 Da; putative annotation: N/A; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.177,"smiles":null,"spectrum_id":"CCMSLIB00017223474","spectrum_index":9008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5S)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one (delta mass: 65.0219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.144,"smiles":null,"spectrum_id":"CCMSLIB00017223475","spectrum_index":9009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 87.0299 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.105,"smiles":null,"spectrum_id":"CCMSLIB00017223477","spectrum_index":9010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 459.2744 Da; putative annotation: N/A; putative formula: C26H41N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.522,"smiles":null,"spectrum_id":"CCMSLIB00017223480","spectrum_index":9011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 89.0829 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.143,"smiles":null,"spectrum_id":"CCMSLIB00017223482","spectrum_index":9012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 304.2036 Da; putative annotation: N/A; putative formula: C19H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.415,"smiles":null,"spectrum_id":"CCMSLIB00017223483","spectrum_index":9013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 312.2282 Da; putative annotation: N/A; putative formula: C22H32O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.568,"smiles":null,"spectrum_id":"CCMSLIB00017223484","spectrum_index":9014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[5-[(3Z,6Z)-2,12-Dihydroxydodeca-3,6-dienyl]oxolan-2-yl]acetic acid (delta mass: 66.0098 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.226,"smiles":null,"spectrum_id":"CCMSLIB00017223488","spectrum_index":9015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 258.0853 Da; putative annotation: N/A; putative formula: C10H14N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.167,"smiles":null,"spectrum_id":"CCMSLIB00017223489","spectrum_index":9016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 118.0587 Da; putative annotation: N/A; putative formula: CH6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.13,"smiles":null,"spectrum_id":"CCMSLIB00017223490","spectrum_index":9017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenylethylamine (delta mass: 75.0191 Da; putative annotation: N/A; putative formula: C4HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.137,"smiles":null,"spectrum_id":"CCMSLIB00017223492","spectrum_index":9018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 70.0409 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.226,"smiles":null,"spectrum_id":"CCMSLIB00017223495","spectrum_index":9019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 73.0164 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.076,"smiles":null,"spectrum_id":"CCMSLIB00017223496","spectrum_index":9020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-hydroxy-1,7-diphenylhept-1-en-3-one (delta mass: 124.0368 Da; putative annotation: N/A; putative formula: N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.19,"smiles":null,"spectrum_id":"CCMSLIB00017223498","spectrum_index":9021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrotachysterol (delta mass: 144.0959 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.458,"smiles":null,"spectrum_id":"CCMSLIB00017223501","spectrum_index":9022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 87.0314 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.112,"smiles":null,"spectrum_id":"CCMSLIB00017223502","spectrum_index":9023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,17-Dihydroxy-4-methylsarpaganium cation (delta mass: 35.0465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.238,"smiles":null,"spectrum_id":"CCMSLIB00017223504","spectrum_index":9024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-15-Tetracosenoic acid (delta mass: 1286.9066 Da; putative annotation: N/A; putative formula: C68H126N4O18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1654.26,"smiles":null,"spectrum_id":"CCMSLIB00017223507","spectrum_index":9025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 74.9932 Da; putative annotation: N/A; putative formula: CHNO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.069,"smiles":null,"spectrum_id":"CCMSLIB00017223508","spectrum_index":9026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-hydroxybenzoic acid CollisionEnergy:102040 (delta mass: 28.0314 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017223510","spectrum_index":9027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 316.2039 Da; putative annotation: N/A; putative formula: C20H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":909.48,"smiles":null,"spectrum_id":"CCMSLIB00017223513","spectrum_index":9028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 106.0787 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.28,"smiles":null,"spectrum_id":"CCMSLIB00017223515","spectrum_index":9029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Testosterone (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.268,"smiles":null,"spectrum_id":"CCMSLIB00017223517","spectrum_index":9030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 74.0525 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.316,"smiles":null,"spectrum_id":"CCMSLIB00017223519","spectrum_index":9031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 250.0848 Da; putative annotation: N/A; putative formula: C6H14N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.134,"smiles":null,"spectrum_id":"CCMSLIB00017223520","spectrum_index":9032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmaline (delta mass: 176.0387 Da; putative annotation: N/A; putative formula: C10H9OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.157,"smiles":null,"spectrum_id":"CCMSLIB00017223524","spectrum_index":9033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 137.0783 Da; putative annotation: N/A; putative formula: C8H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.15,"smiles":null,"spectrum_id":"CCMSLIB00017223525","spectrum_index":9034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 60.0038 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.101,"smiles":null,"spectrum_id":"CCMSLIB00017223526","spectrum_index":9035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Icaridin (delta mass: 78.0441 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.219,"smiles":null,"spectrum_id":"CCMSLIB00017223528","spectrum_index":9036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 178.0911 Da; putative annotation: N/A; putative formula: C11H15P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.23,"smiles":null,"spectrum_id":"CCMSLIB00017223531","spectrum_index":9037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 112.1615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.206,"smiles":null,"spectrum_id":"CCMSLIB00017223532","spectrum_index":9038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 53.0472 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.128,"smiles":null,"spectrum_id":"CCMSLIB00017223534","spectrum_index":9039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 345.1273 Da; putative annotation: N/A; putative formula: C14H24N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.224,"smiles":null,"spectrum_id":"CCMSLIB00017223537","spectrum_index":9040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 170.1055 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.26,"smiles":null,"spectrum_id":"CCMSLIB00017223538","spectrum_index":9041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 9.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.159,"smiles":null,"spectrum_id":"CCMSLIB00017223540","spectrum_index":9042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 54.0311 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.263,"smiles":null,"spectrum_id":"CCMSLIB00017223543","spectrum_index":9043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 4.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.191,"smiles":null,"spectrum_id":"CCMSLIB00017223545","spectrum_index":9044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 106.0768 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.34,"smiles":null,"spectrum_id":"CCMSLIB00017223546","spectrum_index":9045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylphenethylamide (delta mass: 16.9765 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.083,"smiles":null,"spectrum_id":"CCMSLIB00017223548","spectrum_index":9046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zymosterol (delta mass: 270.2573 Da; putative annotation: N/A; putative formula: C17H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.604,"smiles":null,"spectrum_id":"CCMSLIB00017223550","spectrum_index":9047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Cholesterol from NIST14 (delta mass: 316.2041 Da; putative annotation: N/A; putative formula: C20H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.566,"smiles":null,"spectrum_id":"CCMSLIB00017223552","spectrum_index":9048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 126.1057 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.171,"smiles":null,"spectrum_id":"CCMSLIB00017223553","spectrum_index":9049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxy-5Z,8Z,12E,14Z,17Z-eicosapentaenoic acid (delta mass: 88.0675 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.294,"smiles":null,"spectrum_id":"CCMSLIB00017223556","spectrum_index":9050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 13.0316 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.087,"smiles":null,"spectrum_id":"CCMSLIB00017223557","spectrum_index":9051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 224.1775 Da; putative annotation: N/A; putative formula: C14H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.436,"smiles":null,"spectrum_id":"CCMSLIB00017223558","spectrum_index":9052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 355.308 Da; putative annotation: N/A; putative formula: C21H41NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.555,"smiles":null,"spectrum_id":"CCMSLIB00017223561","spectrum_index":9053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 86.0513 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.424,"smiles":null,"spectrum_id":"CCMSLIB00017223563","spectrum_index":9054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-4(Z),7(Z),10(Z),13(Z),15(E),19(Z)-docosahexaenoic acid (delta mass: 31.9896 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.216,"smiles":null,"spectrum_id":"CCMSLIB00017223564","spectrum_index":9055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 770.0646 Da; putative annotation: N/A; putative formula: C32H26N4O13S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1080.18,"smiles":null,"spectrum_id":"CCMSLIB00017223567","spectrum_index":9056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apomorphine (delta mass: 41.0493 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.182,"smiles":null,"spectrum_id":"CCMSLIB00017223568","spectrum_index":9057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 298.2511 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.483,"smiles":null,"spectrum_id":"CCMSLIB00017223569","spectrum_index":9058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of uridine (delta mass: 373.193 Da; putative annotation: N/A; putative formula: C18H33NO3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.27,"smiles":null,"spectrum_id":"CCMSLIB00017223571","spectrum_index":9059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 16.7084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.015,"smiles":null,"spectrum_id":"CCMSLIB00017223574","spectrum_index":9060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 146.0726 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.242,"smiles":null,"spectrum_id":"CCMSLIB00017223576","spectrum_index":9061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 393.2454 Da; putative annotation: N/A; putative formula: C29H31N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.28,"smiles":null,"spectrum_id":"CCMSLIB00017223577","spectrum_index":9062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 155.0829 Da; putative annotation: N/A; putative formula: C10H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.19,"smiles":null,"spectrum_id":"CCMSLIB00017223579","spectrum_index":9063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 286.0683 Da; putative annotation: N/A; putative formula: C12H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.197,"smiles":null,"spectrum_id":"CCMSLIB00017223582","spectrum_index":9064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Nitrophenyl N-acetyl-alpha-galactosaminide CollisionEnergy:102040 (delta mass: 418.2278 Da; putative annotation: N/A; putative formula: C24H35O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.341,"smiles":null,"spectrum_id":"CCMSLIB00017223583","spectrum_index":9065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-cyclohexanecarboxylic acid (delta mass: 50.0154 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017223585","spectrum_index":9066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 59.0363 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.222,"smiles":null,"spectrum_id":"CCMSLIB00017223588","spectrum_index":9067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 5.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.071,"smiles":null,"spectrum_id":"CCMSLIB00017223589","spectrum_index":9068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dimyristoyl-sn-glycero-3-phosphoethanolamine (delta mass: 82.0813 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.541,"smiles":null,"spectrum_id":"CCMSLIB00017223590","spectrum_index":9069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 290.1271 Da; putative annotation: N/A; putative formula: C15H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.224,"smiles":null,"spectrum_id":"CCMSLIB00017223592","spectrum_index":9070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 565.3095 Da; putative annotation: N/A; putative formula: C39H39N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.526,"smiles":null,"spectrum_id":"CCMSLIB00017223595","spectrum_index":9071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15(S)-15-Methylprostaglandin F2.alpha. isopropyl ester (delta mass: 118.0767 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.387,"smiles":null,"spectrum_id":"CCMSLIB00017223597","spectrum_index":9072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 346.2707 Da; putative annotation: N/A; putative formula: C16H30N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.524,"smiles":null,"spectrum_id":"CCMSLIB00017223598","spectrum_index":9073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 229.1098 Da; putative annotation: N/A; putative formula: C14H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.279,"smiles":null,"spectrum_id":"CCMSLIB00017223601","spectrum_index":9074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 46.0051 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.107,"smiles":null,"spectrum_id":"CCMSLIB00017223603","spectrum_index":9075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Traumatic acid (delta mass: 61.9462 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.09,"smiles":null,"spectrum_id":"CCMSLIB00017223604","spectrum_index":9076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxymitragynine (delta mass: 380.176 Da; putative annotation: N/A; putative formula: C21H25N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.399,"smiles":null,"spectrum_id":"CCMSLIB00017223606","spectrum_index":9077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chloromonilinic acid B (delta mass: 18.0005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.043,"smiles":null,"spectrum_id":"CCMSLIB00017223609","spectrum_index":9078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 499.3872 Da; putative annotation: N/A; putative formula: C28H53NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.52,"smiles":null,"spectrum_id":"CCMSLIB00017223610","spectrum_index":9079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 298.1485 Da; putative annotation: N/A; putative formula: C19H23OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.302,"smiles":null,"spectrum_id":"CCMSLIB00017223612","spectrum_index":9080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 200.0322 Da; putative annotation: N/A; putative formula: C8H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.103,"smiles":null,"spectrum_id":"CCMSLIB00017223615","spectrum_index":9081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(6aR,9R,10aR)-9-(methylsulfanylmethyl)-7-propyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline\"\" (delta mass: 79.0697 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.259,"smiles":null,"spectrum_id":"CCMSLIB00017223617","spectrum_index":9082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 41.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.114,"smiles":null,"spectrum_id":"CCMSLIB00017223618","spectrum_index":9083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 50.0 eV (delta mass: 573.2996 Da; putative annotation: N/A; putative formula: C30H47N5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":735.391,"smiles":null,"spectrum_id":"CCMSLIB00017223621","spectrum_index":9084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 467.3865 Da; putative annotation: N/A; putative formula: C30H49N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.478,"smiles":null,"spectrum_id":"CCMSLIB00017223622","spectrum_index":9085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 324.1114 Da; putative annotation: N/A; putative formula: C13H13N10O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.255,"smiles":null,"spectrum_id":"CCMSLIB00017223624","spectrum_index":9086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 256.24 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.316,"smiles":null,"spectrum_id":"CCMSLIB00017223627","spectrum_index":9087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-3-pentanol (delta mass: 27.0466 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":130.158,"smiles":null,"spectrum_id":"CCMSLIB00017223628","spectrum_index":9088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 284.2356 Da; putative annotation: N/A; putative formula: C17H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.322,"smiles":null,"spectrum_id":"CCMSLIB00017223630","spectrum_index":9089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 13.0313 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.18,"smiles":null,"spectrum_id":"CCMSLIB00017223632","spectrum_index":9090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinine (delta mass: 266.2666 Da; putative annotation: N/A; putative formula: C17H34N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.458,"smiles":null,"spectrum_id":"CCMSLIB00017223634","spectrum_index":9091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 41.9866 Da; putative annotation: N/A; putative formula: H-2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.166,"smiles":null,"spectrum_id":"CCMSLIB00017223636","spectrum_index":9092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 45.0097 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017223638","spectrum_index":9093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 140.1046 Da; putative annotation: N/A; putative formula: C6H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.207,"smiles":null,"spectrum_id":"CCMSLIB00017223639","spectrum_index":9094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 66.0468 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.295,"smiles":null,"spectrum_id":"CCMSLIB00017223641","spectrum_index":9095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 293.1138 Da; putative annotation: N/A; putative formula: C13H11N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.247,"smiles":null,"spectrum_id":"CCMSLIB00017223643","spectrum_index":9096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrachcinidine (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.206,"smiles":null,"spectrum_id":"CCMSLIB00017223646","spectrum_index":9097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 48.001 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.077,"smiles":null,"spectrum_id":"CCMSLIB00017223647","spectrum_index":9098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"9,10-dihydrojasmonic acid CollisionEnergy:205060\"\" (delta mass: 57.0214 Da; putative annotation: N/A; putative formula: C2H3NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.17,"smiles":null,"spectrum_id":"CCMSLIB00017223649","spectrum_index":9099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 124.0852 Da; putative annotation: N/A; putative formula: C4H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.208,"smiles":null,"spectrum_id":"CCMSLIB00017223652","spectrum_index":9100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 90.0835 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017223653","spectrum_index":9101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017223655","spectrum_index":9102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:102040 (delta mass: 300.8683 Da; putative annotation: N/A; putative formula: C4H5NO3P6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.912,"smiles":null,"spectrum_id":"CCMSLIB00017223658","spectrum_index":9103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 323.4875 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.559,"smiles":null,"spectrum_id":"CCMSLIB00017223659","spectrum_index":9104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 466.7954 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.996,"smiles":null,"spectrum_id":"CCMSLIB00017223661","spectrum_index":9105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 17.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.097,"smiles":null,"spectrum_id":"CCMSLIB00017223664","spectrum_index":9106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 62.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.092,"smiles":null,"spectrum_id":"CCMSLIB00017223666","spectrum_index":9107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 63.9982 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.209,"smiles":null,"spectrum_id":"CCMSLIB00017223667","spectrum_index":9108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,9(11),12,24-tetraen-26-oic acid (delta mass: 78.0315 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.352,"smiles":null,"spectrum_id":"CCMSLIB00017223669","spectrum_index":9109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1H-Benzimidazol-2-ylsulfanyl)furan--2-carbaldehyde (delta mass: 79.957 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.995,"smiles":null,"spectrum_id":"CCMSLIB00017223672","spectrum_index":9110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyisophthalic acid (delta mass: 120.0212 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.05,"smiles":null,"spectrum_id":"CCMSLIB00017223673","spectrum_index":9111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 14.9537 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.013,"smiles":null,"spectrum_id":"CCMSLIB00017223677","spectrum_index":9112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 80.0604 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.287,"smiles":null,"spectrum_id":"CCMSLIB00017223678","spectrum_index":9113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 267.0953 Da; putative annotation: N/A; putative formula: C9H17NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.327,"smiles":null,"spectrum_id":"CCMSLIB00017223679","spectrum_index":9114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 167.1268 Da; putative annotation: N/A; putative formula: C6H13N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.39,"smiles":null,"spectrum_id":"CCMSLIB00017223681","spectrum_index":9115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 303.132 Da; putative annotation: N/A; putative formula: C13H21NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.223,"smiles":null,"spectrum_id":"CCMSLIB00017223684","spectrum_index":9116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 154.1207 Da; putative annotation: N/A; putative formula: C7H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.363,"smiles":null,"spectrum_id":"CCMSLIB00017223685","spectrum_index":9117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 108.0938 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.352,"smiles":null,"spectrum_id":"CCMSLIB00017223687","spectrum_index":9118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 76.0689 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.332,"smiles":null,"spectrum_id":"CCMSLIB00017223690","spectrum_index":9119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 186.009 Da; putative annotation: N/A; putative formula: C8H11O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.116,"smiles":null,"spectrum_id":"CCMSLIB00017223691","spectrum_index":9120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)cyclohexanol (delta mass: 45.0101 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.191,"smiles":null,"spectrum_id":"CCMSLIB00017223693","spectrum_index":9121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C5:0 (delta mass: 86.0366 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.181,"smiles":null,"spectrum_id":"CCMSLIB00017223696","spectrum_index":9122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-4-((3Z)-5-hydroxy-3-methylpent-3-en-1-yl)-4a,8,8-trimethyl-3-methylidenedecahydronaphthalen-2-yl .beta.-D-mannopyranoside (delta mass: 118.078 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.389,"smiles":null,"spectrum_id":"CCMSLIB00017223698","spectrum_index":9123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 86.0318 Da; putative annotation: N/A; putative formula: C3H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.074,"smiles":null,"spectrum_id":"CCMSLIB00017223699","spectrum_index":9124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 75.0566 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.123,"smiles":null,"spectrum_id":"CCMSLIB00017223702","spectrum_index":9125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arachidonoylglycine (delta mass: 124.0721 Da; putative annotation: N/A; putative formula: C8H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.341,"smiles":null,"spectrum_id":"CCMSLIB00017223704","spectrum_index":9126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,16.Xi.)-17-Hydroxykauran-19-oic acid (delta mass: 94.079 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.321,"smiles":null,"spectrum_id":"CCMSLIB00017223705","spectrum_index":9127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Adamantyl)pyrrolidine (delta mass: 166.083 Da; putative annotation: N/A; putative formula: C3H6N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.273,"smiles":null,"spectrum_id":"CCMSLIB00017223708","spectrum_index":9128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 53.5187 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.59,"smiles":null,"spectrum_id":"CCMSLIB00017223709","spectrum_index":9129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3,4,5-Trimethoxycinnamic acid from NIST14 (delta mass: 49.0321 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.124,"smiles":null,"spectrum_id":"CCMSLIB00017223713","spectrum_index":9130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 36.0335 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.13,"smiles":null,"spectrum_id":"CCMSLIB00017223714","spectrum_index":9131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,17-diol, (3.alpha.,5.alpha.,17.beta.)- (delta mass: 50.0526 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.3,"smiles":null,"spectrum_id":"CCMSLIB00017223716","spectrum_index":9132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 329.128 Da; putative annotation: N/A; putative formula: C19H15N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.214,"smiles":null,"spectrum_id":"CCMSLIB00017223719","spectrum_index":9133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 322.1565 Da; putative annotation: N/A; putative formula: C13H26N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.269,"smiles":null,"spectrum_id":"CCMSLIB00017223720","spectrum_index":9134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 226.1012 Da; putative annotation: N/A; putative formula: C8H14N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.177,"smiles":null,"spectrum_id":"CCMSLIB00017223722","spectrum_index":9135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 39.9948 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.06,"smiles":null,"spectrum_id":"CCMSLIB00017223725","spectrum_index":9136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 146.0736 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.41,"smiles":null,"spectrum_id":"CCMSLIB00017223726","spectrum_index":9137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 60.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.258,"smiles":null,"spectrum_id":"CCMSLIB00017223728","spectrum_index":9138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 93.0215 Da; putative annotation: N/A; putative formula: C5H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017223731","spectrum_index":9139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 310.3343 Da; putative annotation: N/A; putative formula: C20H42N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.426,"smiles":null,"spectrum_id":"CCMSLIB00017223733","spectrum_index":9140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Blood Group H Trisaccharide (delta mass: 51.0466 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.255,"smiles":null,"spectrum_id":"CCMSLIB00017223735","spectrum_index":9141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 72.0584 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.337,"smiles":null,"spectrum_id":"CCMSLIB00017223739","spectrum_index":9142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 402.1472 Da; putative annotation: N/A; putative formula: C17H28N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.28,"smiles":null,"spectrum_id":"CCMSLIB00017223740","spectrum_index":9143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 305.141 Da; putative annotation: N/A; putative formula: C12H23N3O4S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.206,"smiles":null,"spectrum_id":"CCMSLIB00017223743","spectrum_index":9144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 105.0137 Da; putative annotation: N/A; putative formula: C6H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.094,"smiles":null,"spectrum_id":"CCMSLIB00017223745","spectrum_index":9145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxycostic acid (delta mass: 74.0508 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.215,"smiles":null,"spectrum_id":"CCMSLIB00017223746","spectrum_index":9146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 129.0422 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.092,"smiles":null,"spectrum_id":"CCMSLIB00017223748","spectrum_index":9147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 111.0318 Da; putative annotation: D-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.113,"smiles":null,"spectrum_id":"CCMSLIB00017223751","spectrum_index":9148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 676.2012 Da; putative annotation: Helonioside A; putative formula: C32H36O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":941.356,"smiles":null,"spectrum_id":"CCMSLIB00017223752","spectrum_index":9149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclooctatin (delta mass: 286.2288 Da; putative annotation: Drostanolone; putative formula: C20H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.487,"smiles":null,"spectrum_id":"CCMSLIB00017223754","spectrum_index":9150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholesterol (delta mass: 260.2121 Da; putative annotation: Spectral Match to Pinolenic acid from NIST14; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.574,"smiles":null,"spectrum_id":"CCMSLIB00017223757","spectrum_index":9151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 296.234 Da; putative annotation: 12,13-Dihydroxy-9Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.513,"smiles":null,"spectrum_id":"CCMSLIB00017223758","spectrum_index":9152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-6,10,14,18-tetraene-2,3,22,23-tetrol (delta mass: 202.1702 Da; putative annotation: (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol; putative formula: C15H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.58,"smiles":null,"spectrum_id":"CCMSLIB00017223760","spectrum_index":9153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 296.2356 Da; putative annotation: Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.452,"smiles":null,"spectrum_id":"CCMSLIB00017223761","spectrum_index":9154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 810.2726 Da; putative annotation: Maltopentaose; putative formula: C30H50O25)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1315.45,"smiles":null,"spectrum_id":"CCMSLIB00017223764","spectrum_index":9155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 331.2714 Da; putative annotation: Arachidonoyl-2'-fluoroethylamide; putative formula: C22H34FN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.556,"smiles":null,"spectrum_id":"CCMSLIB00017223766","spectrum_index":9156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 142.0239 Da; putative annotation: 2-Oxohexanedioic acid; putative formula: C6H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.084,"smiles":null,"spectrum_id":"CCMSLIB00017223767","spectrum_index":9157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocorticosterone (delta mass: 507.2341 Da; putative annotation: Virginiamycin component b; putative formula: C28H33N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":858.487,"smiles":null,"spectrum_id":"CCMSLIB00017223771","spectrum_index":9158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Val (delta mass: 113.0841 Da; putative annotation: 1747371 - 40.0 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.239,"smiles":null,"spectrum_id":"CCMSLIB00017223772","spectrum_index":9159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 324.084 Da; putative annotation: Caffeic acid 4-O-beta-D-glucopyranoside; putative formula: C15H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.239,"smiles":null,"spectrum_id":"CCMSLIB00017223773","spectrum_index":9160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 298.2505 Da; putative annotation: NCGC00347859-02!2,3-dihydroxypropyl 13-methyltetradecanoate; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.498,"smiles":null,"spectrum_id":"CCMSLIB00017223774","spectrum_index":9161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 132.0582 Da; putative annotation: 2,3-Dimethylbenzoic acid; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.15,"smiles":null,"spectrum_id":"CCMSLIB00017223778","spectrum_index":9162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 162.0534 Da; putative annotation: D-(+)-Mannose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.282,"smiles":null,"spectrum_id":"CCMSLIB00017223779","spectrum_index":9163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 170.0825 Da; putative annotation: 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one; putative formula: C11H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.147,"smiles":null,"spectrum_id":"CCMSLIB00017223780","spectrum_index":9164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine, 2-(diphenylmethyl)-, (2S)- (delta mass: 480.2411 Da; putative annotation: 17-Trifluoromethylphenyltrinorprostaglandin F2.alpha. isopropyl ester; putative formula: C27H35F3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.4,"smiles":null,"spectrum_id":"CCMSLIB00017223784","spectrum_index":9165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 498.319 Da; putative annotation: 3-(.beta.-D-Galactopyranosyloxy)-2-hydroxypropyl (9Z,12Z)-octadeca-9,12-dienoate; putative formula: C27H46O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":775.535,"smiles":null,"spectrum_id":"CCMSLIB00017223785","spectrum_index":9166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.081,"smiles":null,"spectrum_id":"CCMSLIB00017223786","spectrum_index":9167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 13.8709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.082,"smiles":null,"spectrum_id":"CCMSLIB00017223788","spectrum_index":9168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-2-Acetylguanine CollisionEnergy:205060 (delta mass: 120.0423 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.11,"smiles":null,"spectrum_id":"CCMSLIB00017223791","spectrum_index":9169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 86.0517 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017223792","spectrum_index":9170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 79.9662 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.09,"smiles":null,"spectrum_id":"CCMSLIB00017223793","spectrum_index":9171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1025.4987 Da; putative annotation: N/A; putative formula: C49H72N9O13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1188.56,"smiles":null,"spectrum_id":"CCMSLIB00017223797","spectrum_index":9172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 13.9797 Da; putative annotation: N/A; putative formula: H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017223798","spectrum_index":9173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 619.2037 Da; putative annotation: N/A; putative formula: C38H37NOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":954.31,"smiles":null,"spectrum_id":"CCMSLIB00017223799","spectrum_index":9174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 92.0472 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.295,"smiles":null,"spectrum_id":"CCMSLIB00017223801","spectrum_index":9175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 288.2292 Da; putative annotation: N/A; putative formula: C16H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.445,"smiles":null,"spectrum_id":"CCMSLIB00017223804","spectrum_index":9176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 221.1618 Da; putative annotation: N/A; putative formula: C14H23NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.378,"smiles":null,"spectrum_id":"CCMSLIB00017223806","spectrum_index":9177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 134.0747 Da; putative annotation: N/A; putative formula: C2H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.145,"smiles":null,"spectrum_id":"CCMSLIB00017223807","spectrum_index":9178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.138,"smiles":null,"spectrum_id":"CCMSLIB00017223810","spectrum_index":9179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 308.1991 Da; putative annotation: N/A; putative formula: C18H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.29,"smiles":null,"spectrum_id":"CCMSLIB00017223812","spectrum_index":9180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 46.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017223813","spectrum_index":9181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 43.9635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.05,"smiles":null,"spectrum_id":"CCMSLIB00017223816","spectrum_index":9182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP018201 Homovanillic acid|2-(4-hydroxy-3-methoxyphenyl)acetic acid (delta mass: 86.0479 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.113,"smiles":null,"spectrum_id":"CCMSLIB00017223818","spectrum_index":9183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,3S)-3-hydroxy-1-octenyl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5E)- (delta mass: 463.2929 Da; putative annotation: N/A; putative formula: C26H41NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.546,"smiles":null,"spectrum_id":"CCMSLIB00017223819","spectrum_index":9184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 94.077 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.361,"smiles":null,"spectrum_id":"CCMSLIB00017223820","spectrum_index":9185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrotachysterol (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017223823","spectrum_index":9186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Genipin (delta mass: 192.0789 Da; putative annotation: N/A; putative formula: C11H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.17,"smiles":null,"spectrum_id":"CCMSLIB00017223825","spectrum_index":9187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 280.2811 Da; putative annotation: N/A; putative formula: C19H36O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.472,"smiles":null,"spectrum_id":"CCMSLIB00017223826","spectrum_index":9188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Methylgallic acid (delta mass: 154.0263 Da; putative annotation: N/A; putative formula: C7H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.071,"smiles":null,"spectrum_id":"CCMSLIB00017223829","spectrum_index":9189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 121.0198 Da; putative annotation: N/A; putative formula: C3H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.085,"smiles":null,"spectrum_id":"CCMSLIB00017223831","spectrum_index":9190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 104.0989 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017223832","spectrum_index":9191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-3-piperidinamine (delta mass: 46.0044 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.122,"smiles":null,"spectrum_id":"CCMSLIB00017223833","spectrum_index":9192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one (delta mass: 52.0674 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.227,"smiles":null,"spectrum_id":"CCMSLIB00017223837","spectrum_index":9193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 410.281 Da; putative annotation: N/A; putative formula: C21H39N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.457,"smiles":null,"spectrum_id":"CCMSLIB00017223838","spectrum_index":9194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(4-Hydroxy-5,7-dimethyl-3-methylene-2-oxo-3,3a,4,5,8,8a-hexahydro-2H-cyclohepta[b]furan-6-yl)propyl acetate (delta mass: 289.1679 Da; putative annotation: N/A; putative formula: C17H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.338,"smiles":null,"spectrum_id":"CCMSLIB00017223839","spectrum_index":9195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 1353.9861 Da; putative annotation: N/A; putative formula: C90H131NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1576.08,"smiles":null,"spectrum_id":"CCMSLIB00017223842","spectrum_index":9196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 317.1952 Da; putative annotation: N/A; putative formula: C14H27N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.35,"smiles":null,"spectrum_id":"CCMSLIB00017223844","spectrum_index":9197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 30.0 eV (delta mass: 294.1942 Da; putative annotation: N/A; putative formula: C21H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.27,"smiles":null,"spectrum_id":"CCMSLIB00017223845","spectrum_index":9198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 63.0686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.196,"smiles":null,"spectrum_id":"CCMSLIB00017223846","spectrum_index":9199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 132.0779 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017223850","spectrum_index":9200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 157.074 Da; putative annotation: N/A; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.155,"smiles":null,"spectrum_id":"CCMSLIB00017223851","spectrum_index":9201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin - 40.0 eV (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017223852","spectrum_index":9202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 68.0623 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.206,"smiles":null,"spectrum_id":"CCMSLIB00017223853","spectrum_index":9203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 68.0265 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.097,"smiles":null,"spectrum_id":"CCMSLIB00017223857","spectrum_index":9204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 120.0929 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.325,"smiles":null,"spectrum_id":"CCMSLIB00017223858","spectrum_index":9205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 46.021 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.144,"smiles":null,"spectrum_id":"CCMSLIB00017223859","spectrum_index":9206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 131.0219 Da; putative annotation: N/A; putative formula: C4H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.103,"smiles":null,"spectrum_id":"CCMSLIB00017223862","spectrum_index":9207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 41.9071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.962,"smiles":null,"spectrum_id":"CCMSLIB00017223864","spectrum_index":9208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNnT (delta mass: 96.0195 Da; putative annotation: N/A; putative formula: CN6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.275,"smiles":null,"spectrum_id":"CCMSLIB00017223865","spectrum_index":9209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.-ol-17-one (delta mass: 116.099 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.315,"smiles":null,"spectrum_id":"CCMSLIB00017223867","spectrum_index":9210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 313.2738 Da; putative annotation: N/A; putative formula: C17H35N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.49,"smiles":null,"spectrum_id":"CCMSLIB00017223870","spectrum_index":9211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetic acid methyl ester (delta mass: 18.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.374,"smiles":null,"spectrum_id":"CCMSLIB00017223871","spectrum_index":9212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 219.1751 Da; putative annotation: N/A; putative formula: C13H21N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.36,"smiles":null,"spectrum_id":"CCMSLIB00017223873","spectrum_index":9213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 126.0834 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017223875","spectrum_index":9214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 636.5497 Da; putative annotation: N/A; putative formula: C44H68N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":919.813,"smiles":null,"spectrum_id":"CCMSLIB00017223877","spectrum_index":9215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of VANILLIN (delta mass: 45.0308 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.085,"smiles":null,"spectrum_id":"CCMSLIB00017223879","spectrum_index":9216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MELIBIOSE (delta mass: 45.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.181,"smiles":null,"spectrum_id":"CCMSLIB00017223881","spectrum_index":9217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pentenedioic acid, 2-octyl- (delta mass: 31.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.201,"smiles":null,"spectrum_id":"CCMSLIB00017223882","spectrum_index":9218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 477.177 Da; putative annotation: N/A; putative formula: C24H27N7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.268,"smiles":null,"spectrum_id":"CCMSLIB00017223884","spectrum_index":9219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 16.0163 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.123,"smiles":null,"spectrum_id":"CCMSLIB00017223886","spectrum_index":9220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 68.1225 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017223888","spectrum_index":9221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.118,"smiles":null,"spectrum_id":"CCMSLIB00017223890","spectrum_index":9222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 26.9987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.122,"smiles":null,"spectrum_id":"CCMSLIB00017223891","spectrum_index":9223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 386.1083 Da; putative annotation: N/A; putative formula: C15H22N4O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.163,"smiles":null,"spectrum_id":"CCMSLIB00017223893","spectrum_index":9224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Hexadecanoyl-sn-glycerol from NIST14 (delta mass: 308.2719 Da; putative annotation: N/A; putative formula: C20H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.556,"smiles":null,"spectrum_id":"CCMSLIB00017223895","spectrum_index":9225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycyl-glutamine; LC-tDDA; CE10 (delta mass: 129.0419 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.14,"smiles":null,"spectrum_id":"CCMSLIB00017223896","spectrum_index":9226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D2 (delta mass: 140.0986 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.44,"smiles":null,"spectrum_id":"CCMSLIB00017223898","spectrum_index":9227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 13.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.196,"smiles":null,"spectrum_id":"CCMSLIB00017223901","spectrum_index":9228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 123.0521 Da; putative annotation: N/A; putative formula: C7H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.294,"smiles":null,"spectrum_id":"CCMSLIB00017223902","spectrum_index":9229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381451-01!(1S,4S,7R,10S,13S)-7,10-di(butan-2-yl)-4-propan-2-yl-15,16-dithia-3,6,9,12,18-pentazabicyclo[11.4.2]nonadecane-2,5,8,11,19-pentone (delta mass: 78.0096 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.256,"smiles":null,"spectrum_id":"CCMSLIB00017223904","spectrum_index":9230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381059-01!5-[5-(3,5-dihydroxydecanoyloxy)-3-hydroxydecanoyl]oxy-3-hydroxydecanoic acid (delta mass: 150.0972 Da; putative annotation: N/A; putative formula: C10H15O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.492,"smiles":null,"spectrum_id":"CCMSLIB00017223907","spectrum_index":9231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 148.0606 Da; putative annotation: N/A; putative formula: C4H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.122,"smiles":null,"spectrum_id":"CCMSLIB00017223909","spectrum_index":9232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycerol (delta mass: 96.9923 Da; putative annotation: N/A; putative formula: C2H-1N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.538,"smiles":null,"spectrum_id":"CCMSLIB00017223910","spectrum_index":9233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250803 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 45.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.108,"smiles":null,"spectrum_id":"CCMSLIB00017223913","spectrum_index":9234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 8.043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.108,"smiles":null,"spectrum_id":"CCMSLIB00017223915","spectrum_index":9235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dihydroxy-5Z,8Z,11Z-eicosatrienoic acid (delta mass: 50.0518 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017223916","spectrum_index":9236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 421.2032 Da; putative annotation: N/A; putative formula: C23H28N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.3,"smiles":null,"spectrum_id":"CCMSLIB00017223919","spectrum_index":9237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 677.5081 Da; putative annotation: N/A; putative formula: C36H71NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.568,"smiles":null,"spectrum_id":"CCMSLIB00017223921","spectrum_index":9238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 88.0673 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.289,"smiles":null,"spectrum_id":"CCMSLIB00017223922","spectrum_index":9239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 774.4157 Da; putative annotation: N/A; putative formula: C51H50N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1101.54,"smiles":null,"spectrum_id":"CCMSLIB00017223923","spectrum_index":9240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 195.0273 Da; putative annotation: N/A; putative formula: C9H10NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.087,"smiles":null,"spectrum_id":"CCMSLIB00017223927","spectrum_index":9241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 18.0132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.117,"smiles":null,"spectrum_id":"CCMSLIB00017223928","spectrum_index":9242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 15.9942 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.059,"smiles":null,"spectrum_id":"CCMSLIB00017223929","spectrum_index":9243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 325.9751 Da; putative annotation: N/A; putative formula: C14H14O-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.014,"smiles":null,"spectrum_id":"CCMSLIB00017223933","spectrum_index":9244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 261.5752 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.647,"smiles":null,"spectrum_id":"CCMSLIB00017223934","spectrum_index":9245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Wilforlide A (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.362,"smiles":null,"spectrum_id":"CCMSLIB00017223935","spectrum_index":9246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipalmitolein (9c) (delta mass: 299.2873 Da; putative annotation: N/A; putative formula: C17H38N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.77,"smiles":null,"spectrum_id":"CCMSLIB00017223938","spectrum_index":9247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 239.1022 Da; putative annotation: N/A; putative formula: C9H13N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.261,"smiles":null,"spectrum_id":"CCMSLIB00017223939","spectrum_index":9248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(cyclohexylmethyl)- (delta mass: 221.0973 Da; putative annotation: N/A; putative formula: C12H16NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.246,"smiles":null,"spectrum_id":"CCMSLIB00017223941","spectrum_index":9249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid (delta mass: 14.015 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.073,"smiles":null,"spectrum_id":"CCMSLIB00017223944","spectrum_index":9250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-17-ol-3,20-dione (delta mass: 122.072 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.314,"smiles":null,"spectrum_id":"CCMSLIB00017223945","spectrum_index":9251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxo-4-cholestenoic acid (delta mass: 51.9964 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.317,"smiles":null,"spectrum_id":"CCMSLIB00017223947","spectrum_index":9252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 234.147 Da; putative annotation: N/A; putative formula: C11H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.238,"smiles":null,"spectrum_id":"CCMSLIB00017223949","spectrum_index":9253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,4,5,7-Tetramethyl-6H-pyrrolo[3,4-d]pyridazin-6-yl)aniline (delta mass: 32.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.193,"smiles":null,"spectrum_id":"CCMSLIB00017223951","spectrum_index":9254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-C18:2 (delta mass: 280.2396 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.546,"smiles":null,"spectrum_id":"CCMSLIB00017223953","spectrum_index":9255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxyculmorin (delta mass: 186.1414 Da; putative annotation: N/A; putative formula: C14H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.337,"smiles":null,"spectrum_id":"CCMSLIB00017223955","spectrum_index":9256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 31.0303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017223956","spectrum_index":9257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Bromophenyl)-3,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine (delta mass: 18.0174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.052,"smiles":null,"spectrum_id":"CCMSLIB00017223958","spectrum_index":9258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diprotin B (delta mass: 428.2638 Da; putative annotation: N/A; putative formula: C20H36N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.487,"smiles":null,"spectrum_id":"CCMSLIB00017223960","spectrum_index":9259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Iso-16-cyclohexyltetranorprostaglandin E2 (delta mass: 200.1559 Da; putative annotation: N/A; putative formula: C9H21N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.404,"smiles":null,"spectrum_id":"CCMSLIB00017223961","spectrum_index":9260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 194.0579 Da; putative annotation: N/A; putative formula: C10H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.118,"smiles":null,"spectrum_id":"CCMSLIB00017223963","spectrum_index":9261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 102.0832 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.169,"smiles":null,"spectrum_id":"CCMSLIB00017223966","spectrum_index":9262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 58.0418 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017223967","spectrum_index":9263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 122.0364 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.175,"smiles":null,"spectrum_id":"CCMSLIB00017223969","spectrum_index":9264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 32.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.227,"smiles":null,"spectrum_id":"CCMSLIB00017223973","spectrum_index":9265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 146.0369 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.42,"smiles":null,"spectrum_id":"CCMSLIB00017223974","spectrum_index":9266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 144.0487 Da; putative annotation: N/A; putative formula: C10H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.124,"smiles":null,"spectrum_id":"CCMSLIB00017223977","spectrum_index":9267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 43.9534 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017223979","spectrum_index":9268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 63.0691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.421,"smiles":null,"spectrum_id":"CCMSLIB00017223983","spectrum_index":9269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369607 Salicylic acid|2-hydroxybenzoic acid (delta mass: 52.1403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.179,"smiles":null,"spectrum_id":"CCMSLIB00017223985","spectrum_index":9270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 191.0353 Da; putative annotation: N/A; putative formula: C7H14NO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.137,"smiles":null,"spectrum_id":"CCMSLIB00017223988","spectrum_index":9271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 30.0 eV (delta mass: 173.0689 Da; putative annotation: N/A; putative formula: C7H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017223989","spectrum_index":9272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 186.967 Da; putative annotation: N/A; putative formula: C5H2NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.069,"smiles":null,"spectrum_id":"CCMSLIB00017223991","spectrum_index":9273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 418.2129 Da; putative annotation: N/A; putative formula: C21H31N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.492,"smiles":null,"spectrum_id":"CCMSLIB00017223994","spectrum_index":9274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 148.0525 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.154,"smiles":null,"spectrum_id":"CCMSLIB00017223996","spectrum_index":9275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 150.0572 Da; putative annotation: N/A; putative formula: C3H10N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.086,"smiles":null,"spectrum_id":"CCMSLIB00017223999","spectrum_index":9276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heneicosapentaenoic acid (delta mass: 238.0448 Da; putative annotation: N/A; putative formula: C7H14N2O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.292,"smiles":null,"spectrum_id":"CCMSLIB00017224001","spectrum_index":9277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 280.0557 Da; putative annotation: N/A; putative formula: C9H8N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.293,"smiles":null,"spectrum_id":"CCMSLIB00017224003","spectrum_index":9278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 41.0273 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.114,"smiles":null,"spectrum_id":"CCMSLIB00017224006","spectrum_index":9279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PAR_146.0966_8.3 (delta mass: 30.04 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.136,"smiles":null,"spectrum_id":"CCMSLIB00017224007","spectrum_index":9280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 27.0082 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.084,"smiles":null,"spectrum_id":"CCMSLIB00017224009","spectrum_index":9281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 930.4048 Da; putative annotation: N/A; putative formula: C65H50N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1189.53,"smiles":null,"spectrum_id":"CCMSLIB00017224012","spectrum_index":9282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 244.09 Da; putative annotation: N/A; putative formula: C11H12N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.212,"smiles":null,"spectrum_id":"CCMSLIB00017224013","spectrum_index":9283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 40.0321 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.277,"smiles":null,"spectrum_id":"CCMSLIB00017224015","spectrum_index":9284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 415.1843 Da; putative annotation: N/A; putative formula: C19H29NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.234,"smiles":null,"spectrum_id":"CCMSLIB00017224018","spectrum_index":9285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2,3-dione (delta mass: 87.0901 Da; putative annotation: N/A; putative formula: C2H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.12,"smiles":null,"spectrum_id":"CCMSLIB00017224020","spectrum_index":9286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYRINGIC ACID (delta mass: 44.0615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.122,"smiles":null,"spectrum_id":"CCMSLIB00017224022","spectrum_index":9287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 61.0539 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.276,"smiles":null,"spectrum_id":"CCMSLIB00017224024","spectrum_index":9288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 269.0991 Da; putative annotation: N/A; putative formula: C15H15N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.201,"smiles":null,"spectrum_id":"CCMSLIB00017224026","spectrum_index":9289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,10-Bisaboladiene-1,4-diol (delta mass: 144.045 Da; putative annotation: N/A; putative formula: C5H9N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.246,"smiles":null,"spectrum_id":"CCMSLIB00017224027","spectrum_index":9290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 43.9971 Da; putative annotation: N/A; putative formula: N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.162,"smiles":null,"spectrum_id":"CCMSLIB00017224028","spectrum_index":9291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 16.04 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017224032","spectrum_index":9292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001048999-01!1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole\"\" (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.134,"smiles":null,"spectrum_id":"CCMSLIB00017224033","spectrum_index":9293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methoxybenzaldehyde (delta mass: 42.0445 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.099,"smiles":null,"spectrum_id":"CCMSLIB00017224034","spectrum_index":9294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(1H-Indol-3-yl)vinyl]isoquinoline (delta mass: 18.008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.131,"smiles":null,"spectrum_id":"CCMSLIB00017224036","spectrum_index":9295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 306.2201 Da; putative annotation: N/A; putative formula: C19H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.431,"smiles":null,"spectrum_id":"CCMSLIB00017224039","spectrum_index":9296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3S,4S,6aR,6bS,8R,8aR,12aS,14bR)-8-Hydroxy-4,6a,6b,11,11,14b-hexamethyl-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid (delta mass: 90.0836 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.463,"smiles":null,"spectrum_id":"CCMSLIB00017224040","spectrum_index":9297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thymol (delta mass: 215.1004 Da; putative annotation: N/A; putative formula: C9H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.212,"smiles":null,"spectrum_id":"CCMSLIB00017224042","spectrum_index":9298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 96.0462 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.18,"smiles":null,"spectrum_id":"CCMSLIB00017224044","spectrum_index":9299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.alpha.-Aminopimelic acid (delta mass: 167.0956 Da; putative annotation: N/A; putative formula: C9H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.187,"smiles":null,"spectrum_id":"CCMSLIB00017224045","spectrum_index":9300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 303.2794 Da; putative annotation: N/A; putative formula: C18H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.36,"smiles":null,"spectrum_id":"CCMSLIB00017224047","spectrum_index":9301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 665.4511 Da; putative annotation: N/A; putative formula: C38H67NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.511,"smiles":null,"spectrum_id":"CCMSLIB00017224049","spectrum_index":9302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kainic Acid (delta mass: 112.1238 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.231,"smiles":null,"spectrum_id":"CCMSLIB00017224051","spectrum_index":9303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 615.287 Da; putative annotation: N/A; putative formula: C34H49NO3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.353,"smiles":null,"spectrum_id":"CCMSLIB00017224053","spectrum_index":9304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 77.0477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.222,"smiles":null,"spectrum_id":"CCMSLIB00017224055","spectrum_index":9305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 91.0641 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.275,"smiles":null,"spectrum_id":"CCMSLIB00017224056","spectrum_index":9306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 150.0383 Da; putative annotation: N/A; putative formula: C4H11N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.097,"smiles":null,"spectrum_id":"CCMSLIB00017224057","spectrum_index":9307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 461.2909 Da; putative annotation: N/A; putative formula: C23H44NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.631,"smiles":null,"spectrum_id":"CCMSLIB00017224060","spectrum_index":9308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 62.038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.249,"smiles":null,"spectrum_id":"CCMSLIB00017224062","spectrum_index":9309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 16.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.275,"smiles":null,"spectrum_id":"CCMSLIB00017224063","spectrum_index":9310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 214.23 Da; putative annotation: N/A; putative formula: C10H26N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.446,"smiles":null,"spectrum_id":"CCMSLIB00017224066","spectrum_index":9311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 80.0627 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017224067","spectrum_index":9312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Acetyloxy)lanosta-8,24-dien-21-oic acid (delta mass: 146.1089 Da; putative annotation: N/A; putative formula: C11H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.487,"smiles":null,"spectrum_id":"CCMSLIB00017224068","spectrum_index":9313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 16.016 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.16,"smiles":null,"spectrum_id":"CCMSLIB00017224071","spectrum_index":9314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-b]pyridin-6-amine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.077,"smiles":null,"spectrum_id":"CCMSLIB00017224073","spectrum_index":9315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 324.1547 Da; putative annotation: N/A; putative formula: C21H24OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.215,"smiles":null,"spectrum_id":"CCMSLIB00017224075","spectrum_index":9316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.071,"smiles":null,"spectrum_id":"CCMSLIB00017224077","spectrum_index":9317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 146.0753 Da; putative annotation: N/A; putative formula: C7H14OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.23,"smiles":null,"spectrum_id":"CCMSLIB00017224078","spectrum_index":9318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-N-stearoylsphingosine (delta mass: 362.3519 Da; putative annotation: N/A; putative formula: C21H42N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.642,"smiles":null,"spectrum_id":"CCMSLIB00017224080","spectrum_index":9319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,13.alpha.)-7-Oxopimara-8,15-dien-18-oic acid (delta mass: 19.0189 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.23,"smiles":null,"spectrum_id":"CCMSLIB00017224082","spectrum_index":9320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 79.9666 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.143,"smiles":null,"spectrum_id":"CCMSLIB00017224084","spectrum_index":9321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 312.1446 Da; putative annotation: N/A; putative formula: C14H16N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.182,"smiles":null,"spectrum_id":"CCMSLIB00017224087","spectrum_index":9322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 31.0426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.264,"smiles":null,"spectrum_id":"CCMSLIB00017224088","spectrum_index":9323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 104.8747 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.961,"smiles":null,"spectrum_id":"CCMSLIB00017224089","spectrum_index":9324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 834.44 Da; putative annotation: N/A; putative formula: C42H54N14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":997.5,"smiles":null,"spectrum_id":"CCMSLIB00017224091","spectrum_index":9325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 359.1324 Da; putative annotation: N/A; putative formula: C16H26NO4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.193,"smiles":null,"spectrum_id":"CCMSLIB00017224094","spectrum_index":9326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindoleacetic acid; AIF; CE0; MS2Dec (delta mass: 77.03 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.095,"smiles":null,"spectrum_id":"CCMSLIB00017224095","spectrum_index":9327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 671.3755 Da; putative annotation: N/A; putative formula: C32H49N9O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.436,"smiles":null,"spectrum_id":"CCMSLIB00017224098","spectrum_index":9328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 115.9834 Da; putative annotation: N/A; putative formula: C6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.079,"smiles":null,"spectrum_id":"CCMSLIB00017224099","spectrum_index":9329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ent-15-Hydroxy-8(17)-labden-2-one (delta mass: 62.0516 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.315,"smiles":null,"spectrum_id":"CCMSLIB00017224100","spectrum_index":9330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 755.3377 Da; putative annotation: N/A; putative formula: C47H50NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1084.61,"smiles":null,"spectrum_id":"CCMSLIB00017224102","spectrum_index":9331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 479.13 Da; putative annotation: N/A; putative formula: C20H25N5O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.346,"smiles":null,"spectrum_id":"CCMSLIB00017224105","spectrum_index":9332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 636.2671 Da; putative annotation: N/A; putative formula: C38H42N2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":965.536,"smiles":null,"spectrum_id":"CCMSLIB00017224106","spectrum_index":9333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 535.3718 Da; putative annotation: N/A; putative formula: C27H53NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.432,"smiles":null,"spectrum_id":"CCMSLIB00017224109","spectrum_index":9334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4-Dimethylcholest-8(9),24-dien-3.beta.-ol (delta mass: 74.0573 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.435,"smiles":null,"spectrum_id":"CCMSLIB00017224110","spectrum_index":9335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 638.3872 Da; putative annotation: N/A; putative formula: C44H50N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.426,"smiles":null,"spectrum_id":"CCMSLIB00017224111","spectrum_index":9336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1.alpha.,2.alpha.,3.beta.,5.Xi.,9.Xi.,13.Xi.,14.Xi.,18.Xi.)-1,2,3,22,23,29-Hexahydroxy-13,27-cycloolean-11-en-28-oic acid (delta mass: 114.032 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.359,"smiles":null,"spectrum_id":"CCMSLIB00017224114","spectrum_index":9337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 470.1782 Da; putative annotation: N/A; putative formula: C35H22N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.269,"smiles":null,"spectrum_id":"CCMSLIB00017224116","spectrum_index":9338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil - 40.0 eV (delta mass: 2.0407 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":117.091,"smiles":null,"spectrum_id":"CCMSLIB00017224117","spectrum_index":9339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100015 Serotonin|5-HT|5-Hydoxytryptamine|3-(2-Aminoethyl)-5-hydroxyindole|Enteramine (delta mass: 810.6849 Da; putative annotation: N/A; putative formula: C51H90N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.787,"smiles":null,"spectrum_id":"CCMSLIB00017224120","spectrum_index":9340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 58.0531 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.108,"smiles":null,"spectrum_id":"CCMSLIB00017224121","spectrum_index":9341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 98.0004 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.113,"smiles":null,"spectrum_id":"CCMSLIB00017224124","spectrum_index":9342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Orientin (delta mass: 144.0422 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.15,"smiles":null,"spectrum_id":"CCMSLIB00017224126","spectrum_index":9343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,17-diol, (3.alpha.,5.alpha.,17.beta.)- (delta mass: 120.0937 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.341,"smiles":null,"spectrum_id":"CCMSLIB00017224127","spectrum_index":9344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 18.0116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.114,"smiles":null,"spectrum_id":"CCMSLIB00017224130","spectrum_index":9345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 218.0595 Da; putative annotation: N/A; putative formula: C13H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.151,"smiles":null,"spectrum_id":"CCMSLIB00017224132","spectrum_index":9346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzoic acid (delta mass: 579.1947 Da; putative annotation: N/A; putative formula: C40H25N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.234,"smiles":null,"spectrum_id":"CCMSLIB00017224133","spectrum_index":9347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385097-01_C20H22O9_beta-D-Glucopyranoside, 4-hydroxy-2-(hydroxymethyl)phenyl, 6-benzoate (delta mass: 280.1137 Da; putative annotation: N/A; putative formula: C15H20O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.247,"smiles":null,"spectrum_id":"CCMSLIB00017224136","spectrum_index":9348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.beta.-estrane-3.alpha.,17.beta.-diol (delta mass: 76.0705 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.334,"smiles":null,"spectrum_id":"CCMSLIB00017224138","spectrum_index":9349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 92.0624 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.195,"smiles":null,"spectrum_id":"CCMSLIB00017224139","spectrum_index":9350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 85.0143 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.09,"smiles":null,"spectrum_id":"CCMSLIB00017224142","spectrum_index":9351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 62.0112 Da; putative annotation: N/A; putative formula: H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.098,"smiles":null,"spectrum_id":"CCMSLIB00017224144","spectrum_index":9352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 214.1714 Da; putative annotation: N/A; putative formula: C10H23N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.508,"smiles":null,"spectrum_id":"CCMSLIB00017224146","spectrum_index":9353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 93.0579 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.155,"smiles":null,"spectrum_id":"CCMSLIB00017224147","spectrum_index":9354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid CollisionEnergy:205060 (delta mass: 92.046 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.309,"smiles":null,"spectrum_id":"CCMSLIB00017224151","spectrum_index":9355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 108.0788 Da; putative annotation: N/A; putative formula: C5H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.181,"smiles":null,"spectrum_id":"CCMSLIB00017224154","spectrum_index":9356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 149.108 Da; putative annotation: N/A; putative formula: C7H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.215,"smiles":null,"spectrum_id":"CCMSLIB00017224156","spectrum_index":9357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 300.269 Da; putative annotation: N/A; putative formula: C17H37N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.355,"smiles":null,"spectrum_id":"CCMSLIB00017224157","spectrum_index":9358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 314.4196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.5,"smiles":null,"spectrum_id":"CCMSLIB00017224158","spectrum_index":9359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 149.987 Da; putative annotation: N/A; putative formula: C7H3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.03,"smiles":null,"spectrum_id":"CCMSLIB00017224162","spectrum_index":9360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 77.0367 Da; putative annotation: N/A; putative formula: C4H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.223,"smiles":null,"spectrum_id":"CCMSLIB00017224163","spectrum_index":9361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 126.0025 Da; putative annotation: N/A; putative formula: C9H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.141,"smiles":null,"spectrum_id":"CCMSLIB00017224164","spectrum_index":9362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 92.047 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017224167","spectrum_index":9363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyldihydrosphingosine (delta mass: 208.2193 Da; putative annotation: N/A; putative formula: C15H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.535,"smiles":null,"spectrum_id":"CCMSLIB00017224169","spectrum_index":9364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 351.0266 Da; putative annotation: N/A; putative formula: C14H14N3O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.087,"smiles":null,"spectrum_id":"CCMSLIB00017224171","spectrum_index":9365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 284.0309 Da; putative annotation: N/A; putative formula: C15H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.154,"smiles":null,"spectrum_id":"CCMSLIB00017224173","spectrum_index":9366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 438.8788 Da; putative annotation: N/A; putative formula: C6H5N3O12S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.028,"smiles":null,"spectrum_id":"CCMSLIB00017224174","spectrum_index":9367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.076,"smiles":null,"spectrum_id":"CCMSLIB00017224176","spectrum_index":9368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 80.0261 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.107,"smiles":null,"spectrum_id":"CCMSLIB00017224179","spectrum_index":9369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 230.064 Da; putative annotation: N/A; putative formula: C9H15N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.296,"smiles":null,"spectrum_id":"CCMSLIB00017224180","spectrum_index":9370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 143.9953 Da; putative annotation: N/A; putative formula: CHN6OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.082,"smiles":null,"spectrum_id":"CCMSLIB00017224182","spectrum_index":9371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceramide (d18:1/16:0) (delta mass: 266.2608 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.78,"smiles":null,"spectrum_id":"CCMSLIB00017224183","spectrum_index":9372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)ethanol (delta mass: 42.9331 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.067,"smiles":null,"spectrum_id":"CCMSLIB00017224186","spectrum_index":9373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rifamycin S (delta mass: 73.0894 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.391,"smiles":null,"spectrum_id":"CCMSLIB00017224188","spectrum_index":9374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 1088.5635 Da; putative annotation: N/A; putative formula: C65H72N10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1269.63,"smiles":null,"spectrum_id":"CCMSLIB00017224189","spectrum_index":9375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 133.9897 Da; putative annotation: N/A; putative formula: CH2N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.269,"smiles":null,"spectrum_id":"CCMSLIB00017224192","spectrum_index":9376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexanone, 2-(ethylamino)-2-phenyl- (delta mass: 418.1684 Da; putative annotation: N/A; putative formula: C21H30N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.322,"smiles":null,"spectrum_id":"CCMSLIB00017224194","spectrum_index":9377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 1-PHOSPHATE (delta mass: 74.0054 Da; putative annotation: N/A; putative formula: CH3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.042,"smiles":null,"spectrum_id":"CCMSLIB00017224195","spectrum_index":9378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 1-piperazinecarboxylate (delta mass: 86.0416 Da; putative annotation: N/A; putative formula: C3H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.139,"smiles":null,"spectrum_id":"CCMSLIB00017224199","spectrum_index":9379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 132.0535 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017224200","spectrum_index":9380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 3.3987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.5,"smiles":null,"spectrum_id":"CCMSLIB00017224201","spectrum_index":9381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 54.9864 Da; putative annotation: N/A; putative formula: C2HNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.078,"smiles":null,"spectrum_id":"CCMSLIB00017224203","spectrum_index":9382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 174.053 Da; putative annotation: N/A; putative formula: C7H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.207,"smiles":null,"spectrum_id":"CCMSLIB00017224206","spectrum_index":9383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 185.0805 Da; putative annotation: N/A; putative formula: C7H11N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.151,"smiles":null,"spectrum_id":"CCMSLIB00017224207","spectrum_index":9384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 45.0251 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.127,"smiles":null,"spectrum_id":"CCMSLIB00017224209","spectrum_index":9385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 66.0469 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.394,"smiles":null,"spectrum_id":"CCMSLIB00017224212","spectrum_index":9386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 132.0576 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017224213","spectrum_index":9387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 260.0532 Da; putative annotation: N/A; putative formula: C10H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.113,"smiles":null,"spectrum_id":"CCMSLIB00017224214","spectrum_index":9388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cholic acid CollisionEnergy:205060 (delta mass: 107.0147 Da; putative annotation: N/A; putative formula: CH5N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.31,"smiles":null,"spectrum_id":"CCMSLIB00017224218","spectrum_index":9389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 41.0114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.066,"smiles":null,"spectrum_id":"CCMSLIB00017224219","spectrum_index":9390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 31.0049 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.221,"smiles":null,"spectrum_id":"CCMSLIB00017224220","spectrum_index":9391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1173.8363 Da; putative annotation: N/A; putative formula: C60H10N10O-1S10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1395.93,"smiles":null,"spectrum_id":"CCMSLIB00017224223","spectrum_index":9392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 289.1891 Da; putative annotation: N/A; putative formula: C14H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.28,"smiles":null,"spectrum_id":"CCMSLIB00017224224","spectrum_index":9393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 816.6757 Da; putative annotation: N/A; putative formula: C38H84N14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1038.77,"smiles":null,"spectrum_id":"CCMSLIB00017224225","spectrum_index":9394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 77.0299 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.277,"smiles":null,"spectrum_id":"CCMSLIB00017224229","spectrum_index":9395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desferrioxamine H (delta mass: 84.0701 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.331,"smiles":null,"spectrum_id":"CCMSLIB00017224230","spectrum_index":9396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 58.0871 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.149,"smiles":null,"spectrum_id":"CCMSLIB00017224231","spectrum_index":9397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-((4R)-4-((5R,7R,8R,9S,10S,12S,13R,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid\"\" (delta mass: 45.0574 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.341,"smiles":null,"spectrum_id":"CCMSLIB00017224233","spectrum_index":9398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 221.1536 Da; putative annotation: N/A; putative formula: C12H19N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.25,"smiles":null,"spectrum_id":"CCMSLIB00017224236","spectrum_index":9399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-11-(3-pentyl-2-oxiranyl)-10E-undecenoic acid (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.233,"smiles":null,"spectrum_id":"CCMSLIB00017224237","spectrum_index":9400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 70.0425 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017224239","spectrum_index":9401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Hydroxypregnenolone (delta mass: 76.0302 Da; putative annotation: N/A; putative formula: H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.273,"smiles":null,"spectrum_id":"CCMSLIB00017224242","spectrum_index":9402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-[3-(Benzyloxy)benzyl]-1H-tetrazole-1,5-diamine (delta mass: 60.0083 Da; putative annotation: N/A; putative formula: C4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.154,"smiles":null,"spectrum_id":"CCMSLIB00017224243","spectrum_index":9403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 88.0526 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017224244","spectrum_index":9404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phthalyl-L-tryptophan (delta mass: 63.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.135,"smiles":null,"spectrum_id":"CCMSLIB00017224247","spectrum_index":9405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 86.0504 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.282,"smiles":null,"spectrum_id":"CCMSLIB00017224249","spectrum_index":9406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 845.6889 Da; putative annotation: N/A; putative formula: C55H91NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1026.76,"smiles":null,"spectrum_id":"CCMSLIB00017224250","spectrum_index":9407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 577.4646 Da; putative annotation: N/A; putative formula: C42H59N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.535,"smiles":null,"spectrum_id":"CCMSLIB00017224252","spectrum_index":9408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 419.3283 Da; putative annotation: N/A; putative formula: C21H46N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.576,"smiles":null,"spectrum_id":"CCMSLIB00017224255","spectrum_index":9409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 68.0659 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.137,"smiles":null,"spectrum_id":"CCMSLIB00017224256","spectrum_index":9410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desoxypipradrol (delta mass: 479.173 Da; putative annotation: N/A; putative formula: C30H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.348,"smiles":null,"spectrum_id":"CCMSLIB00017224258","spectrum_index":9411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 61.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.281,"smiles":null,"spectrum_id":"CCMSLIB00017224260","spectrum_index":9412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 228.1754 Da; putative annotation: N/A; putative formula: C12H25N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.455,"smiles":null,"spectrum_id":"CCMSLIB00017224262","spectrum_index":9413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperazine (delta mass: 71.0621 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.169,"smiles":null,"spectrum_id":"CCMSLIB00017224264","spectrum_index":9414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 154.0983 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.221,"smiles":null,"spectrum_id":"CCMSLIB00017224266","spectrum_index":9415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 138.0676 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017224268","spectrum_index":9416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethylbenzoic acid (delta mass: 102.0677 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017224270","spectrum_index":9417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,3-Difluoroazetidin-1-yl)piperidine (delta mass: 55.009 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.129,"smiles":null,"spectrum_id":"CCMSLIB00017224273","spectrum_index":9418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-(1,2,4a,5-Tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoic acid (delta mass: 48.0356 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.262,"smiles":null,"spectrum_id":"CCMSLIB00017224275","spectrum_index":9419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 60.0202 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.231,"smiles":null,"spectrum_id":"CCMSLIB00017224276","spectrum_index":9420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 163.0544 Da; putative annotation: N/A; putative formula: C9H10NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.26,"smiles":null,"spectrum_id":"CCMSLIB00017224279","spectrum_index":9421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 194.1675 Da; putative annotation: N/A; putative formula: C13H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.268,"smiles":null,"spectrum_id":"CCMSLIB00017224281","spectrum_index":9422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,17,20,23,26,29-Dotriacontahexaenoic acid, (14Z,17Z,20Z,23Z,26Z,29Z)- (delta mass: 134.102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.506,"smiles":null,"spectrum_id":"CCMSLIB00017224282","spectrum_index":9423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 109.1118 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.323,"smiles":null,"spectrum_id":"CCMSLIB00017224284","spectrum_index":9424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 343.2306 Da; putative annotation: N/A; putative formula: C25H29N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.307,"smiles":null,"spectrum_id":"CCMSLIB00017224287","spectrum_index":9425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 186.1256 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.17,"smiles":null,"spectrum_id":"CCMSLIB00017224288","spectrum_index":9426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Naltrexone (delta mass: 85.0552 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.225,"smiles":null,"spectrum_id":"CCMSLIB00017224290","spectrum_index":9427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine 6-phosphate - 30.0 eV (delta mass: 104.0629 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.116,"smiles":null,"spectrum_id":"CCMSLIB00017224293","spectrum_index":9428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 53.9868 Da; putative annotation: N/A; putative formula: CH-2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.052,"smiles":null,"spectrum_id":"CCMSLIB00017224294","spectrum_index":9429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 150.0685 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.316,"smiles":null,"spectrum_id":"CCMSLIB00017224296","spectrum_index":9430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 28.9941 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.075,"smiles":null,"spectrum_id":"CCMSLIB00017224299","spectrum_index":9431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Aminophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one (delta mass: 167.9644 Da; putative annotation: N/A; putative formula: C5H2N2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.066,"smiles":null,"spectrum_id":"CCMSLIB00017224300","spectrum_index":9432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 54.0105 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.075,"smiles":null,"spectrum_id":"CCMSLIB00017224302","spectrum_index":9433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyquinuclidine-3-carbonitrile (delta mass: 27.9943 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.096,"smiles":null,"spectrum_id":"CCMSLIB00017224305","spectrum_index":9434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 322.5803 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.652,"smiles":null,"spectrum_id":"CCMSLIB00017224306","spectrum_index":9435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 40.9789 Da; putative annotation: N/A; putative formula: CNO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.049,"smiles":null,"spectrum_id":"CCMSLIB00017224308","spectrum_index":9436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 287.0746 Da; putative annotation: N/A; putative formula: C12H18NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.359,"smiles":null,"spectrum_id":"CCMSLIB00017224311","spectrum_index":9437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sericic acid (delta mass: 144.094 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.446,"smiles":null,"spectrum_id":"CCMSLIB00017224312","spectrum_index":9438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 108.0191 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.158,"smiles":null,"spectrum_id":"CCMSLIB00017224314","spectrum_index":9439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 97.0276 Da; putative annotation: N/A; putative formula: C3H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.129,"smiles":null,"spectrum_id":"CCMSLIB00017224316","spectrum_index":9440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynicotinic acid (delta mass: 23.0156 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.05,"smiles":null,"spectrum_id":"CCMSLIB00017224319","spectrum_index":9441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (4R,4aS,10R,13aR)-14-hydroxy-4,13a-dimethyl-9,13-dioxo-2,3,4,4a,5,6,9,10,11,12,13,13a-dodecahydro-1H-7,10-methanobenzo[11]annulene-4-carboxylate (delta mass: 50.0513 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.252,"smiles":null,"spectrum_id":"CCMSLIB00017224320","spectrum_index":9442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-2-hydroxybenzoic acid (delta mass: 112.1982 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.232,"smiles":null,"spectrum_id":"CCMSLIB00017224323","spectrum_index":9443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Azaspiro[4.5]decane-1,3-dione (delta mass: 14.9996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.102,"smiles":null,"spectrum_id":"CCMSLIB00017224325","spectrum_index":9444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 163.0841 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.144,"smiles":null,"spectrum_id":"CCMSLIB00017224326","spectrum_index":9445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 26.0012 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.078,"smiles":null,"spectrum_id":"CCMSLIB00017224330","spectrum_index":9446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maslinic acid (delta mass: 124.0692 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.432,"smiles":null,"spectrum_id":"CCMSLIB00017224331","spectrum_index":9447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((1S,3aR,4S,6S,7R,8aR)-1-Hydroxy-4,8a-dimethyloctahydro-1H-3a,6-epoxyazulen-7-yl)prop-2-enoic acid (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017224332","spectrum_index":9448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 134.0956 Da; putative annotation: N/A; putative formula: C7H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.192,"smiles":null,"spectrum_id":"CCMSLIB00017224335","spectrum_index":9449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 118.0419 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.113,"smiles":null,"spectrum_id":"CCMSLIB00017224337","spectrum_index":9450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-tert-Butylaniline (delta mass: 116.0472 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017224338","spectrum_index":9451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 277.1792 Da; putative annotation: N/A; putative formula: C15H23N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.281,"smiles":null,"spectrum_id":"CCMSLIB00017224340","spectrum_index":9452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N-methyl-4-piperidinamine (delta mass: 40.0301 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017224343","spectrum_index":9453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 17.0348 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.15,"smiles":null,"spectrum_id":"CCMSLIB00017224344","spectrum_index":9454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5S)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one (delta mass: 197.0903 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.213,"smiles":null,"spectrum_id":"CCMSLIB00017224347","spectrum_index":9455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol oxide A (delta mass: 274.214 Da; putative annotation: N/A; putative formula: C15H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.415,"smiles":null,"spectrum_id":"CCMSLIB00017224349","spectrum_index":9456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Methyl-1-piperazinyl)butanoic acid (delta mass: 67.0171 Da; putative annotation: N/A; putative formula: C2HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.161,"smiles":null,"spectrum_id":"CCMSLIB00017224350","spectrum_index":9457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 557.1609 Da; putative annotation: N/A; putative formula: C22H39NO7S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.202,"smiles":null,"spectrum_id":"CCMSLIB00017224353","spectrum_index":9458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 109.0737 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.144,"smiles":null,"spectrum_id":"CCMSLIB00017224355","spectrum_index":9459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 37.9792 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.06,"smiles":null,"spectrum_id":"CCMSLIB00017224356","spectrum_index":9460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 258.1821 Da; putative annotation: N/A; putative formula: C14H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.351,"smiles":null,"spectrum_id":"CCMSLIB00017224359","spectrum_index":9461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Leu-DL-Val (delta mass: 113.084 Da; putative annotation: L-Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017224361","spectrum_index":9462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Pro (delta mass: 97.0528 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.166,"smiles":null,"spectrum_id":"CCMSLIB00017224362","spectrum_index":9463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 324.1053 Da; putative annotation: Maltose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.282,"smiles":null,"spectrum_id":"CCMSLIB00017224365","spectrum_index":9464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 236.2129 Da; putative annotation: cis-9-Hexadecenoic acid; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.455,"smiles":null,"spectrum_id":"CCMSLIB00017224367","spectrum_index":9465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 151.0631 Da; putative annotation: DL-Norepinephrine; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017224368","spectrum_index":9466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 193.1101 Da; putative annotation: Methoxamine; putative formula: C11H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.228,"smiles":null,"spectrum_id":"CCMSLIB00017224370","spectrum_index":9467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lactose from NIST14 (delta mass: 412.2978 Da; putative annotation: Hecogenin; putative formula: C27H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.421,"smiles":null,"spectrum_id":"CCMSLIB00017224373","spectrum_index":9468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 248.2491 Da; putative annotation: cis,cis-9,12-Octadecadien-1-ol; putative formula: C18H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.555,"smiles":null,"spectrum_id":"CCMSLIB00017224374","spectrum_index":9469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 149.0476 Da; putative annotation: PYRIDOXAL - 40.0 eV; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.113,"smiles":null,"spectrum_id":"CCMSLIB00017224376","spectrum_index":9470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzoic acid (delta mass: 193.0921 Da; putative annotation: 4-Methyl-N-phenylbenzamide; putative formula: C14H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.142,"smiles":null,"spectrum_id":"CCMSLIB00017224379","spectrum_index":9471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 412.2996 Da; putative annotation: Hecogenin; putative formula: C27H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.516,"smiles":null,"spectrum_id":"CCMSLIB00017224380","spectrum_index":9472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 282.2553 Da; putative annotation: Spectral Match to 3-Hydroxyoctadecanoic Acid from NIST14; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.513,"smiles":null,"spectrum_id":"CCMSLIB00017224383","spectrum_index":9473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid (delta mass: 295.2519 Da; putative annotation: N-Palmitoylglycine; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.494,"smiles":null,"spectrum_id":"CCMSLIB00017224385","spectrum_index":9474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006043 (+/-) Salsolinol|1-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 116.0646 Da; putative annotation: Cinnamyl alcohol; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.167,"smiles":null,"spectrum_id":"CCMSLIB00017224387","spectrum_index":9475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 138.0305 Da; putative annotation: Opuntiol; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.101,"smiles":null,"spectrum_id":"CCMSLIB00017224389","spectrum_index":9476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 390.2775 Da; putative annotation: CHOLIC ACID; putative formula: C24H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.406,"smiles":null,"spectrum_id":"CCMSLIB00017224391","spectrum_index":9477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 166.0263 Da; putative annotation: 3,4-Dihydroxymandelic acid; putative formula: C8H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.065,"smiles":null,"spectrum_id":"CCMSLIB00017224393","spectrum_index":9478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 240.1713 Da; putative annotation: Tetradecanedioic acid; putative formula: C14H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.341,"smiles":null,"spectrum_id":"CCMSLIB00017224396","spectrum_index":9479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid (delta mass: 192.1145 Da; putative annotation: (.+/-.)7-epi-Jasmonic acid; putative formula: C12H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.268,"smiles":null,"spectrum_id":"CCMSLIB00017224398","spectrum_index":9480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 123.1048 Da; putative annotation: 1-(Piperidin-2-yl)propan-1-one; putative formula: C8H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.191,"smiles":null,"spectrum_id":"CCMSLIB00017224400","spectrum_index":9481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 486.1584 Da; putative annotation: Melezitose; putative formula: C18H30O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.195,"smiles":null,"spectrum_id":"CCMSLIB00017224402","spectrum_index":9482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucrose (delta mass: 161.0689 Da; putative annotation: 2-Amino-2-deoxy-D-glucopyranose; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.192,"smiles":null,"spectrum_id":"CCMSLIB00017224404","spectrum_index":9483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 265.0487 Da; putative annotation: 1,4-Diamino-2-nitroanthraquinone; putative formula: C14H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.14,"smiles":null,"spectrum_id":"CCMSLIB00017224405","spectrum_index":9484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 164.0327 Da; putative annotation: 1-Methyluric acid; putative formula: C6H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.119,"smiles":null,"spectrum_id":"CCMSLIB00017224407","spectrum_index":9485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 361.2614 Da; putative annotation: Leukotriene B4 ethanolamide; putative formula: C22H35NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.519,"smiles":null,"spectrum_id":"CCMSLIB00017224409","spectrum_index":9486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylazepane (delta mass: 194.1305 Da; putative annotation: NCGC00384951-01!2-(6-hydroxy-6-methylheptyl)-2H-furan-5-one; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.274,"smiles":null,"spectrum_id":"CCMSLIB00017224411","spectrum_index":9487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 329.3119 Da; putative annotation: amyl amine-C18:3; putative formula: C23H39N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.57,"smiles":null,"spectrum_id":"CCMSLIB00017224413","spectrum_index":9488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 67.0277 Da; putative annotation: N/A; putative formula: CHN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.38,"smiles":null,"spectrum_id":"CCMSLIB00017224414","spectrum_index":9489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 315.2786 Da; putative annotation: N/A; putative formula: C19H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.49,"smiles":null,"spectrum_id":"CCMSLIB00017224417","spectrum_index":9490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 80.0627 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.112,"smiles":null,"spectrum_id":"CCMSLIB00017224419","spectrum_index":9491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 134.972 Da; putative annotation: N/A; putative formula: C2H2NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.049,"smiles":null,"spectrum_id":"CCMSLIB00017224420","spectrum_index":9492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of URIDINE 5'-DIPHOSPHO-N-ACETYLGALACTOSAMINE - 20.0 eV (delta mass: 272.0999 Da; putative annotation: N/A; putative formula: C13H21O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":880.189,"smiles":null,"spectrum_id":"CCMSLIB00017224423","spectrum_index":9493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1-Pyrrolidinylcarbonyl)piperidine (delta mass: 202.0953 Da; putative annotation: N/A; putative formula: C8H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.245,"smiles":null,"spectrum_id":"CCMSLIB00017224425","spectrum_index":9494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16-Docosatetraenoic acid (delta mass: 588.267 Da; putative annotation: N/A; putative formula: C27H32N12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":921.546,"smiles":null,"spectrum_id":"CCMSLIB00017224426","spectrum_index":9495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dimethyl (R)-(+)-malate (delta mass: 260.0532 Da; putative annotation: N/A; putative formula: C10H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.113,"smiles":null,"spectrum_id":"CCMSLIB00017224428","spectrum_index":9496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 74.052 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017224431","spectrum_index":9497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 68.0473 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.279,"smiles":null,"spectrum_id":"CCMSLIB00017224432","spectrum_index":9498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.143,"smiles":null,"spectrum_id":"CCMSLIB00017224434","spectrum_index":9499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 284.2351 Da; putative annotation: N/A; putative formula: C17H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.493,"smiles":null,"spectrum_id":"CCMSLIB00017224437","spectrum_index":9500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monopalmitolein (9c) from NIST14 (delta mass: 194.0417 Da; putative annotation: N/A; putative formula: C10H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.31,"smiles":null,"spectrum_id":"CCMSLIB00017224439","spectrum_index":9501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 241.1489 Da; putative annotation: N/A; putative formula: C16H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.219,"smiles":null,"spectrum_id":"CCMSLIB00017224442","spectrum_index":9502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.055,"smiles":null,"spectrum_id":"CCMSLIB00017224444","spectrum_index":9503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.071,"smiles":null,"spectrum_id":"CCMSLIB00017224446","spectrum_index":9504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 54.0622 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.435,"smiles":null,"spectrum_id":"CCMSLIB00017224448","spectrum_index":9505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 48.0364 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.263,"smiles":null,"spectrum_id":"CCMSLIB00017224450","spectrum_index":9506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 169.9956 Da; putative annotation: N/A; putative formula: C7H7OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.15,"smiles":null,"spectrum_id":"CCMSLIB00017224452","spectrum_index":9507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 113.084 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.228,"smiles":null,"spectrum_id":"CCMSLIB00017224454","spectrum_index":9508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 81.0579 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.243,"smiles":null,"spectrum_id":"CCMSLIB00017224456","spectrum_index":9509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 50.0 eV (delta mass: 99.9248 Da; putative annotation: N/A; putative formula: C2H-2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.016,"smiles":null,"spectrum_id":"CCMSLIB00017224459","spectrum_index":9510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dierucoyl-sn-glycero-3-phosphoethanolamine (delta mass: 108.1019 Da; putative annotation: N/A; putative formula: C7H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":964.781,"smiles":null,"spectrum_id":"CCMSLIB00017224461","spectrum_index":9511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 129.0355 Da; putative annotation: N/A; putative formula: C4H7N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.132,"smiles":null,"spectrum_id":"CCMSLIB00017224463","spectrum_index":9512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethylene glycol 2-ethylhexyl ether (delta mass: 88.0514 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.247,"smiles":null,"spectrum_id":"CCMSLIB00017224466","spectrum_index":9513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 502.349 Da; putative annotation: N/A; putative formula: C24H42N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.565,"smiles":null,"spectrum_id":"CCMSLIB00017224468","spectrum_index":9514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Chlorophenoxy)ethanol (delta mass: 9.984 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.02,"smiles":null,"spectrum_id":"CCMSLIB00017224471","spectrum_index":9515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 103.9799 Da; putative annotation: N/A; putative formula: N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.196,"smiles":null,"spectrum_id":"CCMSLIB00017224474","spectrum_index":9516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 459.3986 Da; putative annotation: N/A; putative formula: C32H49N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.651,"smiles":null,"spectrum_id":"CCMSLIB00017224476","spectrum_index":9517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 307.1653 Da; putative annotation: N/A; putative formula: C7H21N11OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.236,"smiles":null,"spectrum_id":"CCMSLIB00017224478","spectrum_index":9518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 116.0622 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017224479","spectrum_index":9519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 288.2102 Da; putative annotation: N/A; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":793.386,"smiles":null,"spectrum_id":"CCMSLIB00017224482","spectrum_index":9520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 713.3616 Da; putative annotation: N/A; putative formula: C48H47N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.432,"smiles":null,"spectrum_id":"CCMSLIB00017224484","spectrum_index":9521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 179.1136 Da; putative annotation: N/A; putative formula: C11H17NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.163,"smiles":null,"spectrum_id":"CCMSLIB00017224485","spectrum_index":9522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 371.1381 Da; putative annotation: N/A; putative formula: C21H17N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":743.282,"smiles":null,"spectrum_id":"CCMSLIB00017224489","spectrum_index":9523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 147.088 Da; putative annotation: N/A; putative formula: C2H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.304,"smiles":null,"spectrum_id":"CCMSLIB00017224490","spectrum_index":9524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 104.0839 Da; putative annotation: N/A; putative formula: CH8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.154,"smiles":null,"spectrum_id":"CCMSLIB00017224491","spectrum_index":9525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 313.1009 Da; putative annotation: N/A; putative formula: C10H19NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.197,"smiles":null,"spectrum_id":"CCMSLIB00017224495","spectrum_index":9526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 96.0577 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.29,"smiles":null,"spectrum_id":"CCMSLIB00017224496","spectrum_index":9527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 250.1918 Da; putative annotation: N/A; putative formula: C12H22N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.45,"smiles":null,"spectrum_id":"CCMSLIB00017224497","spectrum_index":9528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN - 30.0 eV (delta mass: 392.5321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.628,"smiles":null,"spectrum_id":"CCMSLIB00017224499","spectrum_index":9529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 45.0094 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.106,"smiles":null,"spectrum_id":"CCMSLIB00017224502","spectrum_index":9530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid methyl ester (delta mass: 170.1151 Da; putative annotation: N/A; putative formula: C3H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.498,"smiles":null,"spectrum_id":"CCMSLIB00017224503","spectrum_index":9531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethoxybenzoic acid (delta mass: 147.8722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.943,"smiles":null,"spectrum_id":"CCMSLIB00017224505","spectrum_index":9532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 70.006 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.088,"smiles":null,"spectrum_id":"CCMSLIB00017224508","spectrum_index":9533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 220.0596 Da; putative annotation: N/A; putative formula: C9H8N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.14,"smiles":null,"spectrum_id":"CCMSLIB00017224509","spectrum_index":9534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.gamma.-Glutamyl-L-glutamic acid (delta mass: 130.0461 Da; putative annotation: N/A; putative formula: C6H12O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.149,"smiles":null,"spectrum_id":"CCMSLIB00017224511","spectrum_index":9535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperazineethanol (delta mass: 1.9863 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.104,"smiles":null,"spectrum_id":"CCMSLIB00017224513","spectrum_index":9536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Erucamide (delta mass: 15.9928 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.335,"smiles":null,"spectrum_id":"CCMSLIB00017224515","spectrum_index":9537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-(-)-Nopol CollisionEnergy:205060 (delta mass: 110.1093 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.252,"smiles":null,"spectrum_id":"CCMSLIB00017224516","spectrum_index":9538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 869.3388 Da; putative annotation: N/A; putative formula: C34H55N5O21)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":996.378,"smiles":null,"spectrum_id":"CCMSLIB00017224520","spectrum_index":9539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 132.0607 Da; putative annotation: N/A; putative formula: C6H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.127,"smiles":null,"spectrum_id":"CCMSLIB00017224521","spectrum_index":9540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 218.0937 Da; putative annotation: N/A; putative formula: C7H15N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.18,"smiles":null,"spectrum_id":"CCMSLIB00017224522","spectrum_index":9541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 507.2396 Da; putative annotation: N/A; putative formula: C27H34N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.28,"smiles":null,"spectrum_id":"CCMSLIB00017224525","spectrum_index":9542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 733.4393 Da; putative annotation: N/A; putative formula: C53H55N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.51,"smiles":null,"spectrum_id":"CCMSLIB00017224527","spectrum_index":9543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 422.3543 Da; putative annotation: N/A; putative formula: C30H46O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.478,"smiles":null,"spectrum_id":"CCMSLIB00017224528","spectrum_index":9544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 593.3924 Da; putative annotation: N/A; putative formula: C33H55NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.452,"smiles":null,"spectrum_id":"CCMSLIB00017224530","spectrum_index":9545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S,15S-Dihydroxy-5Z,9E,11Z,13E-eicosatetraenoic acid (delta mass: 36.0367 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.274,"smiles":null,"spectrum_id":"CCMSLIB00017224533","spectrum_index":9546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-3-Methyl-5-(1,2,5,5-tetramethyl-7-oxo-3,4,4a,6-tetrahydro-2H-naphthalen-1-yl)pent-2-enoic acid (delta mass: 46.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.269,"smiles":null,"spectrum_id":"CCMSLIB00017224534","spectrum_index":9547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-4Z,6E,10Z,13Z,16Z,19Z-docosahexaenoic acid (delta mass: 32.0276 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.27,"smiles":null,"spectrum_id":"CCMSLIB00017224536","spectrum_index":9548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ellagic acid (delta mass: 120.035 Da; putative annotation: N/A; putative formula: C3H8N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.048,"smiles":null,"spectrum_id":"CCMSLIB00017224539","spectrum_index":9549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 154.1302 Da; putative annotation: N/A; putative formula: C10H19O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.217,"smiles":null,"spectrum_id":"CCMSLIB00017224540","spectrum_index":9550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 118.0383 Da; putative annotation: N/A; putative formula: C3H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.119,"smiles":null,"spectrum_id":"CCMSLIB00017224541","spectrum_index":9551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 214.0958 Da; putative annotation: N/A; putative formula: C9H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.192,"smiles":null,"spectrum_id":"CCMSLIB00017224544","spectrum_index":9552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulin (delta mass: 176.1546 Da; putative annotation: N/A; putative formula: C13H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.543,"smiles":null,"spectrum_id":"CCMSLIB00017224545","spectrum_index":9553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 259.2145 Da; putative annotation: N/A; putative formula: C14H29NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.311,"smiles":null,"spectrum_id":"CCMSLIB00017224547","spectrum_index":9554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 120.094 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017224550","spectrum_index":9555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mononervonin (15c) (delta mass: 102.084 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.478,"smiles":null,"spectrum_id":"CCMSLIB00017224551","spectrum_index":9556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 213.0846 Da; putative annotation: N/A; putative formula: C9H16N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.171,"smiles":null,"spectrum_id":"CCMSLIB00017224552","spectrum_index":9557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.128,"smiles":null,"spectrum_id":"CCMSLIB00017224555","spectrum_index":9558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 529.2539 Da; putative annotation: N/A; putative formula: C26H35N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.319,"smiles":null,"spectrum_id":"CCMSLIB00017224557","spectrum_index":9559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 793.5415 Da; putative annotation: N/A; putative formula: C48H76NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":980.674,"smiles":null,"spectrum_id":"CCMSLIB00017224558","spectrum_index":9560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 168.0421 Da; putative annotation: N/A; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.166,"smiles":null,"spectrum_id":"CCMSLIB00017224560","spectrum_index":9561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,8-Difluoro-3-azabicyclo[3.2.1]octane (delta mass: 76.0346 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017224562","spectrum_index":9562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 965.4353 Da; putative annotation: N/A; putative formula: C64H55N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1146.48,"smiles":null,"spectrum_id":"CCMSLIB00017224563","spectrum_index":9563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 161.0683 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017224565","spectrum_index":9564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 46.0063 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.14,"smiles":null,"spectrum_id":"CCMSLIB00017224568","spectrum_index":9565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 792.4308 Da; putative annotation: N/A; putative formula: C43H60N4O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.502,"smiles":null,"spectrum_id":"CCMSLIB00017224569","spectrum_index":9566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 27.0469 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017224571","spectrum_index":9567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-TRIHYDROXYBENZOIC ACID\"\" (delta mass: 446.0479 Da; putative annotation: N/A; putative formula: C18H10N10OS2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.077,"smiles":null,"spectrum_id":"CCMSLIB00017224573","spectrum_index":9568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 102.047 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.096,"smiles":null,"spectrum_id":"CCMSLIB00017224574","spectrum_index":9569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 66.0468 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.2,"smiles":null,"spectrum_id":"CCMSLIB00017224577","spectrum_index":9570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2,3-dihydro-1H-indole (delta mass: 154.1286 Da; putative annotation: N/A; putative formula: C10H19O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.2,"smiles":null,"spectrum_id":"CCMSLIB00017224579","spectrum_index":9571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 142.0665 Da; putative annotation: N/A; putative formula: C6H11N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.314,"smiles":null,"spectrum_id":"CCMSLIB00017224580","spectrum_index":9572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 324.0624 Da; putative annotation: N/A; putative formula: C12H13N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.133,"smiles":null,"spectrum_id":"CCMSLIB00017224582","spectrum_index":9573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 124.0889 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017224584","spectrum_index":9574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE0; CorrDec (delta mass: 300.2292 Da; putative annotation: N/A; putative formula: C17H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.327,"smiles":null,"spectrum_id":"CCMSLIB00017224585","spectrum_index":9575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 40.0312 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.149,"smiles":null,"spectrum_id":"CCMSLIB00017224588","spectrum_index":9576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 377.1557 Da; putative annotation: N/A; putative formula: C14H27N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.231,"smiles":null,"spectrum_id":"CCMSLIB00017224590","spectrum_index":9577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 33.0114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.135,"smiles":null,"spectrum_id":"CCMSLIB00017224591","spectrum_index":9578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of uridine (delta mass: 206.0591 Da; putative annotation: N/A; putative formula: C12H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.136,"smiles":null,"spectrum_id":"CCMSLIB00017224592","spectrum_index":9579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-4-phenyl-3-butyn-2-ol (delta mass: 24.0361 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.132,"smiles":null,"spectrum_id":"CCMSLIB00017224596","spectrum_index":9580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 104.0632 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.143,"smiles":null,"spectrum_id":"CCMSLIB00017224597","spectrum_index":9581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 158.0925 Da; putative annotation: N/A; putative formula: C4H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.179,"smiles":null,"spectrum_id":"CCMSLIB00017224598","spectrum_index":9582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 639.7038 Da; putative annotation: N/A; putative formula: C46H89NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1306.93,"smiles":null,"spectrum_id":"CCMSLIB00017224602","spectrum_index":9583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 396.2281 Da; putative annotation: N/A; putative formula: C18H37O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.299,"smiles":null,"spectrum_id":"CCMSLIB00017224603","spectrum_index":9584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 652.4462 Da; putative annotation: N/A; putative formula: C40H56N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.532,"smiles":null,"spectrum_id":"CCMSLIB00017224604","spectrum_index":9585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 101.0481 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.187,"smiles":null,"spectrum_id":"CCMSLIB00017224607","spectrum_index":9586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11,14-Eicosadienoic acid (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.305,"smiles":null,"spectrum_id":"CCMSLIB00017224609","spectrum_index":9587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 29.9888 Da; putative annotation: N/A; putative formula: C4H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.09,"smiles":null,"spectrum_id":"CCMSLIB00017224610","spectrum_index":9588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 288.1467 Da; putative annotation: N/A; putative formula: C18H25O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.238,"smiles":null,"spectrum_id":"CCMSLIB00017224612","spectrum_index":9589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 243.0389 Da; putative annotation: N/A; putative formula: C10H13NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.354,"smiles":null,"spectrum_id":"CCMSLIB00017224615","spectrum_index":9590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 287.1468 Da; putative annotation: N/A; putative formula: C9H13N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.238,"smiles":null,"spectrum_id":"CCMSLIB00017224616","spectrum_index":9591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 66.0316 Da; putative annotation: N/A; putative formula: C2H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.243,"smiles":null,"spectrum_id":"CCMSLIB00017224618","spectrum_index":9592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 128.1075 Da; putative annotation: N/A; putative formula: C5H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.335,"smiles":null,"spectrum_id":"CCMSLIB00017224621","spectrum_index":9593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 168.1884 Da; putative annotation: N/A; putative formula: C12H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.275,"smiles":null,"spectrum_id":"CCMSLIB00017224622","spectrum_index":9594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 17.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.128,"smiles":null,"spectrum_id":"CCMSLIB00017224624","spectrum_index":9595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 637.7428 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":859.84,"smiles":null,"spectrum_id":"CCMSLIB00017224627","spectrum_index":9596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8Z,14Z-Eicosadienoic acid (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.274,"smiles":null,"spectrum_id":"CCMSLIB00017224628","spectrum_index":9597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 261.1582 Da; putative annotation: N/A; putative formula: C13H27NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.229,"smiles":null,"spectrum_id":"CCMSLIB00017224630","spectrum_index":9598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.beta.-Hydroxyexemestane (delta mass: 109.0561 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.257,"smiles":null,"spectrum_id":"CCMSLIB00017224633","spectrum_index":9599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 323.364 Da; putative annotation: N/A; putative formula: C21H45N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.412,"smiles":null,"spectrum_id":"CCMSLIB00017224635","spectrum_index":9600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 286.2672 Da; putative annotation: N/A; putative formula: C21H34)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.38,"smiles":null,"spectrum_id":"CCMSLIB00017224636","spectrum_index":9601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 295.2668 Da; putative annotation: N/A; putative formula: C22H33NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.52,"smiles":null,"spectrum_id":"CCMSLIB00017224639","spectrum_index":9602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-quinolin-4-yl(5-vinylquinuclidin-2-yl)methanol (delta mass: 321.3133 Da; putative annotation: N/A; putative formula: C20H39N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.494,"smiles":null,"spectrum_id":"CCMSLIB00017224641","spectrum_index":9603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Florfenicol (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.034,"smiles":null,"spectrum_id":"CCMSLIB00017224642","spectrum_index":9604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 145.1168 Da; putative annotation: N/A; putative formula: C2H11N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.228,"smiles":null,"spectrum_id":"CCMSLIB00017224645","spectrum_index":9605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 791.5875 Da; putative annotation: N/A; putative formula: C41H81N3O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":905.679,"smiles":null,"spectrum_id":"CCMSLIB00017224647","spectrum_index":9606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 15.9948 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.222,"smiles":null,"spectrum_id":"CCMSLIB00017224648","spectrum_index":9607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 41.9279 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.04,"smiles":null,"spectrum_id":"CCMSLIB00017224651","spectrum_index":9608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 49.0312 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.096,"smiles":null,"spectrum_id":"CCMSLIB00017224653","spectrum_index":9609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 128.1049 Da; putative annotation: N/A; putative formula: C5H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.347,"smiles":null,"spectrum_id":"CCMSLIB00017224654","spectrum_index":9610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 60.0367 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.321,"smiles":null,"spectrum_id":"CCMSLIB00017224657","spectrum_index":9611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 39.9479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.06,"smiles":null,"spectrum_id":"CCMSLIB00017224658","spectrum_index":9612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vincamine (delta mass: 4.2984 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.5,"smiles":null,"spectrum_id":"CCMSLIB00017224660","spectrum_index":9613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-isopropylthiophenethylamine (delta mass: 92.0078 Da; putative annotation: N/A; putative formula: C6H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.144,"smiles":null,"spectrum_id":"CCMSLIB00017224663","spectrum_index":9614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 104.0475 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.123,"smiles":null,"spectrum_id":"CCMSLIB00017224664","spectrum_index":9615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 15.9585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017224666","spectrum_index":9616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-7,12-Dihydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 142.078 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.284,"smiles":null,"spectrum_id":"CCMSLIB00017224669","spectrum_index":9617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 173.0827 Da; putative annotation: N/A; putative formula: C5H12N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.159,"smiles":null,"spectrum_id":"CCMSLIB00017224670","spectrum_index":9618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 92.0109 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.123,"smiles":null,"spectrum_id":"CCMSLIB00017224671","spectrum_index":9619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl vanillate (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.06,"smiles":null,"spectrum_id":"CCMSLIB00017224675","spectrum_index":9620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 39.4892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.57,"smiles":null,"spectrum_id":"CCMSLIB00017224676","spectrum_index":9621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 30.0 eV (delta mass: 1043.3744 Da; putative annotation: N/A; putative formula: C62H53N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1386.5,"smiles":null,"spectrum_id":"CCMSLIB00017224677","spectrum_index":9622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 150.1083 Da; putative annotation: N/A; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.179,"smiles":null,"spectrum_id":"CCMSLIB00017224681","spectrum_index":9623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 570.2264 Da; putative annotation: N/A; putative formula: C35H38O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.349,"smiles":null,"spectrum_id":"CCMSLIB00017224682","spectrum_index":9624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE - 70.0 eV (delta mass: 55.0444 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.089,"smiles":null,"spectrum_id":"CCMSLIB00017224685","spectrum_index":9625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 40.0423 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.123,"smiles":null,"spectrum_id":"CCMSLIB00017224687","spectrum_index":9626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 55.0831 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.163,"smiles":null,"spectrum_id":"CCMSLIB00017224689","spectrum_index":9627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 122.0731 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.295,"smiles":null,"spectrum_id":"CCMSLIB00017224692","spectrum_index":9628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 51.0502 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.129,"smiles":null,"spectrum_id":"CCMSLIB00017224693","spectrum_index":9629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 70.0892 Da; putative annotation: N/A; putative formula: C4H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.139,"smiles":null,"spectrum_id":"CCMSLIB00017224694","spectrum_index":9630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 29.0885 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.165,"smiles":null,"spectrum_id":"CCMSLIB00017224696","spectrum_index":9631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 61.9968 Da; putative annotation: N/A; putative formula: H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.045,"smiles":null,"spectrum_id":"CCMSLIB00017224699","spectrum_index":9632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,2,3,4-Tetrahydro-9H-carbazol-9-yl)propanohydrazide (delta mass: 179.0446 Da; putative annotation: N/A; putative formula: C6H5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.205,"smiles":null,"spectrum_id":"CCMSLIB00017224700","spectrum_index":9633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 159.0896 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.202,"smiles":null,"spectrum_id":"CCMSLIB00017224701","spectrum_index":9634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Shikimic acid (delta mass: 60.0364 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017224705","spectrum_index":9635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 578.2251 Da; putative annotation: N/A; putative formula: C28H26N12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.343,"smiles":null,"spectrum_id":"CCMSLIB00017224706","spectrum_index":9636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.196,"smiles":null,"spectrum_id":"CCMSLIB00017224707","spectrum_index":9637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 63.9975 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.104,"smiles":null,"spectrum_id":"CCMSLIB00017224708","spectrum_index":9638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 7.989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.08,"smiles":null,"spectrum_id":"CCMSLIB00017224712","spectrum_index":9639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006021 (+/-) Salsolinol|1-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 228.1929 Da; putative annotation: N/A; putative formula: C7H20N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.295,"smiles":null,"spectrum_id":"CCMSLIB00017224713","spectrum_index":9640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 155.1004 Da; putative annotation: N/A; putative formula: C3H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.176,"smiles":null,"spectrum_id":"CCMSLIB00017224714","spectrum_index":9641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 63.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.285,"smiles":null,"spectrum_id":"CCMSLIB00017224717","spectrum_index":9642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026601 5?-CHOLANIC ACID-3?-OL-7_12-DIONE|3-Hydroxy-7,12-diketocholanoic acid|(4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydro-1H-cyclopenta[a (delta mass: 420.2514 Da; putative annotation: N/A; putative formula: C24H36O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.515,"smiles":null,"spectrum_id":"CCMSLIB00017224718","spectrum_index":9643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 234.1659 Da; putative annotation: N/A; putative formula: C14H23N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.226,"smiles":null,"spectrum_id":"CCMSLIB00017224719","spectrum_index":9644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 124.0885 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.326,"smiles":null,"spectrum_id":"CCMSLIB00017224723","spectrum_index":9645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 90.0835 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.352,"smiles":null,"spectrum_id":"CCMSLIB00017224724","spectrum_index":9646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 801.4369 Da; putative annotation: N/A; putative formula: C37H63N5O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":982.508,"smiles":null,"spectrum_id":"CCMSLIB00017224725","spectrum_index":9647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Sitosterol (delta mass: 48.036 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.429,"smiles":null,"spectrum_id":"CCMSLIB00017224728","spectrum_index":9648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 72.0215 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.145,"smiles":null,"spectrum_id":"CCMSLIB00017224730","spectrum_index":9649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 199.1935 Da; putative annotation: N/A; putative formula: C12H25NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.269,"smiles":null,"spectrum_id":"CCMSLIB00017224731","spectrum_index":9650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 303.21 Da; putative annotation: N/A; putative formula: C21H25N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.421,"smiles":null,"spectrum_id":"CCMSLIB00017224734","spectrum_index":9651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 674.2216 Da; putative annotation: N/A; putative formula: C36H39N2O7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.319,"smiles":null,"spectrum_id":"CCMSLIB00017224736","spectrum_index":9652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 42.01 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.112,"smiles":null,"spectrum_id":"CCMSLIB00017224737","spectrum_index":9653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hexamethylolmelamine pentamethyl ether (putative) (delta mass: 164.0803 Da; putative annotation: N/A; putative formula: C5H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.295,"smiles":null,"spectrum_id":"CCMSLIB00017224741","spectrum_index":9654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 193.0593 Da; putative annotation: N/A; putative formula: C7H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.218,"smiles":null,"spectrum_id":"CCMSLIB00017224742","spectrum_index":9655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 alcohol (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.284,"smiles":null,"spectrum_id":"CCMSLIB00017224743","spectrum_index":9656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 41.0261 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.378,"smiles":null,"spectrum_id":"CCMSLIB00017224746","spectrum_index":9657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-C13:0 (delta mass: 55.0504 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.299,"smiles":null,"spectrum_id":"CCMSLIB00017224749","spectrum_index":9658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331602 Linoleic acid|(9Z,12Z)-octadeca-9,12-dienoic acid (delta mass: 171.1025 Da; putative annotation: N/A; putative formula: C6H14N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.35,"smiles":null,"spectrum_id":"CCMSLIB00017224752","spectrum_index":9659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Acetaminobenzoic acid (delta mass: 75.0582 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.124,"smiles":null,"spectrum_id":"CCMSLIB00017224754","spectrum_index":9660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 116.0475 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.088,"smiles":null,"spectrum_id":"CCMSLIB00017224755","spectrum_index":9661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 139.0402 Da; putative annotation: N/A; putative formula: C4H6N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.309,"smiles":null,"spectrum_id":"CCMSLIB00017224758","spectrum_index":9662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aloesin (delta mass: 162.0315 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.165,"smiles":null,"spectrum_id":"CCMSLIB00017224760","spectrum_index":9663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 325.2984 Da; putative annotation: N/A; putative formula: C20H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.546,"smiles":null,"spectrum_id":"CCMSLIB00017224761","spectrum_index":9664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 375.2626 Da; putative annotation: N/A; putative formula: C20H41NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.474,"smiles":null,"spectrum_id":"CCMSLIB00017224762","spectrum_index":9665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 160.0518 Da; putative annotation: N/A; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.19,"smiles":null,"spectrum_id":"CCMSLIB00017224766","spectrum_index":9666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-tridecylpiperidine (delta mass: 366.351 Da; putative annotation: N/A; putative formula: C24H46O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.667,"smiles":null,"spectrum_id":"CCMSLIB00017224767","spectrum_index":9667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 397.2355 Da; putative annotation: N/A; putative formula: C25H36NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.359,"smiles":null,"spectrum_id":"CCMSLIB00017224768","spectrum_index":9668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 43.99 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.076,"smiles":null,"spectrum_id":"CCMSLIB00017224772","spectrum_index":9669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-3,4-dimethyl- (delta mass: 73.0842 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.291,"smiles":null,"spectrum_id":"CCMSLIB00017224773","spectrum_index":9670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 162.057 Da; putative annotation: N/A; putative formula: C4H10N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017224774","spectrum_index":9671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Pregnen-3.beta.-ol-20-one (delta mass: 100.0682 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.316,"smiles":null,"spectrum_id":"CCMSLIB00017224778","spectrum_index":9672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thuggacin A (delta mass: 482.653 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1115.01,"smiles":null,"spectrum_id":"CCMSLIB00017224779","spectrum_index":9673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 909.4719 Da; putative annotation: N/A; putative formula: C59H63N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1192.57,"smiles":null,"spectrum_id":"CCMSLIB00017224780","spectrum_index":9674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 633.2272 Da; putative annotation: N/A; putative formula: C41H35N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.287,"smiles":null,"spectrum_id":"CCMSLIB00017224784","spectrum_index":9675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 408.3021 Da; putative annotation: N/A; putative formula: C22H41N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.398,"smiles":null,"spectrum_id":"CCMSLIB00017224785","spectrum_index":9676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 158.0195 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.143,"smiles":null,"spectrum_id":"CCMSLIB00017224786","spectrum_index":9677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PROPYLPARABEN (delta mass: 56.062 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017224790","spectrum_index":9678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxo-5Z,8Z,10E,14Z-eicosatetraenoic acid (delta mass: 66.0466 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.273,"smiles":null,"spectrum_id":"CCMSLIB00017224791","spectrum_index":9679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 377.0899 Da; putative annotation: N/A; putative formula: C21H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.15,"smiles":null,"spectrum_id":"CCMSLIB00017224792","spectrum_index":9680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 427.2907 Da; putative annotation: N/A; putative formula: C19H37N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.351,"smiles":null,"spectrum_id":"CCMSLIB00017224793","spectrum_index":9681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 847.3784 Da; putative annotation: N/A; putative formula: C60H45N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.417,"smiles":null,"spectrum_id":"CCMSLIB00017224797","spectrum_index":9682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 19.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.262,"smiles":null,"spectrum_id":"CCMSLIB00017224798","spectrum_index":9683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phytomonic acid (delta mass: 115.9775 Da; putative annotation: N/A; putative formula: C2HN2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.256,"smiles":null,"spectrum_id":"CCMSLIB00017224799","spectrum_index":9684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 42.1192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.19,"smiles":null,"spectrum_id":"CCMSLIB00017224803","spectrum_index":9685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 78.0316 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017224804","spectrum_index":9686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 78.032 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.233,"smiles":null,"spectrum_id":"CCMSLIB00017224807","spectrum_index":9687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.18,"smiles":null,"spectrum_id":"CCMSLIB00017224809","spectrum_index":9688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 74.0514 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.247,"smiles":null,"spectrum_id":"CCMSLIB00017224811","spectrum_index":9689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 126.047 Da; putative annotation: N/A; putative formula: C10H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.117,"smiles":null,"spectrum_id":"CCMSLIB00017224814","spectrum_index":9690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 1207.792 Da; putative annotation: N/A; putative formula: C61H113N3O20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1883.04,"smiles":null,"spectrum_id":"CCMSLIB00017224816","spectrum_index":9691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 35.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.3,"smiles":null,"spectrum_id":"CCMSLIB00017224818","spectrum_index":9692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,9a,9b-octahydrobenzo[g][1]benzofuran-2-one (delta mass: 91.0633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.228,"smiles":null,"spectrum_id":"CCMSLIB00017224820","spectrum_index":9693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 60.0353 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.393,"smiles":null,"spectrum_id":"CCMSLIB00017224822","spectrum_index":9694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 92.0376 Da; putative annotation: N/A; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.124,"smiles":null,"spectrum_id":"CCMSLIB00017224824","spectrum_index":9695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Resibufogenin (delta mass: 370.2717 Da; putative annotation: N/A; putative formula: C21H38O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.509,"smiles":null,"spectrum_id":"CCMSLIB00017224825","spectrum_index":9696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 161.1776 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.217,"smiles":null,"spectrum_id":"CCMSLIB00017224828","spectrum_index":9697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 46.0046 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.122,"smiles":null,"spectrum_id":"CCMSLIB00017224830","spectrum_index":9698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(Isobutylamino)methyl]benzoic acid (delta mass: 30.9942 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.127,"smiles":null,"spectrum_id":"CCMSLIB00017224831","spectrum_index":9699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 177.0424 Da; putative annotation: N/A; putative formula: C9H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.124,"smiles":null,"spectrum_id":"CCMSLIB00017224834","spectrum_index":9700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,2'R,4a'S,6'R,8a'S)-4,6'-dihydroxy-2',5',5',8a'-tetramethyl-3',4',4a',5',6',7',8',8a'-octahydro-2'H,3H-spiro[benzo[2,1-b:3,4-c']difuran-2,1'-naphthalen]-6(8H)-one (delta mass: 17.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.242,"smiles":null,"spectrum_id":"CCMSLIB00017224835","spectrum_index":9701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelenteramine (delta mass: 71.9845 Da; putative annotation: N/A; putative formula: C2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.113,"smiles":null,"spectrum_id":"CCMSLIB00017224836","spectrum_index":9702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 242.1155 Da; putative annotation: N/A; putative formula: C12H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.186,"smiles":null,"spectrum_id":"CCMSLIB00017224839","spectrum_index":9703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 511.3142 Da; putative annotation: N/A; putative formula: C27H45NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.546,"smiles":null,"spectrum_id":"CCMSLIB00017224841","spectrum_index":9704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2 ethanolamide (delta mass: 114.0889 Da; putative annotation: N/A; putative formula: C4H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.363,"smiles":null,"spectrum_id":"CCMSLIB00017224842","spectrum_index":9705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 14.006 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.048,"smiles":null,"spectrum_id":"CCMSLIB00017224845","spectrum_index":9706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-5-oxopentanoic acid CollisionEnergy:102040 (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017224847","spectrum_index":9707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 284.0123 Da; putative annotation: N/A; putative formula: C8H13O7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.087,"smiles":null,"spectrum_id":"CCMSLIB00017224849","spectrum_index":9708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 297.3044 Da; putative annotation: N/A; putative formula: C19H39NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.417,"smiles":null,"spectrum_id":"CCMSLIB00017224851","spectrum_index":9709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 74.037 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.269,"smiles":null,"spectrum_id":"CCMSLIB00017224853","spectrum_index":9710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 66.0467 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.258,"smiles":null,"spectrum_id":"CCMSLIB00017224854","spectrum_index":9711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 85.0644 Da; putative annotation: N/A; putative formula: C3H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.27,"smiles":null,"spectrum_id":"CCMSLIB00017224856","spectrum_index":9712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 112.8947 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.937,"smiles":null,"spectrum_id":"CCMSLIB00017224859","spectrum_index":9713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(2-Hydroxyphenoxy)ethoxy]phenol (delta mass: 96.0421 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.139,"smiles":null,"spectrum_id":"CCMSLIB00017224861","spectrum_index":9714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 72.0317 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.196,"smiles":null,"spectrum_id":"CCMSLIB00017224862","spectrum_index":9715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybutyrylcarnitine (delta mass: 66.0093 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.159,"smiles":null,"spectrum_id":"CCMSLIB00017224864","spectrum_index":9716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 169.0744 Da; putative annotation: N/A; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.129,"smiles":null,"spectrum_id":"CCMSLIB00017224866","spectrum_index":9717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Globulol (delta mass: 46.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.248,"smiles":null,"spectrum_id":"CCMSLIB00017224869","spectrum_index":9718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Pro (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.214,"smiles":null,"spectrum_id":"CCMSLIB00017224870","spectrum_index":9719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 295.2511 Da; putative annotation: N/A; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.311,"smiles":null,"spectrum_id":"CCMSLIB00017224872","spectrum_index":9720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 279.1677 Da; putative annotation: N/A; putative formula: C12H25NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.228,"smiles":null,"spectrum_id":"CCMSLIB00017224874","spectrum_index":9721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 345.1878 Da; putative annotation: N/A; putative formula: C27H23NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.229,"smiles":null,"spectrum_id":"CCMSLIB00017224875","spectrum_index":9722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 313.0799 Da; putative annotation: N/A; putative formula: C13H15NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.119,"smiles":null,"spectrum_id":"CCMSLIB00017224878","spectrum_index":9723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYBENZOATE (delta mass: 77.0839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017224880","spectrum_index":9724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 44.0266 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.133,"smiles":null,"spectrum_id":"CCMSLIB00017224881","spectrum_index":9725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 41.1283 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.225,"smiles":null,"spectrum_id":"CCMSLIB00017224883","spectrum_index":9726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 51.9955 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.077,"smiles":null,"spectrum_id":"CCMSLIB00017224886","spectrum_index":9727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 18.0088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.079,"smiles":null,"spectrum_id":"CCMSLIB00017224887","spectrum_index":9728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 262.2312 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.312,"smiles":null,"spectrum_id":"CCMSLIB00017224889","spectrum_index":9729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,8-Dihydroxy-1,5,8-trimethyl-4,5a,6,7,8a,9-hexahydro-3aH-azuleno[6,5-b]furan-2-one (delta mass: 144.0428 Da; putative annotation: N/A; putative formula: C7H12O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.202,"smiles":null,"spectrum_id":"CCMSLIB00017224892","spectrum_index":9730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(15)-Selinene-11,12-diol (delta mass: 179.0786 Da; putative annotation: N/A; putative formula: C3H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.279,"smiles":null,"spectrum_id":"CCMSLIB00017224893","spectrum_index":9731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 50.0156 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017224895","spectrum_index":9732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 71.0196 Da; putative annotation: N/A; putative formula: C3H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.117,"smiles":null,"spectrum_id":"CCMSLIB00017224898","spectrum_index":9733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 63.9367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.002,"smiles":null,"spectrum_id":"CCMSLIB00017224900","spectrum_index":9734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 5.0997 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.1,"smiles":null,"spectrum_id":"CCMSLIB00017224902","spectrum_index":9735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 256.1096 Da; putative annotation: N/A; putative formula: C16H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.164,"smiles":null,"spectrum_id":"CCMSLIB00017224903","spectrum_index":9736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 89.0628 Da; putative annotation: N/A; putative formula: C7H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.097,"smiles":null,"spectrum_id":"CCMSLIB00017224905","spectrum_index":9737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 122.1029 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":858.594,"smiles":null,"spectrum_id":"CCMSLIB00017224907","spectrum_index":9738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-tetrahydro-6-methoxy-1-oxo-beta-carboline (delta mass: 140.0345 Da; putative annotation: N/A; putative formula: C4H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.132,"smiles":null,"spectrum_id":"CCMSLIB00017224910","spectrum_index":9739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-17-ol-3,20-dione (delta mass: 77.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.289,"smiles":null,"spectrum_id":"CCMSLIB00017224912","spectrum_index":9740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 74.0343 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.136,"smiles":null,"spectrum_id":"CCMSLIB00017224913","spectrum_index":9741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.274,"smiles":null,"spectrum_id":"CCMSLIB00017224914","spectrum_index":9742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 268.1787 Da; putative annotation: N/A; putative formula: C14H24N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.307,"smiles":null,"spectrum_id":"CCMSLIB00017224917","spectrum_index":9743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 11.9999 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.097,"smiles":null,"spectrum_id":"CCMSLIB00017224918","spectrum_index":9744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-butyric acid CollisionEnergy:102040 (delta mass: 7.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017224920","spectrum_index":9745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 794.4475 Da; putative annotation: N/A; putative formula: C44H66N4O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":975.518,"smiles":null,"spectrum_id":"CCMSLIB00017224923","spectrum_index":9746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Amino-1-phenylethyl)dimethylamine (delta mass: 37.9538 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.092,"smiles":null,"spectrum_id":"CCMSLIB00017224924","spectrum_index":9747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 82.0421 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.284,"smiles":null,"spectrum_id":"CCMSLIB00017224925","spectrum_index":9748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 216.0415 Da; putative annotation: N/A; putative formula: C6H9N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.128,"smiles":null,"spectrum_id":"CCMSLIB00017224929","spectrum_index":9749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 169.0951 Da; putative annotation: N/A; putative formula: C6H11N5O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.165,"smiles":null,"spectrum_id":"CCMSLIB00017224930","spectrum_index":9750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311082 Dicoumaroyl Spermidine (delta mass: 146.039 Da; putative annotation: N/A; putative formula: C8H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.278,"smiles":null,"spectrum_id":"CCMSLIB00017224931","spectrum_index":9751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 361.1735 Da; putative annotation: N/A; putative formula: C16H27NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.228,"smiles":null,"spectrum_id":"CCMSLIB00017224934","spectrum_index":9752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Urospermal (delta mass: 70.0784 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.201,"smiles":null,"spectrum_id":"CCMSLIB00017224936","spectrum_index":9753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 444.1272 Da; putative annotation: N/A; putative formula: C19H24O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.282,"smiles":null,"spectrum_id":"CCMSLIB00017224937","spectrum_index":9754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 63.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.154,"smiles":null,"spectrum_id":"CCMSLIB00017224940","spectrum_index":9755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 70.0779 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017224941","spectrum_index":9756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 112.0509 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.132,"smiles":null,"spectrum_id":"CCMSLIB00017224942","spectrum_index":9757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 45.0217 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017224946","spectrum_index":9758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 136.0889 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.404,"smiles":null,"spectrum_id":"CCMSLIB00017224947","spectrum_index":9759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 59.0369 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.191,"smiles":null,"spectrum_id":"CCMSLIB00017224948","spectrum_index":9760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 1215.4444 Da; putative annotation: N/A; putative formula: C94H57NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1558.57,"smiles":null,"spectrum_id":"CCMSLIB00017224950","spectrum_index":9761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1089.6579 Da; putative annotation: N/A; putative formula: C55H91N7O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1270.73,"smiles":null,"spectrum_id":"CCMSLIB00017224953","spectrum_index":9762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 545.3457 Da; putative annotation: N/A; putative formula: C32H52NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1041.69,"smiles":null,"spectrum_id":"CCMSLIB00017224954","spectrum_index":9763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoleoylglycine (delta mass: 85.0928 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.362,"smiles":null,"spectrum_id":"CCMSLIB00017224956","spectrum_index":9764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 38.0509 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.241,"smiles":null,"spectrum_id":"CCMSLIB00017224959","spectrum_index":9765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 34.0063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.238,"smiles":null,"spectrum_id":"CCMSLIB00017224960","spectrum_index":9766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 344.0736 Da; putative annotation: N/A; putative formula: C12H12N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.16,"smiles":null,"spectrum_id":"CCMSLIB00017224962","spectrum_index":9767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 84.0579 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.16,"smiles":null,"spectrum_id":"CCMSLIB00017224965","spectrum_index":9768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 81.0313 Da; putative annotation: N/A; putative formula: C3H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.113,"smiles":null,"spectrum_id":"CCMSLIB00017224967","spectrum_index":9769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 265.0794 Da; putative annotation: N/A; putative formula: C9H15NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.364,"smiles":null,"spectrum_id":"CCMSLIB00017224968","spectrum_index":9770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 139.1431 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.38,"smiles":null,"spectrum_id":"CCMSLIB00017224970","spectrum_index":9771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 106.0782 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.143,"smiles":null,"spectrum_id":"CCMSLIB00017224973","spectrum_index":9772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 76.0673 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017224975","spectrum_index":9773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 264.1576 Da; putative annotation: N/A; putative formula: C12H24O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.218,"smiles":null,"spectrum_id":"CCMSLIB00017224977","spectrum_index":9774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Glu (delta mass: 111.0319 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.176,"smiles":null,"spectrum_id":"CCMSLIB00017224978","spectrum_index":9775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 156.1364 Da; putative annotation: N/A; putative formula: C7H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.478,"smiles":null,"spectrum_id":"CCMSLIB00017224980","spectrum_index":9776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 36.097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.162,"smiles":null,"spectrum_id":"CCMSLIB00017224981","spectrum_index":9777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,18-Dihydroxykaurenolide (delta mass: 108.0939 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017224985","spectrum_index":9778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 202.0267 Da; putative annotation: N/A; putative formula: C11H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.122,"smiles":null,"spectrum_id":"CCMSLIB00017224986","spectrum_index":9779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00850 Dehydro-piliformic-acid (delta mass: 134.0181 Da; putative annotation: N/A; putative formula: C2H7N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.13,"smiles":null,"spectrum_id":"CCMSLIB00017224987","spectrum_index":9780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 197.0896 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.196,"smiles":null,"spectrum_id":"CCMSLIB00017224991","spectrum_index":9781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 76.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.362,"smiles":null,"spectrum_id":"CCMSLIB00017224992","spectrum_index":9782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10(S),17(S)-Dihydroxy-4Z,7Z,11E,13Z,15E,19Z-docosahexaenoic acid (delta mass: 67.0194 Da; putative annotation: N/A; putative formula: C2HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.257,"smiles":null,"spectrum_id":"CCMSLIB00017224993","spectrum_index":9783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.065,"smiles":null,"spectrum_id":"CCMSLIB00017224996","spectrum_index":9784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 215.0211 Da; putative annotation: N/A; putative formula: C5H6N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.123,"smiles":null,"spectrum_id":"CCMSLIB00017224998","spectrum_index":9785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methylephedrine (delta mass: 248.0978 Da; putative annotation: N/A; putative formula: C5H12N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.236,"smiles":null,"spectrum_id":"CCMSLIB00017224999","spectrum_index":9786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 455.7171 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.788,"smiles":null,"spectrum_id":"CCMSLIB00017225001","spectrum_index":9787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 102.072 Da; putative annotation: N/A; putative formula: C4H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.138,"smiles":null,"spectrum_id":"CCMSLIB00017225004","spectrum_index":9788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 619.3567 Da; putative annotation: N/A; putative formula: C28H41N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":970.61,"smiles":null,"spectrum_id":"CCMSLIB00017225005","spectrum_index":9789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methylphenyl)-2,3,4,9-tetrahydro-1H-.beta.-carboline (delta mass: 46.0645 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.219,"smiles":null,"spectrum_id":"CCMSLIB00017225007","spectrum_index":9790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 220.0349 Da; putative annotation: N/A; putative formula: C15H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.137,"smiles":null,"spectrum_id":"CCMSLIB00017225010","spectrum_index":9791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 623.1753 Da; putative annotation: N/A; putative formula: C30H29N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.216,"smiles":null,"spectrum_id":"CCMSLIB00017225011","spectrum_index":9792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 400.1576 Da; putative annotation: N/A; putative formula: C28H20N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.218,"smiles":null,"spectrum_id":"CCMSLIB00017225013","spectrum_index":9793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 3.3774 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017225016","spectrum_index":9794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipivefrine (delta mass: 60.0367 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.249,"smiles":null,"spectrum_id":"CCMSLIB00017225018","spectrum_index":9795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Genipin (delta mass: 297.1211 Da; putative annotation: N/A; putative formula: C14H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.213,"smiles":null,"spectrum_id":"CCMSLIB00017225019","spectrum_index":9796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 88.0675 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.331,"smiles":null,"spectrum_id":"CCMSLIB00017225022","spectrum_index":9797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-L-.alpha.-lysophosphatidic acid (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.293,"smiles":null,"spectrum_id":"CCMSLIB00017225024","spectrum_index":9798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.263,"smiles":null,"spectrum_id":"CCMSLIB00017225026","spectrum_index":9799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 46.041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.08,"smiles":null,"spectrum_id":"CCMSLIB00017225030","spectrum_index":9800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 166.1161 Da; putative annotation: N/A; putative formula: C14H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.358,"smiles":null,"spectrum_id":"CCMSLIB00017225032","spectrum_index":9801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,11-Undecanedicarboxylic acid (delta mass: 36.0341 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.209,"smiles":null,"spectrum_id":"CCMSLIB00017225034","spectrum_index":9802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one (delta mass: 60.0359 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.252,"smiles":null,"spectrum_id":"CCMSLIB00017225036","spectrum_index":9803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 41.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.123,"smiles":null,"spectrum_id":"CCMSLIB00017225037","spectrum_index":9804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 198.1374 Da; putative annotation: N/A; putative formula: C10H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.234,"smiles":null,"spectrum_id":"CCMSLIB00017225040","spectrum_index":9805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 190.4297 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.5,"smiles":null,"spectrum_id":"CCMSLIB00017225042","spectrum_index":9806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 798.4258 Da; putative annotation: N/A; putative formula: C38H70O13S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1059.46,"smiles":null,"spectrum_id":"CCMSLIB00017225043","spectrum_index":9807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 296.032 Da; putative annotation: N/A; putative formula: C16H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.103,"smiles":null,"spectrum_id":"CCMSLIB00017225044","spectrum_index":9808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 74.067 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.33,"smiles":null,"spectrum_id":"CCMSLIB00017225048","spectrum_index":9809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 34.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017225049","spectrum_index":9810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rosiridol (delta mass: 355.1121 Da; putative annotation: N/A; putative formula: C13H25NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.25,"smiles":null,"spectrum_id":"CCMSLIB00017225053","spectrum_index":9811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 191.0788 Da; putative annotation: N/A; putative formula: C7H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.212,"smiles":null,"spectrum_id":"CCMSLIB00017225054","spectrum_index":9812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 200.1083 Da; putative annotation: N/A; putative formula: C9H17N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.163,"smiles":null,"spectrum_id":"CCMSLIB00017225055","spectrum_index":9813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 158031 - 30.0 eV (delta mass: 16.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.117,"smiles":null,"spectrum_id":"CCMSLIB00017225058","spectrum_index":9814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid (delta mass: 121.0735 Da; putative annotation: N/A; putative formula: C5H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.112,"smiles":null,"spectrum_id":"CCMSLIB00017225060","spectrum_index":9815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311014 Feruloyl agmatine (isomer of 1607) (delta mass: 176.0324 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.209,"smiles":null,"spectrum_id":"CCMSLIB00017225061","spectrum_index":9816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 160.0528 Da; putative annotation: 3-Methoxycinnamic acid; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.144,"smiles":null,"spectrum_id":"CCMSLIB00017225064","spectrum_index":9817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 121.0532 Da; putative annotation: 3-hydroxy-1,2-dimethylpyridin-4(1H)-one; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017225066","spectrum_index":9818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 276.2064 Da; putative annotation: Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14; putative formula: C18H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.428,"smiles":null,"spectrum_id":"CCMSLIB00017225067","spectrum_index":9819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 104.0261 Da; putative annotation: 4-Hydroxybenzaldehyde; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.076,"smiles":null,"spectrum_id":"CCMSLIB00017225070","spectrum_index":9820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 286.193 Da; putative annotation: h_266_oxandrolone_m3; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.435,"smiles":null,"spectrum_id":"CCMSLIB00017225072","spectrum_index":9821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetamide (delta mass: 129.0414 Da; putative annotation: L-(+)-Glutamic acid - 30.0 eV; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.128,"smiles":null,"spectrum_id":"CCMSLIB00017225074","spectrum_index":9822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 104.0258 Da; putative annotation: Benzoic acid; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.138,"smiles":null,"spectrum_id":"CCMSLIB00017225077","spectrum_index":9823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 352.106 Da; putative annotation: 1-[3-Carboxy-3-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]propyl]pyridin-1-ium-3-carboxylate; putative formula: C19H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.192,"smiles":null,"spectrum_id":"CCMSLIB00017225078","spectrum_index":9824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 228.077 Da; putative annotation: Kawainol; putative formula: C14H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.153,"smiles":null,"spectrum_id":"CCMSLIB00017225079","spectrum_index":9825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Adamantanol (delta mass: 184.1126 Da; putative annotation: Sebacic acid; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.24,"smiles":null,"spectrum_id":"CCMSLIB00017225081","spectrum_index":9826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 239.0713 Da; putative annotation: 2-Chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide; putative formula: C12H14ClNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.126,"smiles":null,"spectrum_id":"CCMSLIB00017225084","spectrum_index":9827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 169.0738 Da; putative annotation: Massbank:RP021303 3-hydroxy-C4-homoserine lactone|3-hydroxy-N-(2-oxooxolan-3-yl)butanamide; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.134,"smiles":null,"spectrum_id":"CCMSLIB00017225085","spectrum_index":9828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 40.0 eV (delta mass: 161.066 Da; putative annotation: Spectral Match to D-Glucosamine from NIST14; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.242,"smiles":null,"spectrum_id":"CCMSLIB00017225088","spectrum_index":9829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 118.0736 Da; putative annotation: N/A; putative formula: C4H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.306,"smiles":null,"spectrum_id":"CCMSLIB00017225090","spectrum_index":9830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 56.0662 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.205,"smiles":null,"spectrum_id":"CCMSLIB00017225091","spectrum_index":9831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 138.0834 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017225094","spectrum_index":9832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.295,"smiles":null,"spectrum_id":"CCMSLIB00017225097","spectrum_index":9833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 130.0989 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.179,"smiles":null,"spectrum_id":"CCMSLIB00017225099","spectrum_index":9834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Norandrosterone (delta mass: 124.0679 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.284,"smiles":null,"spectrum_id":"CCMSLIB00017225100","spectrum_index":9835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,11-Tridecadienoic acid, 13-(3-pentyl-2-oxiranyl)-, (8Z,11Z)- (delta mass: 74.0366 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.295,"smiles":null,"spectrum_id":"CCMSLIB00017225102","spectrum_index":9836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 71.0609 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.356,"smiles":null,"spectrum_id":"CCMSLIB00017225103","spectrum_index":9837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 88.0669 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.325,"smiles":null,"spectrum_id":"CCMSLIB00017225107","spectrum_index":9838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 75.9258 Da; putative annotation: N/A; putative formula: H-2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.986,"smiles":null,"spectrum_id":"CCMSLIB00017225108","spectrum_index":9839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 148.053 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.186,"smiles":null,"spectrum_id":"CCMSLIB00017225109","spectrum_index":9840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 38.0181 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.109,"smiles":null,"spectrum_id":"CCMSLIB00017225113","spectrum_index":9841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 99.0313 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.07,"smiles":null,"spectrum_id":"CCMSLIB00017225114","spectrum_index":9842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 28.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.085,"smiles":null,"spectrum_id":"CCMSLIB00017225115","spectrum_index":9843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 53.0472 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.332,"smiles":null,"spectrum_id":"CCMSLIB00017225119","spectrum_index":9844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hederagenin (delta mass: 39.9926 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.355,"smiles":null,"spectrum_id":"CCMSLIB00017225120","spectrum_index":9845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 130.0505 Da; putative annotation: N/A; putative formula: C3H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.112,"smiles":null,"spectrum_id":"CCMSLIB00017225121","spectrum_index":9846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 98.0728 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017225125","spectrum_index":9847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-cis-Retinol (delta mass: 89.0476 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.284,"smiles":null,"spectrum_id":"CCMSLIB00017225126","spectrum_index":9848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 186.0979 Da; putative annotation: N/A; putative formula: C4H10N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.196,"smiles":null,"spectrum_id":"CCMSLIB00017225128","spectrum_index":9849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 40.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.17,"smiles":null,"spectrum_id":"CCMSLIB00017225130","spectrum_index":9850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 26.0872 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.122,"smiles":null,"spectrum_id":"CCMSLIB00017225132","spectrum_index":9851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 98.0731 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017225134","spectrum_index":9852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347570-02_C26H29N3O3_3-{[2,2-Dimethyl-7-(2-methyl-3-buten-2-yl)-2,8-dihydropyrano[3,2-f]indol-6-yl]methyl}-2,3,6,7-tetrahydropyrrolo[1,2-a]pyrazine-1,4-dione (delta mass: 431.2181 Da; putative annotation: N/A; putative formula: C22H25N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":863.446,"smiles":null,"spectrum_id":"CCMSLIB00017225136","spectrum_index":9853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Threonine methyl ester (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.092,"smiles":null,"spectrum_id":"CCMSLIB00017225137","spectrum_index":9854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 222.198 Da; putative annotation: N/A; putative formula: C15H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.295,"smiles":null,"spectrum_id":"CCMSLIB00017225140","spectrum_index":9855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 190.0983 Da; putative annotation: N/A; putative formula: C6H15N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.32,"smiles":null,"spectrum_id":"CCMSLIB00017225142","spectrum_index":9856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 243.1483 Da; putative annotation: N/A; putative formula: C13H17N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.37,"smiles":null,"spectrum_id":"CCMSLIB00017225144","spectrum_index":9857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 112.0905 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.167,"smiles":null,"spectrum_id":"CCMSLIB00017225146","spectrum_index":9858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 163.0733 Da; putative annotation: N/A; putative formula: C8H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017225148","spectrum_index":9859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 123.0902 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.322,"smiles":null,"spectrum_id":"CCMSLIB00017225151","spectrum_index":9860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 112.0373 Da; putative annotation: N/A; putative formula: C3H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.149,"smiles":null,"spectrum_id":"CCMSLIB00017225153","spectrum_index":9861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde - 40.0 eV (delta mass: 66.0469 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.091,"smiles":null,"spectrum_id":"CCMSLIB00017225154","spectrum_index":9862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 87.0296 Da; putative annotation: N/A; putative formula: C3H5NO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.1,"smiles":null,"spectrum_id":"CCMSLIB00017225156","spectrum_index":9863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 86.0287 Da; putative annotation: N/A; putative formula: C4H7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.089,"smiles":null,"spectrum_id":"CCMSLIB00017225159","spectrum_index":9864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperazin-1-yl)pentan-1-one (delta mass: 25.9794 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.129,"smiles":null,"spectrum_id":"CCMSLIB00017225160","spectrum_index":9865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 70.0053 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.065,"smiles":null,"spectrum_id":"CCMSLIB00017225162","spectrum_index":9866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 95.0663 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.168,"smiles":null,"spectrum_id":"CCMSLIB00017225165","spectrum_index":9867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethoxyphenol (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.065,"smiles":null,"spectrum_id":"CCMSLIB00017225166","spectrum_index":9868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,12.alpha.-Epidioxy-13(14)-abieten-18-oic acid (delta mass: 24.0359 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017225168","spectrum_index":9869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethylene glycol (delta mass: 44.017 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.087,"smiles":null,"spectrum_id":"CCMSLIB00017225170","spectrum_index":9870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 353.2324 Da; putative annotation: N/A; putative formula: C19H35N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.371,"smiles":null,"spectrum_id":"CCMSLIB00017225171","spectrum_index":9871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 74.0778 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017225174","spectrum_index":9872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 207.035 Da; putative annotation: N/A; putative formula: C10H9NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.116,"smiles":null,"spectrum_id":"CCMSLIB00017225176","spectrum_index":9873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 48.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.263,"smiles":null,"spectrum_id":"CCMSLIB00017225177","spectrum_index":9874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11-Dideoxy-9.alpha.,11.alpha.-methanoepoxyprosta-5Z,13E-dien-1-oic acid, methyl ester (delta mass: 76.0325 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.323,"smiles":null,"spectrum_id":"CCMSLIB00017225180","spectrum_index":9875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 460.762 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.853,"smiles":null,"spectrum_id":"CCMSLIB00017225182","spectrum_index":9876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Isobutyryl-4-piperidinamine (delta mass: 37.9797 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.129,"smiles":null,"spectrum_id":"CCMSLIB00017225184","spectrum_index":9877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 2.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.097,"smiles":null,"spectrum_id":"CCMSLIB00017225186","spectrum_index":9878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 115.0622 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.144,"smiles":null,"spectrum_id":"CCMSLIB00017225189","spectrum_index":9879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cyclohexylethanol (delta mass: 174.9226 Da; putative annotation: N/A; putative formula: C3H-1NO4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.05,"smiles":null,"spectrum_id":"CCMSLIB00017225190","spectrum_index":9880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-3-[4-(carboxymethyl)phenyl]propanoic acid (delta mass: 67.0775 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.169,"smiles":null,"spectrum_id":"CCMSLIB00017225191","spectrum_index":9881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Hyodeoxycholic acid (delta mass: 90.0859 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.386,"smiles":null,"spectrum_id":"CCMSLIB00017225195","spectrum_index":9882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-1,3-Dihydroxydammara-12,24-dien-26-oic acid (delta mass: 62.0502 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.413,"smiles":null,"spectrum_id":"CCMSLIB00017225196","spectrum_index":9883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 314.0639 Da; putative annotation: N/A; putative formula: C8H11N8O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.15,"smiles":null,"spectrum_id":"CCMSLIB00017225197","spectrum_index":9884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 361.2881 Da; putative annotation: N/A; putative formula: C25H35N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.52,"smiles":null,"spectrum_id":"CCMSLIB00017225199","spectrum_index":9885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 68.0628 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017225202","spectrum_index":9886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 324.1493 Da; putative annotation: N/A; putative formula: C5H12N18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.22,"smiles":null,"spectrum_id":"CCMSLIB00017225203","spectrum_index":9887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethoxybenzoic acid (delta mass: 4.0995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.17,"smiles":null,"spectrum_id":"CCMSLIB00017225205","spectrum_index":9888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methylquinoline-2-carboxylic acid CollisionEnergy:205060 (delta mass: 16.0494 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.12,"smiles":null,"spectrum_id":"CCMSLIB00017225207","spectrum_index":9889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 264.2297 Da; putative annotation: N/A; putative formula: C15H28N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":931.459,"smiles":null,"spectrum_id":"CCMSLIB00017225210","spectrum_index":9890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 285.1206 Da; putative annotation: N/A; putative formula: C13H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.249,"smiles":null,"spectrum_id":"CCMSLIB00017225212","spectrum_index":9891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethylpiperazine (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.118,"smiles":null,"spectrum_id":"CCMSLIB00017225213","spectrum_index":9892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 255.0387 Da; putative annotation: N/A; putative formula: C11H13NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.13,"smiles":null,"spectrum_id":"CCMSLIB00017225215","spectrum_index":9893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 501.4032 Da; putative annotation: N/A; putative formula: C28H55NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.588,"smiles":null,"spectrum_id":"CCMSLIB00017225217","spectrum_index":9894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 770.4595 Da; putative annotation: N/A; putative formula: C38H67N4O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1127.76,"smiles":null,"spectrum_id":"CCMSLIB00017225218","spectrum_index":9895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 82.0775 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.461,"smiles":null,"spectrum_id":"CCMSLIB00017225220","spectrum_index":9896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.alpha.,9.Xi.)-3-Hydroxyolean-12-en-24-oic acid (delta mass: 62.0624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.43,"smiles":null,"spectrum_id":"CCMSLIB00017225223","spectrum_index":9897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 223.0954 Da; putative annotation: N/A; putative formula: C10H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.182,"smiles":null,"spectrum_id":"CCMSLIB00017225224","spectrum_index":9898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 166.1018 Da; putative annotation: N/A; putative formula: C9H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.193,"smiles":null,"spectrum_id":"CCMSLIB00017225226","spectrum_index":9899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-Gln (delta mass: 224.1158 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.229,"smiles":null,"spectrum_id":"CCMSLIB00017225229","spectrum_index":9900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 7.886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.961,"smiles":null,"spectrum_id":"CCMSLIB00017225231","spectrum_index":9901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 144.0437 Da; putative annotation: N/A; putative formula: C7H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.13,"smiles":null,"spectrum_id":"CCMSLIB00017225232","spectrum_index":9902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxopimara-8(14),15-dien-20-oic acid (delta mass: 53.0481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017225235","spectrum_index":9903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 355.1452 Da; putative annotation: N/A; putative formula: C17H25NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.221,"smiles":null,"spectrum_id":"CCMSLIB00017225237","spectrum_index":9904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 12.4301 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.5,"smiles":null,"spectrum_id":"CCMSLIB00017225238","spectrum_index":9905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytisine (delta mass: 148.0161 Da; putative annotation: N/A; putative formula: C8H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.134,"smiles":null,"spectrum_id":"CCMSLIB00017225241","spectrum_index":9906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxysebacic acid (delta mass: 16.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017225243","spectrum_index":9907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 493.3231 Da; putative annotation: N/A; putative formula: C29H51NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.383,"smiles":null,"spectrum_id":"CCMSLIB00017225244","spectrum_index":9908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 545.3035 Da; putative annotation: N/A; putative formula: C27H49NO6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.364,"smiles":null,"spectrum_id":"CCMSLIB00017225245","spectrum_index":9909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Epiandrographolide (delta mass: 148.0883 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.305,"smiles":null,"spectrum_id":"CCMSLIB00017225249","spectrum_index":9910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 206.0944 Da; putative annotation: N/A; putative formula: C12H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.17,"smiles":null,"spectrum_id":"CCMSLIB00017225250","spectrum_index":9911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 59.0802 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017225253","spectrum_index":9912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-carboxypropanoylamino)-3-methylpentanoic acid CollisionEnergy:205060 (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017225254","spectrum_index":9913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 65.0091 Da; putative annotation: N/A; putative formula: CH-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.08,"smiles":null,"spectrum_id":"CCMSLIB00017225257","spectrum_index":9914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 405.2509 Da; putative annotation: N/A; putative formula: C23H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.38,"smiles":null,"spectrum_id":"CCMSLIB00017225259","spectrum_index":9915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,17-diol, (3.alpha.,5.alpha.,17.beta.)- (delta mass: 116.0986 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.346,"smiles":null,"spectrum_id":"CCMSLIB00017225260","spectrum_index":9916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethopabate (delta mass: 60.0209 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.128,"smiles":null,"spectrum_id":"CCMSLIB00017225262","spectrum_index":9917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 55.078 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.211,"smiles":null,"spectrum_id":"CCMSLIB00017225265","spectrum_index":9918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 269.2368 Da; putative annotation: N/A; putative formula: C16H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.521,"smiles":null,"spectrum_id":"CCMSLIB00017225266","spectrum_index":9919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 345.1076 Da; putative annotation: N/A; putative formula: C16H27NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.186,"smiles":null,"spectrum_id":"CCMSLIB00017225268","spectrum_index":9920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 424.1362 Da; putative annotation: N/A; putative formula: C33H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.212,"smiles":null,"spectrum_id":"CCMSLIB00017225271","spectrum_index":9921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rostafuroxin (delta mass: 18.0121 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.265,"smiles":null,"spectrum_id":"CCMSLIB00017225272","spectrum_index":9922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 116.0634 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.306,"smiles":null,"spectrum_id":"CCMSLIB00017225274","spectrum_index":9923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 7.8525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.032,"smiles":null,"spectrum_id":"CCMSLIB00017225277","spectrum_index":9924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.074,"smiles":null,"spectrum_id":"CCMSLIB00017225279","spectrum_index":9925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 331.2871 Da; putative annotation: N/A; putative formula: C22H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.39,"smiles":null,"spectrum_id":"CCMSLIB00017225280","spectrum_index":9926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 40.031 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017225282","spectrum_index":9927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 44.0258 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.075,"smiles":null,"spectrum_id":"CCMSLIB00017225285","spectrum_index":9928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 202.1206 Da; putative annotation: N/A; putative formula: C10H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.243,"smiles":null,"spectrum_id":"CCMSLIB00017225288","spectrum_index":9929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:102040 (delta mass: 251.2225 Da; putative annotation: N/A; putative formula: C12H25N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.491,"smiles":null,"spectrum_id":"CCMSLIB00017225290","spectrum_index":9930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenol (delta mass: 206.1661 Da; putative annotation: N/A; putative formula: C14H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.236,"smiles":null,"spectrum_id":"CCMSLIB00017225291","spectrum_index":9931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 484.189 Da; putative annotation: N/A; putative formula: C22H34N2O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.26,"smiles":null,"spectrum_id":"CCMSLIB00017225293","spectrum_index":9932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 146.0849 Da; putative annotation: N/A; putative formula: C9H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017225296","spectrum_index":9933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 17.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.15,"smiles":null,"spectrum_id":"CCMSLIB00017225297","spectrum_index":9934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 326.1041 Da; putative annotation: N/A; putative formula: C15H23N2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.18,"smiles":null,"spectrum_id":"CCMSLIB00017225299","spectrum_index":9935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 171.0572 Da; putative annotation: N/A; putative formula: C5H9N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.175,"smiles":null,"spectrum_id":"CCMSLIB00017225302","spectrum_index":9936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 470.2881 Da; putative annotation: N/A; putative formula: C25H42O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.504,"smiles":null,"spectrum_id":"CCMSLIB00017225303","spectrum_index":9937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TDP-2 (delta mass: 17.9994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.159,"smiles":null,"spectrum_id":"CCMSLIB00017225305","spectrum_index":9938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 578.493 Da; putative annotation: N/A; putative formula: C37H62N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":933.777,"smiles":null,"spectrum_id":"CCMSLIB00017225308","spectrum_index":9939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 133.9444 Da; putative annotation: N/A; putative formula: C2H2N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.985,"smiles":null,"spectrum_id":"CCMSLIB00017225310","spectrum_index":9940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 779.3899 Da; putative annotation: N/A; putative formula: C31H61N3O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.45,"smiles":null,"spectrum_id":"CCMSLIB00017225311","spectrum_index":9941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 362.2803 Da; putative annotation: N/A; putative formula: C19H34N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.377,"smiles":null,"spectrum_id":"CCMSLIB00017225315","spectrum_index":9942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 162.0525 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.176,"smiles":null,"spectrum_id":"CCMSLIB00017225316","spectrum_index":9943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 412.3715 Da; putative annotation: N/A; putative formula: C22H48N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.442,"smiles":null,"spectrum_id":"CCMSLIB00017225317","spectrum_index":9944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 386.319 Da; putative annotation: N/A; putative formula: C26H42O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.509,"smiles":null,"spectrum_id":"CCMSLIB00017225319","spectrum_index":9945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 30.0 eV (delta mass: 247.0329 Da; putative annotation: N/A; putative formula: C8H9NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.103,"smiles":null,"spectrum_id":"CCMSLIB00017225322","spectrum_index":9946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 114.068 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.175,"smiles":null,"spectrum_id":"CCMSLIB00017225323","spectrum_index":9947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ellipticine (delta mass: 35.9065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.03,"smiles":null,"spectrum_id":"CCMSLIB00017225325","spectrum_index":9948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 61.0051 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017225328","spectrum_index":9949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 146.1432 Da; putative annotation: N/A; putative formula: C12H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.224,"smiles":null,"spectrum_id":"CCMSLIB00017225329","spectrum_index":9950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylazepane (delta mass: 100.0366 Da; putative annotation: N/A; putative formula: C2H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.18,"smiles":null,"spectrum_id":"CCMSLIB00017225330","spectrum_index":9951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Lauroyl-D-erythro-sphinganine (delta mass: 68.0622 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.535,"smiles":null,"spectrum_id":"CCMSLIB00017225334","spectrum_index":9952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 174.0387 Da; putative annotation: N/A; putative formula: C4H6N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.097,"smiles":null,"spectrum_id":"CCMSLIB00017225335","spectrum_index":9953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 302.0069 Da; putative annotation: N/A; putative formula: C6H12N2O8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.056,"smiles":null,"spectrum_id":"CCMSLIB00017225336","spectrum_index":9954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of galanthamine (delta mass: 35.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.196,"smiles":null,"spectrum_id":"CCMSLIB00017225340","spectrum_index":9955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 252.0398 Da; putative annotation: N/A; putative formula: C8H13O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.1,"smiles":null,"spectrum_id":"CCMSLIB00017225341","spectrum_index":9956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 334.2641 Da; putative annotation: N/A; putative formula: C19H35N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.35,"smiles":null,"spectrum_id":"CCMSLIB00017225342","spectrum_index":9957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 61.0653 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.132,"smiles":null,"spectrum_id":"CCMSLIB00017225346","spectrum_index":9958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 289.2616 Da; putative annotation: N/A; putative formula: C17H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.629,"smiles":null,"spectrum_id":"CCMSLIB00017225347","spectrum_index":9959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N.epsilon.-Acetyl-L-lysine (delta mass: 134.0373 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.161,"smiles":null,"spectrum_id":"CCMSLIB00017225348","spectrum_index":9960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.049,"smiles":null,"spectrum_id":"CCMSLIB00017225351","spectrum_index":9961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-11,12-dihydroindolo[2,3-a]carbazole (delta mass: 353.1998 Da; putative annotation: N/A; putative formula: C15H27N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.323,"smiles":null,"spectrum_id":"CCMSLIB00017225354","spectrum_index":9962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 516.2965 Da; putative annotation: N/A; putative formula: C25H45N2O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.43,"smiles":null,"spectrum_id":"CCMSLIB00017225357","spectrum_index":9963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 134.1148 Da; putative annotation: N/A; putative formula: H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.597,"smiles":null,"spectrum_id":"CCMSLIB00017225358","spectrum_index":9964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 118.078 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.294,"smiles":null,"spectrum_id":"CCMSLIB00017225360","spectrum_index":9965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 40.7706 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.909,"smiles":null,"spectrum_id":"CCMSLIB00017225363","spectrum_index":9966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 133.0642 Da; putative annotation: N/A; putative formula: C7H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.125,"smiles":null,"spectrum_id":"CCMSLIB00017225365","spectrum_index":9967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-3,4-dihydro-1(2H)-naphthalenone (delta mass: 178.064 Da; putative annotation: N/A; putative formula: C11H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.139,"smiles":null,"spectrum_id":"CCMSLIB00017225368","spectrum_index":9968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 245.164 Da; putative annotation: N/A; putative formula: C13H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.386,"smiles":null,"spectrum_id":"CCMSLIB00017225370","spectrum_index":9969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 26.0154 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017225372","spectrum_index":9970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-2-methylbutyric acid (delta mass: 27.0462 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.117,"smiles":null,"spectrum_id":"CCMSLIB00017225375","spectrum_index":9971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 239.0778 Da; putative annotation: N/A; putative formula: C8H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.164,"smiles":null,"spectrum_id":"CCMSLIB00017225376","spectrum_index":9972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 197.0573 Da; putative annotation: N/A; putative formula: C4H12N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.154,"smiles":null,"spectrum_id":"CCMSLIB00017225378","spectrum_index":9973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Leu (delta mass: 242.127 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.288,"smiles":null,"spectrum_id":"CCMSLIB00017225381","spectrum_index":9974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-HYDANTOIN (delta mass: 55.9938 Da; putative annotation: N/A; putative formula: CHN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.044,"smiles":null,"spectrum_id":"CCMSLIB00017225383","spectrum_index":9975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 2.4243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":102.5,"smiles":null,"spectrum_id":"CCMSLIB00017225384","spectrum_index":9976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Methoxyphenyl)acetic acid (delta mass: 40.068 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017225388","spectrum_index":9977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-2-Decenoic acid (delta mass: 53.0267 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.165,"smiles":null,"spectrum_id":"CCMSLIB00017225392","spectrum_index":9978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1,3-dimethyl-1H-pyrazole-4-carbonitrile (delta mass: 39.0146 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.097,"smiles":null,"spectrum_id":"CCMSLIB00017225394","spectrum_index":9979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 2.9617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":113.033,"smiles":null,"spectrum_id":"CCMSLIB00017225397","spectrum_index":9980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 74.0499 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.272,"smiles":null,"spectrum_id":"CCMSLIB00017225399","spectrum_index":9981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 33.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.284,"smiles":null,"spectrum_id":"CCMSLIB00017225402","spectrum_index":9982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 10.021 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.206,"smiles":null,"spectrum_id":"CCMSLIB00017225404","spectrum_index":9983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 370.1855 Da; putative annotation: N/A; putative formula: C16H26N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.251,"smiles":null,"spectrum_id":"CCMSLIB00017225406","spectrum_index":9984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 78.0467 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.127,"smiles":null,"spectrum_id":"CCMSLIB00017225409","spectrum_index":9985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4',5-Trihydroxy-7-methoxyflavanone (delta mass: 176.0331 Da; putative annotation: N/A; putative formula: C7H12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.119,"smiles":null,"spectrum_id":"CCMSLIB00017225411","spectrum_index":9986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Tosylethylenediamine (delta mass: 132.0636 Da; putative annotation: N/A; putative formula: C3H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.148,"smiles":null,"spectrum_id":"CCMSLIB00017225415","spectrum_index":9987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 248.052 Da; putative annotation: N/A; putative formula: C14H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.138,"smiles":null,"spectrum_id":"CCMSLIB00017225416","spectrum_index":9988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3,4-dimethoxybenzoic acid (delta mass: 116.0261 Da; putative annotation: N/A; putative formula: C8H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.086,"smiles":null,"spectrum_id":"CCMSLIB00017225418","spectrum_index":9989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 116.0986 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.325,"smiles":null,"spectrum_id":"CCMSLIB00017225421","spectrum_index":9990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 201.2037 Da; putative annotation: N/A; putative formula: C8H23N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.258,"smiles":null,"spectrum_id":"CCMSLIB00017225422","spectrum_index":9991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 115.0273 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.077,"smiles":null,"spectrum_id":"CCMSLIB00017225426","spectrum_index":9992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylimbricatolic acid (delta mass: 124.087 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.356,"smiles":null,"spectrum_id":"CCMSLIB00017225428","spectrum_index":9993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 77.0477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017225431","spectrum_index":9994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 237.1575 Da; putative annotation: N/A; putative formula: C7H15N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.4,"smiles":null,"spectrum_id":"CCMSLIB00017225433","spectrum_index":9995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-aminobenzoate; AIF; CE10; CorrDec (delta mass: 55.0672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.154,"smiles":null,"spectrum_id":"CCMSLIB00017225435","spectrum_index":9996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 26,27-Dinorcholest-5-en-24-yne-3,20-diol, (3.beta.)- (delta mass: 61.9466 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.241,"smiles":null,"spectrum_id":"CCMSLIB00017225437","spectrum_index":9997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 239.7381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.809,"smiles":null,"spectrum_id":"CCMSLIB00017225439","spectrum_index":9998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 161.0474 Da; putative annotation: N/A; putative formula: C9H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.118,"smiles":null,"spectrum_id":"CCMSLIB00017225443","spectrum_index":9999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cannabidiol (delta mass: 15.9949 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.227,"smiles":null,"spectrum_id":"CCMSLIB00017225447","spectrum_index":10000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 54.0105 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017225448","spectrum_index":10001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 368.1829 Da; putative annotation: N/A; putative formula: C13H29N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.243,"smiles":null,"spectrum_id":"CCMSLIB00017225451","spectrum_index":10002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 418.136 Da; putative annotation: N/A; putative formula: C17H22N8OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.216,"smiles":null,"spectrum_id":"CCMSLIB00017225453","spectrum_index":10003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 302.1591 Da; putative annotation: N/A; putative formula: C12H22N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.241,"smiles":null,"spectrum_id":"CCMSLIB00017225456","spectrum_index":10004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,19-Cyclolanost-25-ene-3,24-diol (delta mass: 255.2566 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.645,"smiles":null,"spectrum_id":"CCMSLIB00017225458","spectrum_index":10005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Acetyloxy)-3-methylbenzoic acid (delta mass: 149.0389 Da; putative annotation: N/A; putative formula: C8H8NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.104,"smiles":null,"spectrum_id":"CCMSLIB00017225460","spectrum_index":10006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.164,"smiles":null,"spectrum_id":"CCMSLIB00017225463","spectrum_index":10007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 387.1372 Da; putative annotation: N/A; putative formula: C26H17N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.218,"smiles":null,"spectrum_id":"CCMSLIB00017225464","spectrum_index":10008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 74.0086 Da; putative annotation: N/A; putative formula: CH2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.069,"smiles":null,"spectrum_id":"CCMSLIB00017225466","spectrum_index":10009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hexadecyl-2-azelaoyl-sn-glycero-3-phosphocholine (delta mass: 104.0961 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.551,"smiles":null,"spectrum_id":"CCMSLIB00017225469","spectrum_index":10010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydodecanoic acid (delta mass: 103.0093 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.189,"smiles":null,"spectrum_id":"CCMSLIB00017225471","spectrum_index":10011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 304.0947 Da; putative annotation: N/A; putative formula: C16H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.17,"smiles":null,"spectrum_id":"CCMSLIB00017225475","spectrum_index":10012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 36.0405 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.262,"smiles":null,"spectrum_id":"CCMSLIB00017225477","spectrum_index":10013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 59.0364 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.117,"smiles":null,"spectrum_id":"CCMSLIB00017225480","spectrum_index":10014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 41.0259 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017225481","spectrum_index":10015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 190.0448 Da; putative annotation: N/A; putative formula: C3H6N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.126,"smiles":null,"spectrum_id":"CCMSLIB00017225484","spectrum_index":10016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 177.1363 Da; putative annotation: N/A; putative formula: C9H15N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.384,"smiles":null,"spectrum_id":"CCMSLIB00017225486","spectrum_index":10017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 349.1378 Da; putative annotation: N/A; putative formula: C17H24N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.37,"smiles":null,"spectrum_id":"CCMSLIB00017225488","spectrum_index":10018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thuggacin A (delta mass: 632.0849 Da; putative annotation: N/A; putative formula: C30H24N4O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1264.45,"smiles":null,"spectrum_id":"CCMSLIB00017225491","spectrum_index":10019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Phenylalanine, methyl ester (delta mass: 57.0197 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.122,"smiles":null,"spectrum_id":"CCMSLIB00017225492","spectrum_index":10020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Octen-3-ol (delta mass: 215.0102 Da; putative annotation: N/A; putative formula: C4H9NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.138,"smiles":null,"spectrum_id":"CCMSLIB00017225495","spectrum_index":10021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C12:1 (delta mass: 75.0353 Da; putative annotation: N/A; putative formula: CH6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.226,"smiles":null,"spectrum_id":"CCMSLIB00017225497","spectrum_index":10022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 79.9568 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.074,"smiles":null,"spectrum_id":"CCMSLIB00017225499","spectrum_index":10023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 16.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.122,"smiles":null,"spectrum_id":"CCMSLIB00017225502","spectrum_index":10024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 298.2508 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.483,"smiles":null,"spectrum_id":"CCMSLIB00017225504","spectrum_index":10025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 131.0611 Da; putative annotation: N/A; putative formula: C4H10N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.14,"smiles":null,"spectrum_id":"CCMSLIB00017225505","spectrum_index":10026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 102.0659 Da; putative annotation: N/A; putative formula: CH6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.236,"smiles":null,"spectrum_id":"CCMSLIB00017225508","spectrum_index":10027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 296.2358 Da; putative annotation: N/A; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.327,"smiles":null,"spectrum_id":"CCMSLIB00017225510","spectrum_index":10028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7,8,9,10,11-Hexahydro-5H-cycloocta[b]indole (delta mass: 132.0607 Da; putative annotation: N/A; putative formula: C6H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.204,"smiles":null,"spectrum_id":"CCMSLIB00017225511","spectrum_index":10029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300565 Isomajdine (delta mass: 428.1944 Da; putative annotation: N/A; putative formula: C23H28N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.396,"smiles":null,"spectrum_id":"CCMSLIB00017225513","spectrum_index":10030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 109.0766 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.314,"smiles":null,"spectrum_id":"CCMSLIB00017225516","spectrum_index":10031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 325.1094 Da; putative annotation: N/A; putative formula: C16H16N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.259,"smiles":null,"spectrum_id":"CCMSLIB00017225517","spectrum_index":10032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 314.2236 Da; putative annotation: N/A; putative formula: C21H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.347,"smiles":null,"spectrum_id":"CCMSLIB00017225520","spectrum_index":10033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-O-((2.alpha.,3.beta.,5.Xi.,9.Xi.,18.Xi.,19.alpha.)-2,3,19-Trihydroxy-28-oxoolean-12-en-28-yl)-.beta.-D-glucopyranose (delta mass: 48.0363 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.447,"smiles":null,"spectrum_id":"CCMSLIB00017225523","spectrum_index":10034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Pyrrolidinylcarbonyl)piperidine (delta mass: 209.0685 Da; putative annotation: N/A; putative formula: C10H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.218,"smiles":null,"spectrum_id":"CCMSLIB00017225524","spectrum_index":10035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid (delta mass: 180.0627 Da; putative annotation: N/A; putative formula: C10H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.216,"smiles":null,"spectrum_id":"CCMSLIB00017225528","spectrum_index":10036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arthrobactin (delta mass: 1004.1704 Da; putative annotation: N/A; putative formula: C55H48N4O-1S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1481.43,"smiles":null,"spectrum_id":"CCMSLIB00017225529","spectrum_index":10037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 57.0638 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.122,"smiles":null,"spectrum_id":"CCMSLIB00017225531","spectrum_index":10038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 110.0363 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.07,"smiles":null,"spectrum_id":"CCMSLIB00017225533","spectrum_index":10039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11-Eicosenoic acid (delta mass: 34.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.336,"smiles":null,"spectrum_id":"CCMSLIB00017225535","spectrum_index":10040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.16,"smiles":null,"spectrum_id":"CCMSLIB00017225538","spectrum_index":10041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Populin (delta mass: 317.1113 Da; putative annotation: N/A; putative formula: C13H19NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.25,"smiles":null,"spectrum_id":"CCMSLIB00017225539","spectrum_index":10042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 210.0669 Da; putative annotation: N/A; putative formula: C8H11N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.127,"smiles":null,"spectrum_id":"CCMSLIB00017225541","spectrum_index":10043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.102,"smiles":null,"spectrum_id":"CCMSLIB00017225544","spectrum_index":10044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinine (delta mass: 294.2989 Da; putative annotation: N/A; putative formula: C19H38N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.49,"smiles":null,"spectrum_id":"CCMSLIB00017225547","spectrum_index":10045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 184.8941 Da; putative annotation: N/A; putative formula: C2H3NO-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.2,"smiles":null,"spectrum_id":"CCMSLIB00017225550","spectrum_index":10046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 64.0306 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.388,"smiles":null,"spectrum_id":"CCMSLIB00017225551","spectrum_index":10047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholic Acid, Methyl Ester (delta mass: 126.0824 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.393,"smiles":null,"spectrum_id":"CCMSLIB00017225555","spectrum_index":10048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.102,"smiles":null,"spectrum_id":"CCMSLIB00017225557","spectrum_index":10049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 89.1031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.184,"smiles":null,"spectrum_id":"CCMSLIB00017225560","spectrum_index":10050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 117.0616 Da; putative annotation: N/A; putative formula: C5H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.126,"smiles":null,"spectrum_id":"CCMSLIB00017225561","spectrum_index":10051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 94.0404 Da; putative annotation: N/A; putative formula: C2H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.138,"smiles":null,"spectrum_id":"CCMSLIB00017225563","spectrum_index":10052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 46.0893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.17,"smiles":null,"spectrum_id":"CCMSLIB00017225566","spectrum_index":10053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine - 40.0 eV (delta mass: 93.9714 Da; putative annotation: N/A; putative formula: C3H-1N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.058,"smiles":null,"spectrum_id":"CCMSLIB00017225568","spectrum_index":10054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Pregnen-3.beta.-ol-20-one (delta mass: 112.0876 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.335,"smiles":null,"spectrum_id":"CCMSLIB00017225571","spectrum_index":10055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin C (delta mass: 56.0259 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.206,"smiles":null,"spectrum_id":"CCMSLIB00017225573","spectrum_index":10056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.342,"smiles":null,"spectrum_id":"CCMSLIB00017225576","spectrum_index":10057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 54.0109 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.09,"smiles":null,"spectrum_id":"CCMSLIB00017225577","spectrum_index":10058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 50.0517 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.331,"smiles":null,"spectrum_id":"CCMSLIB00017225580","spectrum_index":10059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Aminocamptothecin (delta mass: 69.0465 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.176,"smiles":null,"spectrum_id":"CCMSLIB00017225582","spectrum_index":10060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 84.0421 Da; putative annotation: N/A; putative formula: C2H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.16,"smiles":null,"spectrum_id":"CCMSLIB00017225583","spectrum_index":10061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 78.0463 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.336,"smiles":null,"spectrum_id":"CCMSLIB00017225586","spectrum_index":10062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 550.2001 Da; putative annotation: N/A; putative formula: C35H34O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1055.38,"smiles":null,"spectrum_id":"CCMSLIB00017225588","spectrum_index":10063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-trans-Prostaglandin E3 (delta mass: 104.0628 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.279,"smiles":null,"spectrum_id":"CCMSLIB00017225590","spectrum_index":10064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 13.9471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.195,"smiles":null,"spectrum_id":"CCMSLIB00017225593","spectrum_index":10065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 183.0602 Da; putative annotation: N/A; putative formula: C12H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.157,"smiles":null,"spectrum_id":"CCMSLIB00017225594","spectrum_index":10066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 70.0055 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017225597","spectrum_index":10067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 606.3663 Da; putative annotation: N/A; putative formula: C30H51N6O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.463,"smiles":null,"spectrum_id":"CCMSLIB00017225599","spectrum_index":10068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 578.6385 Da; putative annotation: N/A; putative formula: C36H78N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.673,"smiles":null,"spectrum_id":"CCMSLIB00017225601","spectrum_index":10069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 8.9889 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.055,"smiles":null,"spectrum_id":"CCMSLIB00017225603","spectrum_index":10070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 14,15-EE-(8Z)-E from NIST14 (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.284,"smiles":null,"spectrum_id":"CCMSLIB00017225604","spectrum_index":10071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trihexyphenidyl (delta mass: 101.0719 Da; putative annotation: N/A; putative formula: C2H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017225607","spectrum_index":10072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.263,"smiles":null,"spectrum_id":"CCMSLIB00017225609","spectrum_index":10073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7(S)-Maresin 1 (delta mass: 74.0525 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.29,"smiles":null,"spectrum_id":"CCMSLIB00017225610","spectrum_index":10074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 140.0825 Da; putative annotation: N/A; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.158,"smiles":null,"spectrum_id":"CCMSLIB00017225614","spectrum_index":10075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 167.1621 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.237,"smiles":null,"spectrum_id":"CCMSLIB00017225615","spectrum_index":10076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 102.0468 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017225617","spectrum_index":10077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 43.0421 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.128,"smiles":null,"spectrum_id":"CCMSLIB00017225620","spectrum_index":10078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 17.0305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.167,"smiles":null,"spectrum_id":"CCMSLIB00017225621","spectrum_index":10079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 42.9455 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.973,"smiles":null,"spectrum_id":"CCMSLIB00017225623","spectrum_index":10080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 367.1114 Da; putative annotation: N/A; putative formula: C13H21NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.244,"smiles":null,"spectrum_id":"CCMSLIB00017225626","spectrum_index":10081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 414.0871 Da; putative annotation: N/A; putative formula: C17H10N12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.272,"smiles":null,"spectrum_id":"CCMSLIB00017225627","spectrum_index":10082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 101.0479 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.187,"smiles":null,"spectrum_id":"CCMSLIB00017225630","spectrum_index":10083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4H-1-Benzopyran-4-one, 6-arabinopyranosyl-8-.beta.-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)- (delta mass: 132.0396 Da; putative annotation: N/A; putative formula: CH4N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.195,"smiles":null,"spectrum_id":"CCMSLIB00017225632","spectrum_index":10084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 86.052 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017225633","spectrum_index":10085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 263.2413 Da; putative annotation: N/A; putative formula: C16H29N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.463,"smiles":null,"spectrum_id":"CCMSLIB00017225637","spectrum_index":10086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381317-01!(E)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-methyldec-8-ene-1,3-dione [IIN-based on: CCMSLIB00000846613] (delta mass: 278.2239 Da; putative annotation: N/A; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.43,"smiles":null,"spectrum_id":"CCMSLIB00017225638","spectrum_index":10087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 471.2553 Da; putative annotation: N/A; putative formula: C18H33N9O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.34,"smiles":null,"spectrum_id":"CCMSLIB00017225640","spectrum_index":10088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 61.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.331,"smiles":null,"spectrum_id":"CCMSLIB00017225643","spectrum_index":10089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Di(2-ethylhexyl)amine (delta mass: 108.9686 Da; putative annotation: N/A; putative formula: CH3NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017225644","spectrum_index":10090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 66.8251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.922,"smiles":null,"spectrum_id":"CCMSLIB00017225646","spectrum_index":10091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 243.1046 Da; putative annotation: N/A; putative formula: C18H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.191,"smiles":null,"spectrum_id":"CCMSLIB00017225649","spectrum_index":10092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine, 2-(diphenylmethyl)-, (2S)- (delta mass: 112.0735 Da; putative annotation: N/A; putative formula: C4H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.233,"smiles":null,"spectrum_id":"CCMSLIB00017225650","spectrum_index":10093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 192.1991 Da; putative annotation: N/A; putative formula: C13H24N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.478,"smiles":null,"spectrum_id":"CCMSLIB00017225652","spectrum_index":10094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 110.9408 Da; putative annotation: N/A; putative formula: C2H-2N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.022,"smiles":null,"spectrum_id":"CCMSLIB00017225655","spectrum_index":10095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084604 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 43.969 Da; putative annotation: N/A; putative formula: CS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.024,"smiles":null,"spectrum_id":"CCMSLIB00017225657","spectrum_index":10096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brassicasterol (delta mass: 377.1533 Da; putative annotation: N/A; putative formula: C18H19N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.515,"smiles":null,"spectrum_id":"CCMSLIB00017225658","spectrum_index":10097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-3.alpha.-ol-11,20-dione (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017225662","spectrum_index":10098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 120.0694 Da; putative annotation: N/A; putative formula: C7H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.14,"smiles":null,"spectrum_id":"CCMSLIB00017225663","spectrum_index":10099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 938.598 Da; putative annotation: N/A; putative formula: C52H82N4O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1119.67,"smiles":null,"spectrum_id":"CCMSLIB00017225666","spectrum_index":10100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-(6,7-Dimethoxyquinazolin-4-yl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]amine (delta mass: 18.0861 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.222,"smiles":null,"spectrum_id":"CCMSLIB00017225668","spectrum_index":10101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 326.1931 Da; putative annotation: N/A; putative formula: C19H26N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.306,"smiles":null,"spectrum_id":"CCMSLIB00017225670","spectrum_index":10102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androsterone (delta mass: 392.1426 Da; putative annotation: N/A; putative formula: C28H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.375,"smiles":null,"spectrum_id":"CCMSLIB00017225673","spectrum_index":10103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 360.0731 Da; putative annotation: N/A; putative formula: C14H21N2O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.123,"smiles":null,"spectrum_id":"CCMSLIB00017225674","spectrum_index":10104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 61.9535 Da; putative annotation: N/A; putative formula: H-1O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.077,"smiles":null,"spectrum_id":"CCMSLIB00017225676","spectrum_index":10105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 365.3135 Da; putative annotation: N/A; putative formula: C16H35N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.353,"smiles":null,"spectrum_id":"CCMSLIB00017225680","spectrum_index":10106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 76.0508 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.095,"smiles":null,"spectrum_id":"CCMSLIB00017225681","spectrum_index":10107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 324.1058 Da; putative annotation: N/A; putative formula: C17H18N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.24,"smiles":null,"spectrum_id":"CCMSLIB00017225683","spectrum_index":10108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 72.0274 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017225686","spectrum_index":10109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 31.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.29,"smiles":null,"spectrum_id":"CCMSLIB00017225688","spectrum_index":10110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 144.0901 Da; putative annotation: N/A; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.208,"smiles":null,"spectrum_id":"CCMSLIB00017225690","spectrum_index":10111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Leu (delta mass: 252.1483 Da; putative annotation: N/A; putative formula: C14H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.303,"smiles":null,"spectrum_id":"CCMSLIB00017225692","spectrum_index":10112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 70.0762 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.203,"smiles":null,"spectrum_id":"CCMSLIB00017225695","spectrum_index":10113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 40.0672 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017225697","spectrum_index":10114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 114.0818 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.277,"smiles":null,"spectrum_id":"CCMSLIB00017225699","spectrum_index":10115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 221.0347 Da; putative annotation: N/A; putative formula: C4H3N11O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.121,"smiles":null,"spectrum_id":"CCMSLIB00017225702","spectrum_index":10116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 328.0788 Da; putative annotation: N/A; putative formula: C12H4N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.145,"smiles":null,"spectrum_id":"CCMSLIB00017225704","spectrum_index":10117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 370.1269 Da; putative annotation: N/A; putative formula: C20H23N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.26,"smiles":null,"spectrum_id":"CCMSLIB00017225706","spectrum_index":10118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 19.0058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.113,"smiles":null,"spectrum_id":"CCMSLIB00017225709","spectrum_index":10119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 298.2484 Da; putative annotation: N/A; putative formula: C14H30N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.533,"smiles":null,"spectrum_id":"CCMSLIB00017225710","spectrum_index":10120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 62.0529 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.306,"smiles":null,"spectrum_id":"CCMSLIB00017225714","spectrum_index":10121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 171.1551 Da; putative annotation: N/A; putative formula: C10H22NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.34,"smiles":null,"spectrum_id":"CCMSLIB00017225715","spectrum_index":10122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Dehydroretinol (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.242,"smiles":null,"spectrum_id":"CCMSLIB00017225717","spectrum_index":10123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cresotinic acid (delta mass: 12.0365 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.091,"smiles":null,"spectrum_id":"CCMSLIB00017225720","spectrum_index":10124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde - 40.0 eV (delta mass: 53.9873 Da; putative annotation: N/A; putative formula: CH-2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.031,"smiles":null,"spectrum_id":"CCMSLIB00017225722","spectrum_index":10125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid (delta mass: 200.1769 Da; putative annotation: N/A; putative formula: C12H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.44,"smiles":null,"spectrum_id":"CCMSLIB00017225725","spectrum_index":10126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylene glycol monobutyl ether (delta mass: 84.0934 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.253,"smiles":null,"spectrum_id":"CCMSLIB00017225727","spectrum_index":10127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethyl ester (delta mass: 74.0518 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.331,"smiles":null,"spectrum_id":"CCMSLIB00017225729","spectrum_index":10128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoadenosine (delta mass: 194.0619 Da; putative annotation: N/A; putative formula: C7H14O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.177,"smiles":null,"spectrum_id":"CCMSLIB00017225730","spectrum_index":10129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 324.0632 Da; putative annotation: N/A; putative formula: C13H17N4PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.123,"smiles":null,"spectrum_id":"CCMSLIB00017225732","spectrum_index":10130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxytyramine (delta mass: 124.0515 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.138,"smiles":null,"spectrum_id":"CCMSLIB00017225734","spectrum_index":10131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bonactin (delta mass: 767.4822 Da; putative annotation: N/A; putative formula: C41H69NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1168.74,"smiles":null,"spectrum_id":"CCMSLIB00017225736","spectrum_index":10132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 121.1004 Da; putative annotation: N/A; putative formula: C7H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.182,"smiles":null,"spectrum_id":"CCMSLIB00017225739","spectrum_index":10133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z-octadecadienoic acid (delta mass: 30.0481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.275,"smiles":null,"spectrum_id":"CCMSLIB00017225740","spectrum_index":10134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 280.2476 Da; putative annotation: N/A; putative formula: C13H28N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.334,"smiles":null,"spectrum_id":"CCMSLIB00017225743","spectrum_index":10135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 203.1527 Da; putative annotation: N/A; putative formula: C10H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.4,"smiles":null,"spectrum_id":"CCMSLIB00017225745","spectrum_index":10136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 240.1124 Da; putative annotation: N/A; putative formula: C12H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.15,"smiles":null,"spectrum_id":"CCMSLIB00017225746","spectrum_index":10137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA270101 10,11-trans-Dihydroxy-10,11-dihydrocarbamazepine|(5S,6S)-5,6-bis(oxidanyl)-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 162.0313 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.139,"smiles":null,"spectrum_id":"CCMSLIB00017225749","spectrum_index":10138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 290.0794 Da; putative annotation: N/A; putative formula: C15H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.16,"smiles":null,"spectrum_id":"CCMSLIB00017225751","spectrum_index":10139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 416.2797 Da; putative annotation: N/A; putative formula: C28H36N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.485,"smiles":null,"spectrum_id":"CCMSLIB00017225752","spectrum_index":10140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 114.0812 Da; putative annotation: N/A; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.572,"smiles":null,"spectrum_id":"CCMSLIB00017225753","spectrum_index":10141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bellericagenin B (delta mass: 164.0976 Da; putative annotation: N/A; putative formula: C14H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.445,"smiles":null,"spectrum_id":"CCMSLIB00017225757","spectrum_index":10142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 95.1511 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.233,"smiles":null,"spectrum_id":"CCMSLIB00017225758","spectrum_index":10143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.alpha.-Hydroxystanozolol (delta mass: 94.0517 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.305,"smiles":null,"spectrum_id":"CCMSLIB00017225759","spectrum_index":10144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D3 (delta mass: 62.0486 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.39,"smiles":null,"spectrum_id":"CCMSLIB00017225762","spectrum_index":10145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-1-piperazinyl)acetic acid (delta mass: 11.0402 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017225763","spectrum_index":10146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 110.0365 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.279,"smiles":null,"spectrum_id":"CCMSLIB00017225765","spectrum_index":10147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 244.0259 Da; putative annotation: N/A; putative formula: C9H13N2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.331,"smiles":null,"spectrum_id":"CCMSLIB00017225768","spectrum_index":10148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 61.0316 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017225769","spectrum_index":10149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 45.0622 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.121,"smiles":null,"spectrum_id":"CCMSLIB00017225770","spectrum_index":10150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 30.005 Da; putative annotation: N/A; putative formula: CH3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.074,"smiles":null,"spectrum_id":"CCMSLIB00017225774","spectrum_index":10151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 176.9866 Da; putative annotation: N/A; putative formula: C4H-1N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.047,"smiles":null,"spectrum_id":"CCMSLIB00017225775","spectrum_index":10152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.216,"smiles":null,"spectrum_id":"CCMSLIB00017225776","spectrum_index":10153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 353.4032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.526,"smiles":null,"spectrum_id":"CCMSLIB00017225780","spectrum_index":10154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 116.9487 Da; putative annotation: N/A; putative formula: CH-1N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.051,"smiles":null,"spectrum_id":"CCMSLIB00017225781","spectrum_index":10155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 42.9322 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.976,"smiles":null,"spectrum_id":"CCMSLIB00017225783","spectrum_index":10156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 24.0366 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.279,"smiles":null,"spectrum_id":"CCMSLIB00017225786","spectrum_index":10157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 162.0416 Da; putative annotation: N/A; putative formula: C2H7N6OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.087,"smiles":null,"spectrum_id":"CCMSLIB00017225787","spectrum_index":10158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Acetyloxy)lanosta-8,24-dien-21-oic acid (delta mass: 80.0627 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.441,"smiles":null,"spectrum_id":"CCMSLIB00017225788","spectrum_index":10159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 38.0145 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.257,"smiles":null,"spectrum_id":"CCMSLIB00017225791","spectrum_index":10160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 214.1393 Da; putative annotation: N/A; putative formula: C15H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.21,"smiles":null,"spectrum_id":"CCMSLIB00017225794","spectrum_index":10161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 18.0469 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.191,"smiles":null,"spectrum_id":"CCMSLIB00017225796","spectrum_index":10162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 54.0317 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.295,"smiles":null,"spectrum_id":"CCMSLIB00017225798","spectrum_index":10163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 73.997 Da; putative annotation: N/A; putative formula: CH2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.076,"smiles":null,"spectrum_id":"CCMSLIB00017225801","spectrum_index":10164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 86.0515 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.341,"smiles":null,"spectrum_id":"CCMSLIB00017225802","spectrum_index":10165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 333.2898 Da; putative annotation: N/A; putative formula: C19H35N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.475,"smiles":null,"spectrum_id":"CCMSLIB00017225805","spectrum_index":10166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 286.1932 Da; putative annotation: h_266_oxandrolone_m3; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.317,"smiles":null,"spectrum_id":"CCMSLIB00017225807","spectrum_index":10167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 236.214 Da; putative annotation: Spectral Match to cis-9-Hexadecenoic acid from NIST14; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.498,"smiles":null,"spectrum_id":"CCMSLIB00017225808","spectrum_index":10168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 156.1152 Da; putative annotation: 9-Hydroxynonanoic acid; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.18,"smiles":null,"spectrum_id":"CCMSLIB00017225811","spectrum_index":10169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 162.0529 Da; putative annotation: Spectral Match to D-(+)-Mannose from NIST14; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.139,"smiles":null,"spectrum_id":"CCMSLIB00017225813","spectrum_index":10170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 286.2277 Da; putative annotation: Anticopalic acid; putative formula: C20H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.742,"smiles":null,"spectrum_id":"CCMSLIB00017225816","spectrum_index":10171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 473.2987 Da; putative annotation: Oleana-1,9(11)-dien-28-oic acid, 2-cyano-3,12-dioxo-; putative formula: C31H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.583,"smiles":null,"spectrum_id":"CCMSLIB00017225819","spectrum_index":10172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 317.235 Da; putative annotation: Gly-C18:3; putative formula: C20H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.472,"smiles":null,"spectrum_id":"CCMSLIB00017225821","spectrum_index":10173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 302.0774 Da; putative annotation: barceloneic acid A; putative formula: C16H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.289,"smiles":null,"spectrum_id":"CCMSLIB00017225824","spectrum_index":10174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 132.1127 Da; putative annotation: N/A; putative formula: C3H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.178,"smiles":null,"spectrum_id":"CCMSLIB00017225825","spectrum_index":10175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid (delta mass: 51.0307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.383,"smiles":null,"spectrum_id":"CCMSLIB00017225828","spectrum_index":10176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Ethyl-4-hydroxycoumarin (delta mass: 110.0365 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.107,"smiles":null,"spectrum_id":"CCMSLIB00017225829","spectrum_index":10177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N~1~,N~4~-bis(3-aminopropyl)-1,4-butanediamine (delta mass: 71.0736 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.297,"smiles":null,"spectrum_id":"CCMSLIB00017225832","spectrum_index":10178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 680.4138 Da; putative annotation: N/A; putative formula: C37H60O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.51,"smiles":null,"spectrum_id":"CCMSLIB00017225834","spectrum_index":10179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 176.0323 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.082,"smiles":null,"spectrum_id":"CCMSLIB00017225835","spectrum_index":10180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 54.0466 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.258,"smiles":null,"spectrum_id":"CCMSLIB00017225839","spectrum_index":10181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 310.2121 Da; putative annotation: N/A; putative formula: C22H30O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.293,"smiles":null,"spectrum_id":"CCMSLIB00017225840","spectrum_index":10182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 116.0985 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.351,"smiles":null,"spectrum_id":"CCMSLIB00017225842","spectrum_index":10183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 285.2056 Da; putative annotation: N/A; putative formula: C14H27N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.329,"smiles":null,"spectrum_id":"CCMSLIB00017225845","spectrum_index":10184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 102.0684 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.332,"smiles":null,"spectrum_id":"CCMSLIB00017225846","spectrum_index":10185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 56.0643 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.124,"smiles":null,"spectrum_id":"CCMSLIB00017225848","spectrum_index":10186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Arachidonoyltaurine (delta mass: 90.0504 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.302,"smiles":null,"spectrum_id":"CCMSLIB00017225851","spectrum_index":10187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.alpha.-Hydroxytestosterone (delta mass: 123.0681 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.279,"smiles":null,"spectrum_id":"CCMSLIB00017225852","spectrum_index":10188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocorticosterone (delta mass: 307.2145 Da; putative annotation: N/A; putative formula: C18H29NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.468,"smiles":null,"spectrum_id":"CCMSLIB00017225855","spectrum_index":10189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 130.0453 Da; putative annotation: N/A; putative formula: C6H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.121,"smiles":null,"spectrum_id":"CCMSLIB00017225857","spectrum_index":10190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-indole-3-carbaldehyde (delta mass: 73.0528 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017225859","spectrum_index":10191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 86.8902 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.956,"smiles":null,"spectrum_id":"CCMSLIB00017225861","spectrum_index":10192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 256.2401 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.277,"smiles":null,"spectrum_id":"CCMSLIB00017225862","spectrum_index":10193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 474.2824 Da; putative annotation: N/A; putative formula: C22H30N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.358,"smiles":null,"spectrum_id":"CCMSLIB00017225866","spectrum_index":10194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 64.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.205,"smiles":null,"spectrum_id":"CCMSLIB00017225867","spectrum_index":10195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.4]nonane-2,4-dione (delta mass: 126.0885 Da; putative annotation: N/A; putative formula: C8H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.17,"smiles":null,"spectrum_id":"CCMSLIB00017225869","spectrum_index":10196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 299.219 Da; putative annotation: N/A; putative formula: C11H25N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.31,"smiles":null,"spectrum_id":"CCMSLIB00017225872","spectrum_index":10197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 509.6675 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.749,"smiles":null,"spectrum_id":"CCMSLIB00017225874","spectrum_index":10198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-11-(3-pentyl-2-oxiranyl)-10E-undecenoic acid (delta mass: 74.0361 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.258,"smiles":null,"spectrum_id":"CCMSLIB00017225877","spectrum_index":10199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 18.0081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.24,"smiles":null,"spectrum_id":"CCMSLIB00017225879","spectrum_index":10200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 737.4344 Da; putative annotation: N/A; putative formula: C52H55N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":918.505,"smiles":null,"spectrum_id":"CCMSLIB00017225880","spectrum_index":10201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 72.0095 Da; putative annotation: N/A; putative formula: C5N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.132,"smiles":null,"spectrum_id":"CCMSLIB00017225883","spectrum_index":10202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 416.1086 Da; putative annotation: N/A; putative formula: C21H20O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.169,"smiles":null,"spectrum_id":"CCMSLIB00017225885","spectrum_index":10203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 1152.4801 Da; putative annotation: N/A; putative formula: C63H73N6O11PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1333.55,"smiles":null,"spectrum_id":"CCMSLIB00017225886","spectrum_index":10204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,5-Piperazinedione, 3-[[1-(1,1-dimethyl-2-propen-1-yl)-1H-indol-3-yl]methyl]-6-[[2-(1,1-dimethyl-2-propen-1-yl)-1H-indol-3-yl]methyl]-, (3S,6S)_120157\"\" (delta mass: 372.1576 Da; putative annotation: N/A; putative formula: C21H24O6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.449,"smiles":null,"spectrum_id":"CCMSLIB00017225889","spectrum_index":10205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 78.0469 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.185,"smiles":null,"spectrum_id":"CCMSLIB00017225891","spectrum_index":10206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 162.057 Da; putative annotation: N/A; putative formula: C4H10N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.132,"smiles":null,"spectrum_id":"CCMSLIB00017225893","spectrum_index":10207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 89.0118 Da; putative annotation: N/A; putative formula: C2H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.056,"smiles":null,"spectrum_id":"CCMSLIB00017225896","spectrum_index":10208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 436.2839 Da; putative annotation: N/A; putative formula: C26H36N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.339,"smiles":null,"spectrum_id":"CCMSLIB00017225897","spectrum_index":10209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 273.1689 Da; putative annotation: N/A; putative formula: C12H23N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.324,"smiles":null,"spectrum_id":"CCMSLIB00017225899","spectrum_index":10210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 272.1522 Da; putative annotation: N/A; putative formula: C16H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.254,"smiles":null,"spectrum_id":"CCMSLIB00017225902","spectrum_index":10211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 264.2461 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.354,"smiles":null,"spectrum_id":"CCMSLIB00017225904","spectrum_index":10212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydodecanoic acid (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.232,"smiles":null,"spectrum_id":"CCMSLIB00017225907","spectrum_index":10213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 326.2838 Da; putative annotation: N/A; putative formula: C21H34N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.526,"smiles":null,"spectrum_id":"CCMSLIB00017225909","spectrum_index":10214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Syringic acid from NIST14 (delta mass: 102.068 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.128,"smiles":null,"spectrum_id":"CCMSLIB00017225911","spectrum_index":10215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 829.7365 Da; putative annotation: N/A; putative formula: C50H95N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":992.797,"smiles":null,"spectrum_id":"CCMSLIB00017225914","spectrum_index":10216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 193.0375 Da; putative annotation: N/A; putative formula: C9H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.129,"smiles":null,"spectrum_id":"CCMSLIB00017225915","spectrum_index":10217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxybenzoyl)-4-piperidinylamine (delta mass: 54.9327 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.077,"smiles":null,"spectrum_id":"CCMSLIB00017225917","spectrum_index":10218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 383.2319 Da; putative annotation: N/A; putative formula: C21H29N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.292,"smiles":null,"spectrum_id":"CCMSLIB00017225920","spectrum_index":10219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 104.0628 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017225921","spectrum_index":10220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-hydroxy-4-methoxy-3,5-bis(3-methylbut-2-enyl)-6-pentylbenzoic acid (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017225923","spectrum_index":10221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 49.9974 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.052,"smiles":null,"spectrum_id":"CCMSLIB00017225926","spectrum_index":10222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-4(Z),7(Z),10(Z),13(Z),15(E),19(Z)-docosahexaenoic acid (delta mass: 46.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.269,"smiles":null,"spectrum_id":"CCMSLIB00017225927","spectrum_index":10223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 250.1209 Da; putative annotation: N/A; putative formula: C7H18N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.306,"smiles":null,"spectrum_id":"CCMSLIB00017225931","spectrum_index":10224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 46.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.259,"smiles":null,"spectrum_id":"CCMSLIB00017225932","spectrum_index":10225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 44.0113 Da; putative annotation: N/A; putative formula: C2H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.093,"smiles":null,"spectrum_id":"CCMSLIB00017225936","spectrum_index":10226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 100.0581 Da; putative annotation: N/A; putative formula: C4H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.342,"smiles":null,"spectrum_id":"CCMSLIB00017225937","spectrum_index":10227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal (delta mass: 102.096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.145,"smiles":null,"spectrum_id":"CCMSLIB00017225938","spectrum_index":10228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 162.0398 Da; putative annotation: N/A; putative formula: C4H10N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.095,"smiles":null,"spectrum_id":"CCMSLIB00017225941","spectrum_index":10229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 328.1526 Da; putative annotation: N/A; putative formula: C19H25N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.224,"smiles":null,"spectrum_id":"CCMSLIB00017225943","spectrum_index":10230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 509.2555 Da; putative annotation: N/A; putative formula: C27H36N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.296,"smiles":null,"spectrum_id":"CCMSLIB00017225944","spectrum_index":10231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Methyl-5.beta.-androstan-3.alpha.,17.beta.-diol (delta mass: 283.0902 Da; putative annotation: N/A; putative formula: C7H5N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.353,"smiles":null,"spectrum_id":"CCMSLIB00017225947","spectrum_index":10232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 186.1004 Da; putative annotation: N/A; putative formula: C8H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.213,"smiles":null,"spectrum_id":"CCMSLIB00017225949","spectrum_index":10233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 128.0622 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.122,"smiles":null,"spectrum_id":"CCMSLIB00017225951","spectrum_index":10234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 445.252 Da; putative annotation: N/A; putative formula: C31H31N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.317,"smiles":null,"spectrum_id":"CCMSLIB00017225953","spectrum_index":10235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 127.0834 Da; putative annotation: N/A; putative formula: C7H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.42,"smiles":null,"spectrum_id":"CCMSLIB00017225954","spectrum_index":10236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 298.0844 Da; putative annotation: N/A; putative formula: C10H22N2O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.27,"smiles":null,"spectrum_id":"CCMSLIB00017225956","spectrum_index":10237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Di-tert-butyl-4-hydroxymethylphenol (delta mass: 41.0633 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.248,"smiles":null,"spectrum_id":"CCMSLIB00017225959","spectrum_index":10238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 137.154 Da; putative annotation: N/A; putative formula: C10H19NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017225960","spectrum_index":10239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole - 40.0 eV (delta mass: 74.0349 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017225962","spectrum_index":10240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Myrtenol (delta mass: 41.8726 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017225965","spectrum_index":10241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-n-benzoyl-2-hydroxy-2-phenylethylamine (delta mass: 88.9892 Da; putative annotation: N/A; putative formula: H-1N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.107,"smiles":null,"spectrum_id":"CCMSLIB00017225966","spectrum_index":10242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 273.1435 Da; putative annotation: N/A; putative formula: C10H19N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.24,"smiles":null,"spectrum_id":"CCMSLIB00017225968","spectrum_index":10243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 178.1031 Da; putative annotation: N/A; putative formula: C10H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.283,"smiles":null,"spectrum_id":"CCMSLIB00017225971","spectrum_index":10244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 393.1273 Da; putative annotation: N/A; putative formula: C15H23NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.23,"smiles":null,"spectrum_id":"CCMSLIB00017225972","spectrum_index":10245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU043703 Monomethyl phthalate|2-(Methoxycarbonyl)benzoic acid|2-methoxycarbonylbenzoic acid (delta mass: 112.1244 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.174,"smiles":null,"spectrum_id":"CCMSLIB00017225974","spectrum_index":10246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 59.0325 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.113,"smiles":null,"spectrum_id":"CCMSLIB00017225977","spectrum_index":10247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 342.1165 Da; putative annotation: N/A; putative formula: C15H23N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.24,"smiles":null,"spectrum_id":"CCMSLIB00017225979","spectrum_index":10248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381375-01!(6E)-heptadeca-6,16-diene-1,2,4-triol [IIN-based: Match] (delta mass: 248.2176 Da; putative annotation: N/A; putative formula: C17H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.46,"smiles":null,"spectrum_id":"CCMSLIB00017225982","spectrum_index":10249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Isopentyloxy)benzoic acid (delta mass: 102.0336 Da; putative annotation: N/A; putative formula: C5H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.151,"smiles":null,"spectrum_id":"CCMSLIB00017225983","spectrum_index":10250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Dehydroretinol (delta mass: 155.0785 Da; putative annotation: N/A; putative formula: C8H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.3,"smiles":null,"spectrum_id":"CCMSLIB00017225985","spectrum_index":10251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 137.0676 Da; putative annotation: N/A; putative formula: C8H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.299,"smiles":null,"spectrum_id":"CCMSLIB00017225988","spectrum_index":10252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 88.0314 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.097,"smiles":null,"spectrum_id":"CCMSLIB00017225989","spectrum_index":10253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 90.9947 Da; putative annotation: N/A; putative formula: H2N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.065,"smiles":null,"spectrum_id":"CCMSLIB00017225991","spectrum_index":10254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 91.0646 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.328,"smiles":null,"spectrum_id":"CCMSLIB00017225993","spectrum_index":10255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 16.0157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.19,"smiles":null,"spectrum_id":"CCMSLIB00017225995","spectrum_index":10256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 62.0378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.113,"smiles":null,"spectrum_id":"CCMSLIB00017225998","spectrum_index":10257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 347.9637 Da; putative annotation: N/A; putative formula: C10H9N2O6PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.066,"smiles":null,"spectrum_id":"CCMSLIB00017226000","spectrum_index":10258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-4-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 551.3309 Da; putative annotation: N/A; putative formula: C26H49NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.5,"smiles":null,"spectrum_id":"CCMSLIB00017226003","spectrum_index":10259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 81.9616 Da; putative annotation: N/A; putative formula: C2H-2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.038,"smiles":null,"spectrum_id":"CCMSLIB00017226004","spectrum_index":10260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 68.0259 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.138,"smiles":null,"spectrum_id":"CCMSLIB00017226005","spectrum_index":10261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 1-PHOSPHATE (delta mass: 63.045 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.082,"smiles":null,"spectrum_id":"CCMSLIB00017226009","spectrum_index":10262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 178.0966 Da; putative annotation: N/A; putative formula: C7H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.158,"smiles":null,"spectrum_id":"CCMSLIB00017226010","spectrum_index":10263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 136.0888 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.331,"smiles":null,"spectrum_id":"CCMSLIB00017226012","spectrum_index":10264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 122.0727 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.31,"smiles":null,"spectrum_id":"CCMSLIB00017226015","spectrum_index":10265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Pipecolic acid (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017226017","spectrum_index":10266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-7-methoxy-6-oxooxepino[2,3-b]chromene-5-carboxylic acid (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.092,"smiles":null,"spectrum_id":"CCMSLIB00017226018","spectrum_index":10267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 234.1081 Da; putative annotation: N/A; putative formula: C14H18OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.21,"smiles":null,"spectrum_id":"CCMSLIB00017226020","spectrum_index":10268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyomeprazole sulfide (delta mass: 208.1217 Da; putative annotation: N/A; putative formula: C11H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.233,"smiles":null,"spectrum_id":"CCMSLIB00017226022","spectrum_index":10269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP012803 Benzoic acid (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.065,"smiles":null,"spectrum_id":"CCMSLIB00017226025","spectrum_index":10270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.113,"smiles":null,"spectrum_id":"CCMSLIB00017226027","spectrum_index":10271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 990.665 Da; putative annotation: N/A; putative formula: C57H90N4O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1487.0,"smiles":null,"spectrum_id":"CCMSLIB00017226028","spectrum_index":10272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 34.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.111,"smiles":null,"spectrum_id":"CCMSLIB00017226030","spectrum_index":10273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 118.0765 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.303,"smiles":null,"spectrum_id":"CCMSLIB00017226032","spectrum_index":10274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 162.053 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.134,"smiles":null,"spectrum_id":"CCMSLIB00017226035","spectrum_index":10275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 51.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.242,"smiles":null,"spectrum_id":"CCMSLIB00017226037","spectrum_index":10276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 240.0506 Da; putative annotation: N/A; putative formula: C9H4N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.346,"smiles":null,"spectrum_id":"CCMSLIB00017226038","spectrum_index":10277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 151.1307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.212,"smiles":null,"spectrum_id":"CCMSLIB00017226041","spectrum_index":10278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 54.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.122,"smiles":null,"spectrum_id":"CCMSLIB00017226043","spectrum_index":10279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 72.0312 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.169,"smiles":null,"spectrum_id":"CCMSLIB00017226044","spectrum_index":10280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(Z),7(Z),10(Z),13(Z),16(Z)-N-(2-Hydroxyethyl)docosapentaenamide (delta mass: 152.008 Da; putative annotation: N/A; putative formula: C3N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.313,"smiles":null,"spectrum_id":"CCMSLIB00017226047","spectrum_index":10281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Cyclodecadiene-1-methanol, .alpha.,.alpha.,4,8-tetramethyl- (delta mass: 100.0161 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017226049","spectrum_index":10282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycodeoxycholic acid (delta mass: 192.1786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.5,"smiles":null,"spectrum_id":"CCMSLIB00017226050","spectrum_index":10283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 200.0759 Da; putative annotation: N/A; putative formula: C13H13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.12,"smiles":null,"spectrum_id":"CCMSLIB00017226051","spectrum_index":10284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 497.3565 Da; putative annotation: N/A; putative formula: C22H39N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.396,"smiles":null,"spectrum_id":"CCMSLIB00017226055","spectrum_index":10285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid CollisionEnergy:102040 (delta mass: 327.3143 Da; putative annotation: N/A; putative formula: C20H41NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.578,"smiles":null,"spectrum_id":"CCMSLIB00017226056","spectrum_index":10286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 90.0835 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.207,"smiles":null,"spectrum_id":"CCMSLIB00017226059","spectrum_index":10287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Imidazol-1-ylmethyl)benzoic acid (delta mass: 89.033 Da; putative annotation: N/A; putative formula: H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.115,"smiles":null,"spectrum_id":"CCMSLIB00017226061","spectrum_index":10288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 262.1005 Da; putative annotation: N/A; putative formula: C11H14N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.223,"smiles":null,"spectrum_id":"CCMSLIB00017226062","spectrum_index":10289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epilupeol (delta mass: 441.308 Da; putative annotation: N/A; putative formula: C28H45NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.701,"smiles":null,"spectrum_id":"CCMSLIB00017226066","spectrum_index":10290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 15.0326 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.081,"smiles":null,"spectrum_id":"CCMSLIB00017226067","spectrum_index":10291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 75.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.107,"smiles":null,"spectrum_id":"CCMSLIB00017226068","spectrum_index":10292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 348.2493 Da; putative annotation: N/A; putative formula: C15H28N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.309,"smiles":null,"spectrum_id":"CCMSLIB00017226071","spectrum_index":10293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE10; MS2Dec (delta mass: 60.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.123,"smiles":null,"spectrum_id":"CCMSLIB00017226073","spectrum_index":10294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130036 (delta mass: 312.2283 Da; putative annotation: N/A; putative formula: C22H32O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.424,"smiles":null,"spectrum_id":"CCMSLIB00017226075","spectrum_index":10295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 403.1136 Da; putative annotation: N/A; putative formula: C18H21N5O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.268,"smiles":null,"spectrum_id":"CCMSLIB00017226078","spectrum_index":10296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tauro-alpha-muricholic acid (delta mass: 532.3165 Da; putative annotation: N/A; putative formula: C27H49O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1048.62,"smiles":null,"spectrum_id":"CCMSLIB00017226080","spectrum_index":10297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 761.5636 Da; putative annotation: N/A; putative formula: C38H71N11O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1038.78,"smiles":null,"spectrum_id":"CCMSLIB00017226082","spectrum_index":10298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Picrinine (delta mass: 104.0842 Da; putative annotation: N/A; putative formula: CH8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.254,"smiles":null,"spectrum_id":"CCMSLIB00017226084","spectrum_index":10299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodecanoic acid (delta mass: 41.027 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.212,"smiles":null,"spectrum_id":"CCMSLIB00017226087","spectrum_index":10300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 144.057 Da; putative annotation: N/A; putative formula: C10H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.186,"smiles":null,"spectrum_id":"CCMSLIB00017226088","spectrum_index":10301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 160.0525 Da; putative annotation: N/A; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017226091","spectrum_index":10302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 701.8765 Da; putative annotation: N/A; putative formula: C8H20O25P6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1045.0,"smiles":null,"spectrum_id":"CCMSLIB00017226093","spectrum_index":10303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 162.0325 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.4,"smiles":null,"spectrum_id":"CCMSLIB00017226095","spectrum_index":10304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 149.0223 Da; putative annotation: N/A; putative formula: C6H3N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.124,"smiles":null,"spectrum_id":"CCMSLIB00017226097","spectrum_index":10305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 217.1674 Da; putative annotation: N/A; putative formula: C11H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.425,"smiles":null,"spectrum_id":"CCMSLIB00017226099","spectrum_index":10306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 65.0254 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.08,"smiles":null,"spectrum_id":"CCMSLIB00017226101","spectrum_index":10307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 577.295 Da; putative annotation: N/A; putative formula: C37H43N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":862.487,"smiles":null,"spectrum_id":"CCMSLIB00017226103","spectrum_index":10308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Benzoyl-4-piperidinamine (delta mass: 94.0516 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.185,"smiles":null,"spectrum_id":"CCMSLIB00017226105","spectrum_index":10309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 54.0504 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.267,"smiles":null,"spectrum_id":"CCMSLIB00017226108","spectrum_index":10310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 142.1093 Da; putative annotation: N/A; putative formula: C7H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.191,"smiles":null,"spectrum_id":"CCMSLIB00017226109","spectrum_index":10311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 299.1738 Da; putative annotation: N/A; putative formula: C16H29NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.234,"smiles":null,"spectrum_id":"CCMSLIB00017226110","spectrum_index":10312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 169.1909 Da; putative annotation: N/A; putative formula: C10H23N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.256,"smiles":null,"spectrum_id":"CCMSLIB00017226113","spectrum_index":10313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isotachysterol 3 (delta mass: 150.0831 Da; putative annotation: N/A; putative formula: C13H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.43,"smiles":null,"spectrum_id":"CCMSLIB00017226115","spectrum_index":10314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(N-Methylacetamido)benzoic acid (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017226118","spectrum_index":10315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .DELTA.12-Prostaglandin D2 (delta mass: 59.0735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.306,"smiles":null,"spectrum_id":"CCMSLIB00017226120","spectrum_index":10316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citromycetin (delta mass: 234.0173 Da; putative annotation: N/A; putative formula: C12H10OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.067,"smiles":null,"spectrum_id":"CCMSLIB00017226123","spectrum_index":10317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 66.0378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.088,"smiles":null,"spectrum_id":"CCMSLIB00017226125","spectrum_index":10318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 84.2232 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.271,"smiles":null,"spectrum_id":"CCMSLIB00017226127","spectrum_index":10319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 191.0255 Da; putative annotation: N/A; putative formula: C6H9NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.086,"smiles":null,"spectrum_id":"CCMSLIB00017226129","spectrum_index":10320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 126.0864 Da; putative annotation: N/A; putative formula: C8H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.287,"smiles":null,"spectrum_id":"CCMSLIB00017226132","spectrum_index":10321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 313.1524 Da; putative annotation: N/A; putative formula: C15H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.191,"smiles":null,"spectrum_id":"CCMSLIB00017226134","spectrum_index":10322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 277.1166 Da; putative annotation: N/A; putative formula: C14H20N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.166,"smiles":null,"spectrum_id":"CCMSLIB00017226135","spectrum_index":10323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 157.1855 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.439,"smiles":null,"spectrum_id":"CCMSLIB00017226138","spectrum_index":10324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 88.0677 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.263,"smiles":null,"spectrum_id":"CCMSLIB00017226139","spectrum_index":10325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 158.0943 Da; putative annotation: N/A; putative formula: C8H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.159,"smiles":null,"spectrum_id":"CCMSLIB00017226141","spectrum_index":10326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 317.0776 Da; putative annotation: N/A; putative formula: C11H16N3O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.31,"smiles":null,"spectrum_id":"CCMSLIB00017226144","spectrum_index":10327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Retinoic acid (delta mass: 48.0364 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.253,"smiles":null,"spectrum_id":"CCMSLIB00017226146","spectrum_index":10328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 100.0676 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.284,"smiles":null,"spectrum_id":"CCMSLIB00017226149","spectrum_index":10329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 210.2202 Da; putative annotation: N/A; putative formula: C12H26N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.296,"smiles":null,"spectrum_id":"CCMSLIB00017226150","spectrum_index":10330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,20-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0,?.0?,?.0?,?]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaen-17-ol (delta mass: 41.0296 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.163,"smiles":null,"spectrum_id":"CCMSLIB00017226154","spectrum_index":10331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 41.4695 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.524,"smiles":null,"spectrum_id":"CCMSLIB00017226155","spectrum_index":10332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 114.1042 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.169,"smiles":null,"spectrum_id":"CCMSLIB00017226157","spectrum_index":10333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 19.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.086,"smiles":null,"spectrum_id":"CCMSLIB00017226160","spectrum_index":10334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 301.221 Da; putative annotation: N/A; putative formula: C15H33N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.323,"smiles":null,"spectrum_id":"CCMSLIB00017226162","spectrum_index":10335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 41.0267 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.134,"smiles":null,"spectrum_id":"CCMSLIB00017226164","spectrum_index":10336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 48.0685 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.139,"smiles":null,"spectrum_id":"CCMSLIB00017226165","spectrum_index":10337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.065,"smiles":null,"spectrum_id":"CCMSLIB00017226167","spectrum_index":10338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 91.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.295,"smiles":null,"spectrum_id":"CCMSLIB00017226170","spectrum_index":10339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-Hydroxychalcone (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.112,"smiles":null,"spectrum_id":"CCMSLIB00017226172","spectrum_index":10340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU100601 Sulfaclozine|4-amino-N-(6-chloropyrazin-2-yl)benzenesulfonamide (delta mass: 284.0136 Da; putative annotation: N/A; putative formula: C7H12N2O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.034,"smiles":null,"spectrum_id":"CCMSLIB00017226173","spectrum_index":10341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 48.073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017226176","spectrum_index":10342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Piperidinyl)-2-pyrrolidinone (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.139,"smiles":null,"spectrum_id":"CCMSLIB00017226178","spectrum_index":10343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 124.9938 Da; putative annotation: N/A; putative formula: C5H3NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.049,"smiles":null,"spectrum_id":"CCMSLIB00017226181","spectrum_index":10344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 125.0688 Da; putative annotation: N/A; putative formula: C4H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.149,"smiles":null,"spectrum_id":"CCMSLIB00017226183","spectrum_index":10345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 389.0936 Da; putative annotation: N/A; putative formula: C19H19NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.159,"smiles":null,"spectrum_id":"CCMSLIB00017226184","spectrum_index":10346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-[(Z)-oct-2-enyl]pentanedioic acid (delta mass: 64.066 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.22,"smiles":null,"spectrum_id":"CCMSLIB00017226187","spectrum_index":10347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.16,"smiles":null,"spectrum_id":"CCMSLIB00017226189","spectrum_index":10348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 163.1208 Da; putative annotation: N/A; putative formula: C8H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.337,"smiles":null,"spectrum_id":"CCMSLIB00017226192","spectrum_index":10349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 328.1357 Da; putative annotation: N/A; putative formula: C16H26O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.263,"smiles":null,"spectrum_id":"CCMSLIB00017226194","spectrum_index":10350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Muricholic acid (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.342,"smiles":null,"spectrum_id":"CCMSLIB00017226195","spectrum_index":10351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 145.0195 Da; putative annotation: N/A; putative formula: C7H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.132,"smiles":null,"spectrum_id":"CCMSLIB00017226198","spectrum_index":10352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 267.1705 Da; putative annotation: N/A; putative formula: C12H21N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.319,"smiles":null,"spectrum_id":"CCMSLIB00017226200","spectrum_index":10353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoleoyl-sn-glycero-3-phosphoethanolamine (delta mass: 60.0361 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.527,"smiles":null,"spectrum_id":"CCMSLIB00017226202","spectrum_index":10354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rosellichalasin (delta mass: 45.0572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.3,"smiles":null,"spectrum_id":"CCMSLIB00017226204","spectrum_index":10355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 25.9792 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017226205","spectrum_index":10356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 116.0477 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.269,"smiles":null,"spectrum_id":"CCMSLIB00017226209","spectrum_index":10357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.175,"smiles":null,"spectrum_id":"CCMSLIB00017226210","spectrum_index":10358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 78.0319 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.087,"smiles":null,"spectrum_id":"CCMSLIB00017226212","spectrum_index":10359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 45.0646 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.186,"smiles":null,"spectrum_id":"CCMSLIB00017226215","spectrum_index":10360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbofuran phenol-3-ketone (delta mass: 28.0789 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.149,"smiles":null,"spectrum_id":"CCMSLIB00017226216","spectrum_index":10361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 123.0685 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.192,"smiles":null,"spectrum_id":"CCMSLIB00017226218","spectrum_index":10362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 46.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.122,"smiles":null,"spectrum_id":"CCMSLIB00017226221","spectrum_index":10363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 361.1219 Da; putative annotation: N/A; putative formula: C9H11N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.218,"smiles":null,"spectrum_id":"CCMSLIB00017226222","spectrum_index":10364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU203801 Carbamazepine-10,11-epoxide|Carbamazepine epoxide (delta mass: 63.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.166,"smiles":null,"spectrum_id":"CCMSLIB00017226224","spectrum_index":10365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(18)-Epoxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017226227","spectrum_index":10366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 57.0652 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017226229","spectrum_index":10367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grandiflorenic acid (delta mass: 197.1264 Da; putative annotation: N/A; putative formula: C8H15N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.343,"smiles":null,"spectrum_id":"CCMSLIB00017226231","spectrum_index":10368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Schaftoside (delta mass: 132.0417 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.197,"smiles":null,"spectrum_id":"CCMSLIB00017226233","spectrum_index":10369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 375.2368 Da; putative annotation: N/A; putative formula: C17H33N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":734.552,"smiles":null,"spectrum_id":"CCMSLIB00017226235","spectrum_index":10370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 144.1103 Da; putative annotation: N/A; putative formula: C7H16N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.17,"smiles":null,"spectrum_id":"CCMSLIB00017226237","spectrum_index":10371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 73.0528 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.316,"smiles":null,"spectrum_id":"CCMSLIB00017226240","spectrum_index":10372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 619.5568 Da; putative annotation: N/A; putative formula: C38H74N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.82,"smiles":null,"spectrum_id":"CCMSLIB00017226242","spectrum_index":10373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 319.3079 Da; putative annotation: N/A; putative formula: C19H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.383,"smiles":null,"spectrum_id":"CCMSLIB00017226244","spectrum_index":10374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 332.2366 Da; putative annotation: N/A; putative formula: C22H28N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.36,"smiles":null,"spectrum_id":"CCMSLIB00017226246","spectrum_index":10375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017226249","spectrum_index":10376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 140.0811 Da; putative annotation: N/A; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.162,"smiles":null,"spectrum_id":"CCMSLIB00017226251","spectrum_index":10377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 318.2404 Da; putative annotation: N/A; putative formula: C17H34O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.43,"smiles":null,"spectrum_id":"CCMSLIB00017226253","spectrum_index":10378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Furan-3-yl)-7,8-dihydroxy-6a,7,10b-trimethyl-2,4a,5,6,8,9,10,10a-octahydro-1H-benzo[f]isochromen-4-one (delta mass: 104.062 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.263,"smiles":null,"spectrum_id":"CCMSLIB00017226256","spectrum_index":10379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 35.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.17,"smiles":null,"spectrum_id":"CCMSLIB00017226258","spectrum_index":10380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Eicosenoic acid (delta mass: 17.9376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.232,"smiles":null,"spectrum_id":"CCMSLIB00017226260","spectrum_index":10381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 151.92 Da; putative annotation: N/A; putative formula: C6O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.985,"smiles":null,"spectrum_id":"CCMSLIB00017226262","spectrum_index":10382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 68.0464 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.278,"smiles":null,"spectrum_id":"CCMSLIB00017226265","spectrum_index":10383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dehydrodocosahexaenoic acid (delta mass: 14.0152 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.247,"smiles":null,"spectrum_id":"CCMSLIB00017226267","spectrum_index":10384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385229-01!5-hydroxy-2-(2-hydroxy-6-methoxyphenyl)-6,7,8-trimethoxychromen-4-one (delta mass: 162.0513 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.159,"smiles":null,"spectrum_id":"CCMSLIB00017226271","spectrum_index":10385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 143.0219 Da; putative annotation: N/A; putative formula: C5H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.092,"smiles":null,"spectrum_id":"CCMSLIB00017226272","spectrum_index":10386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-amino-4-methylbenzoate (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.097,"smiles":null,"spectrum_id":"CCMSLIB00017226275","spectrum_index":10387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 252.9894 Da; putative annotation: N/A; putative formula: C10H11NO-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.221,"smiles":null,"spectrum_id":"CCMSLIB00017226277","spectrum_index":10388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,6-Dimethylpyridazin-4-amine (delta mass: 81.9631 Da; putative annotation: N/A; putative formula: C2H-2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.05,"smiles":null,"spectrum_id":"CCMSLIB00017226279","spectrum_index":10389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 43.9899 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.07,"smiles":null,"spectrum_id":"CCMSLIB00017226282","spectrum_index":10390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 40.016 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017226284","spectrum_index":10391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyclopropylmethyl)piperazine (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.165,"smiles":null,"spectrum_id":"CCMSLIB00017226286","spectrum_index":10392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 76.0164 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.066,"smiles":null,"spectrum_id":"CCMSLIB00017226289","spectrum_index":10393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5S)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one (delta mass: 63.0298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.152,"smiles":null,"spectrum_id":"CCMSLIB00017226290","spectrum_index":10394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:102040 (delta mass: 267.2537 Da; putative annotation: N/A; putative formula: C13H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.522,"smiles":null,"spectrum_id":"CCMSLIB00017226292","spectrum_index":10395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 94.0736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.128,"smiles":null,"spectrum_id":"CCMSLIB00017226295","spectrum_index":10396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 64.0149 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.117,"smiles":null,"spectrum_id":"CCMSLIB00017226297","spectrum_index":10397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyacetophenone (delta mass: 96.9823 Da; putative annotation: N/A; putative formula: C2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.042,"smiles":null,"spectrum_id":"CCMSLIB00017226299","spectrum_index":10398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1355.5747 Da; putative annotation: N/A; putative formula: C71H77N19O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1577.67,"smiles":null,"spectrum_id":"CCMSLIB00017226302","spectrum_index":10399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 410.244 Da; putative annotation: N/A; putative formula: C19H39O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.315,"smiles":null,"spectrum_id":"CCMSLIB00017226303","spectrum_index":10400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 312.2301 Da; putative annotation: N/A; putative formula: C18H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.296,"smiles":null,"spectrum_id":"CCMSLIB00017226306","spectrum_index":10401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 38.0507 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.319,"smiles":null,"spectrum_id":"CCMSLIB00017226308","spectrum_index":10402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 64.0661 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.293,"smiles":null,"spectrum_id":"CCMSLIB00017226310","spectrum_index":10403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aspirin (delta mass: 43.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.075,"smiles":null,"spectrum_id":"CCMSLIB00017226313","spectrum_index":10404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Epoxy-5Z,8Z,11Z-eicosatrienoic acid (delta mass: 64.0307 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.273,"smiles":null,"spectrum_id":"CCMSLIB00017226315","spectrum_index":10405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 182.1907 Da; putative annotation: N/A; putative formula: C10H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.371,"smiles":null,"spectrum_id":"CCMSLIB00017226318","spectrum_index":10406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 282.256 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.405,"smiles":null,"spectrum_id":"CCMSLIB00017226320","spectrum_index":10407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Pro (delta mass: 240.2453 Da; putative annotation: N/A; putative formula: C16H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.358,"smiles":null,"spectrum_id":"CCMSLIB00017226323","spectrum_index":10408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 87.0329 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.151,"smiles":null,"spectrum_id":"CCMSLIB00017226325","spectrum_index":10409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heneicosapentaenoic acid (delta mass: 50.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.285,"smiles":null,"spectrum_id":"CCMSLIB00017226326","spectrum_index":10410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzoic acid (delta mass: 169.9698 Da; putative annotation: N/A; putative formula: C5H3N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.009,"smiles":null,"spectrum_id":"CCMSLIB00017226330","spectrum_index":10411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyageraphorone (delta mass: 162.0521 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.237,"smiles":null,"spectrum_id":"CCMSLIB00017226331","spectrum_index":10412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Dihydrotestosterone (delta mass: 82.0779 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017226334","spectrum_index":10413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 175.0634 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.155,"smiles":null,"spectrum_id":"CCMSLIB00017226336","spectrum_index":10414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amino adipic acid dimethyl ester (delta mass: 98.0724 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.18,"smiles":null,"spectrum_id":"CCMSLIB00017226338","spectrum_index":10415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monopalmitolein (9c) from NIST14 (delta mass: 166.0635 Da; putative annotation: N/A; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.332,"smiles":null,"spectrum_id":"CCMSLIB00017226341","spectrum_index":10416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 247.1788 Da; putative annotation: N/A; putative formula: C12H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.239,"smiles":null,"spectrum_id":"CCMSLIB00017226342","spectrum_index":10417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 483.2562 Da; putative annotation: N/A; putative formula: C35H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.379,"smiles":null,"spectrum_id":"CCMSLIB00017226345","spectrum_index":10418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 446.2058 Da; putative annotation: N/A; putative formula: C26H31N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.318,"smiles":null,"spectrum_id":"CCMSLIB00017226347","spectrum_index":10419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 43.0394 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.219,"smiles":null,"spectrum_id":"CCMSLIB00017226349","spectrum_index":10420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 68.0262 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017226352","spectrum_index":10421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 143.0583 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.192,"smiles":null,"spectrum_id":"CCMSLIB00017226353","spectrum_index":10422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 40.0316 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.097,"smiles":null,"spectrum_id":"CCMSLIB00017226355","spectrum_index":10423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 162.0527 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.229,"smiles":null,"spectrum_id":"CCMSLIB00017226358","spectrum_index":10424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 118.077 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.309,"smiles":null,"spectrum_id":"CCMSLIB00017226359","spectrum_index":10425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 104.0267 Da; putative annotation: N/A; putative formula: H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.274,"smiles":null,"spectrum_id":"CCMSLIB00017226362","spectrum_index":10426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-((methylamino)methyl)quinolin-2(1H)-one (delta mass: 72.0293 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.132,"smiles":null,"spectrum_id":"CCMSLIB00017226364","spectrum_index":10427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300738 Cephaeline (delta mass: 85.0605 Da; putative annotation: N/A; putative formula: C3H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.351,"smiles":null,"spectrum_id":"CCMSLIB00017226366","spectrum_index":10428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 159.0896 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.155,"smiles":null,"spectrum_id":"CCMSLIB00017226369","spectrum_index":10429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 298.2511 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.53,"smiles":null,"spectrum_id":"CCMSLIB00017226370","spectrum_index":10430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 418.3078 Da; putative annotation: N/A; putative formula: C26H42O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.524,"smiles":null,"spectrum_id":"CCMSLIB00017226373","spectrum_index":10431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 291.122 Da; putative annotation: N/A; putative formula: C14H17N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.209,"smiles":null,"spectrum_id":"CCMSLIB00017226375","spectrum_index":10432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 296.1787 Da; putative annotation: N/A; putative formula: C13H24N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.458,"smiles":null,"spectrum_id":"CCMSLIB00017226376","spectrum_index":10433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.295,"smiles":null,"spectrum_id":"CCMSLIB00017226380","spectrum_index":10434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (delta mass: 329.0527 Da; putative annotation: N/A; putative formula: C10H12N5O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.157,"smiles":null,"spectrum_id":"CCMSLIB00017226381","spectrum_index":10435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 43.067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.159,"smiles":null,"spectrum_id":"CCMSLIB00017226383","spectrum_index":10436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 138.0491 Da; putative annotation: N/A; putative formula: H6N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.129,"smiles":null,"spectrum_id":"CCMSLIB00017226386","spectrum_index":10437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 633.0252 Da; putative annotation: N/A; putative formula: C19H19N7O12S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.138,"smiles":null,"spectrum_id":"CCMSLIB00017226387","spectrum_index":10438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 699.5004 Da; putative annotation: N/A; putative formula: C41H69N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1052.77,"smiles":null,"spectrum_id":"CCMSLIB00017226389","spectrum_index":10439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 80.0631 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.321,"smiles":null,"spectrum_id":"CCMSLIB00017226392","spectrum_index":10440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 48.0366 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.279,"smiles":null,"spectrum_id":"CCMSLIB00017226393","spectrum_index":10441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 46.0134 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.189,"smiles":null,"spectrum_id":"CCMSLIB00017226396","spectrum_index":10442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 156.0422 Da; putative annotation: N/A; putative formula: C7H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.129,"smiles":null,"spectrum_id":"CCMSLIB00017226398","spectrum_index":10443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 133.0331 Da; putative annotation: N/A; putative formula: C3H9N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.114,"smiles":null,"spectrum_id":"CCMSLIB00017226399","spectrum_index":10444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminocaproic acid (delta mass: 42.011 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.113,"smiles":null,"spectrum_id":"CCMSLIB00017226401","spectrum_index":10445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 78.0141 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.069,"smiles":null,"spectrum_id":"CCMSLIB00017226404","spectrum_index":10446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 37.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.106,"smiles":null,"spectrum_id":"CCMSLIB00017226405","spectrum_index":10447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 133.0459 Da; putative annotation: N/A; putative formula: C8H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.096,"smiles":null,"spectrum_id":"CCMSLIB00017226407","spectrum_index":10448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 143.0949 Da; putative annotation: N/A; putative formula: C7H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.176,"smiles":null,"spectrum_id":"CCMSLIB00017226410","spectrum_index":10449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 289.1181 Da; putative annotation: N/A; putative formula: C13H15N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.197,"smiles":null,"spectrum_id":"CCMSLIB00017226411","spectrum_index":10450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 94.0215 Da; putative annotation: N/A; putative formula: C9H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.269,"smiles":null,"spectrum_id":"CCMSLIB00017226414","spectrum_index":10451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.247,"smiles":null,"spectrum_id":"CCMSLIB00017226416","spectrum_index":10452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Dehydrocorticosterone (delta mass: 36.0348 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.241,"smiles":null,"spectrum_id":"CCMSLIB00017226417","spectrum_index":10453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid (delta mass: 114.0687 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.436,"smiles":null,"spectrum_id":"CCMSLIB00017226421","spectrum_index":10454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-pyrazole (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.066,"smiles":null,"spectrum_id":"CCMSLIB00017226422","spectrum_index":10455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 383.2153 Da; putative annotation: N/A; putative formula: C14H21N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.291,"smiles":null,"spectrum_id":"CCMSLIB00017226424","spectrum_index":10456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 1189.7683 Da; putative annotation: N/A; putative formula: C60H99N15O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1327.86,"smiles":null,"spectrum_id":"CCMSLIB00017226427","spectrum_index":10457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 577.7101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.781,"smiles":null,"spectrum_id":"CCMSLIB00017226428","spectrum_index":10458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 777.5324 Da; putative annotation: N/A; putative formula: C43H75N3O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":958.603,"smiles":null,"spectrum_id":"CCMSLIB00017226430","spectrum_index":10459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 493.4849 Da; putative annotation: N/A; putative formula: C32H63NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.555,"smiles":null,"spectrum_id":"CCMSLIB00017226433","spectrum_index":10460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 199.0618 Da; putative annotation: N/A; putative formula: C6H10N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.362,"smiles":null,"spectrum_id":"CCMSLIB00017226435","spectrum_index":10461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. alcohol methyl ether (delta mass: 375.2251 Da; putative annotation: N/A; putative formula: C18H33NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.509,"smiles":null,"spectrum_id":"CCMSLIB00017226438","spectrum_index":10462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 252.2798 Da; putative annotation: N/A; putative formula: C18H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.48,"smiles":null,"spectrum_id":"CCMSLIB00017226439","spectrum_index":10463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 282.2556 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.331,"smiles":null,"spectrum_id":"CCMSLIB00017226441","spectrum_index":10464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 3.5287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":113.6,"smiles":null,"spectrum_id":"CCMSLIB00017226444","spectrum_index":10465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 154.0028 Da; putative annotation: N/A; putative formula: C6H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.235,"smiles":null,"spectrum_id":"CCMSLIB00017226445","spectrum_index":10466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 392.2927 Da; putative annotation: N/A; putative formula: C24H40O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.368,"smiles":null,"spectrum_id":"CCMSLIB00017226448","spectrum_index":10467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 385.1478 Da; putative annotation: N/A; putative formula: C18H28NO4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.234,"smiles":null,"spectrum_id":"CCMSLIB00017226450","spectrum_index":10468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 121.0444 Da; putative annotation: N/A; putative formula: C7H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.25,"smiles":null,"spectrum_id":"CCMSLIB00017226452","spectrum_index":10469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(6-methyl-6-azabicyclo[4.4.0]dec-2-yl)methyl 3-aminopropanoate, iodide CollisionEnergy:205060\"\" (delta mass: 160.1233 Da; putative annotation: N/A; putative formula: C12H16)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.33,"smiles":null,"spectrum_id":"CCMSLIB00017226455","spectrum_index":10470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 29.1107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.083,"smiles":null,"spectrum_id":"CCMSLIB00017226456","spectrum_index":10471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 106.0632 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.165,"smiles":null,"spectrum_id":"CCMSLIB00017226458","spectrum_index":10472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperidine-2-carboxylic acid (delta mass: 117.0432 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.14,"smiles":null,"spectrum_id":"CCMSLIB00017226461","spectrum_index":10473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 225.1633 Da; putative annotation: N/A; putative formula: C15H19N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.255,"smiles":null,"spectrum_id":"CCMSLIB00017226462","spectrum_index":10474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 28.0061 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.124,"smiles":null,"spectrum_id":"CCMSLIB00017226465","spectrum_index":10475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,3S)-3-hydroxy-1-octenyl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5E)- (delta mass: 100.0672 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.32,"smiles":null,"spectrum_id":"CCMSLIB00017226467","spectrum_index":10476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1a,1b-Dihomoprostaglandin E1 (delta mass: 62.0521 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.331,"smiles":null,"spectrum_id":"CCMSLIB00017226468","spectrum_index":10477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Fenoterol (delta mass: 116.0685 Da; putative annotation: N/A; putative formula: C3H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.223,"smiles":null,"spectrum_id":"CCMSLIB00017226471","spectrum_index":10478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 153.0454 Da; putative annotation: N/A; putative formula: C6H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.158,"smiles":null,"spectrum_id":"CCMSLIB00017226473","spectrum_index":10479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 137.0685 Da; putative annotation: N/A; putative formula: C5H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.285,"smiles":null,"spectrum_id":"CCMSLIB00017226474","spectrum_index":10480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 56.0304 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.137,"smiles":null,"spectrum_id":"CCMSLIB00017226476","spectrum_index":10481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epinephrine (delta mass: 371.3183 Da; putative annotation: N/A; putative formula: C25H41NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.415,"smiles":null,"spectrum_id":"CCMSLIB00017226479","spectrum_index":10482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethanolamine; AIF; CE10; MS2Dec (delta mass: 88.0521 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.165,"smiles":null,"spectrum_id":"CCMSLIB00017226480","spectrum_index":10483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 85.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.185,"smiles":null,"spectrum_id":"CCMSLIB00017226482","spectrum_index":10484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML01010 Demecolcine (delta mass: 371.1777 Da; putative annotation: N/A; putative formula: C19H33NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":743.358,"smiles":null,"spectrum_id":"CCMSLIB00017226485","spectrum_index":10485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aspirin (delta mass: 15.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.065,"smiles":null,"spectrum_id":"CCMSLIB00017226487","spectrum_index":10486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 203.1154 Da; putative annotation: N/A; putative formula: C9H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.363,"smiles":null,"spectrum_id":"CCMSLIB00017226488","spectrum_index":10487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 125.032 Da; putative annotation: N/A; putative formula: C3H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.243,"smiles":null,"spectrum_id":"CCMSLIB00017226492","spectrum_index":10488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 156.1314 Da; putative annotation: N/A; putative formula: C13H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.556,"smiles":null,"spectrum_id":"CCMSLIB00017226493","spectrum_index":10489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 174.1431 Da; putative annotation: N/A; putative formula: C13H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.568,"smiles":null,"spectrum_id":"CCMSLIB00017226496","spectrum_index":10490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 92.0473 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.154,"smiles":null,"spectrum_id":"CCMSLIB00017226498","spectrum_index":10491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 155.0618 Da; putative annotation: N/A; putative formula: C6H10N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.121,"smiles":null,"spectrum_id":"CCMSLIB00017226499","spectrum_index":10492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 301.2157 Da; putative annotation: N/A; putative formula: C18H27N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.5,"smiles":null,"spectrum_id":"CCMSLIB00017226502","spectrum_index":10493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 84.0208 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.071,"smiles":null,"spectrum_id":"CCMSLIB00017226504","spectrum_index":10494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxocholesterol (delta mass: 60.0205 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.362,"smiles":null,"spectrum_id":"CCMSLIB00017226505","spectrum_index":10495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Arg (delta mass: 43.0058 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.209,"smiles":null,"spectrum_id":"CCMSLIB00017226507","spectrum_index":10496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 108.0942 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.321,"smiles":null,"spectrum_id":"CCMSLIB00017226510","spectrum_index":10497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 317.238 Da; putative annotation: N/A; putative formula: C19H32N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.491,"smiles":null,"spectrum_id":"CCMSLIB00017226511","spectrum_index":10498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 158.1506 Da; putative annotation: N/A; putative formula: C7H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.409,"smiles":null,"spectrum_id":"CCMSLIB00017226512","spectrum_index":10499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 285.1067 Da; putative annotation: N/A; putative formula: C12H20N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.375,"smiles":null,"spectrum_id":"CCMSLIB00017226516","spectrum_index":10500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 75.0319 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.097,"smiles":null,"spectrum_id":"CCMSLIB00017226517","spectrum_index":10501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 50.051 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.288,"smiles":null,"spectrum_id":"CCMSLIB00017226519","spectrum_index":10502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017226522","spectrum_index":10503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 133.0847 Da; putative annotation: N/A; putative formula: C4H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.125,"smiles":null,"spectrum_id":"CCMSLIB00017226523","spectrum_index":10504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4-dihydroxybenzoic acid CollisionEnergy:102040\"\" (delta mass: 5.1103 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.144,"smiles":null,"spectrum_id":"CCMSLIB00017226526","spectrum_index":10505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 220.0851 Da; putative annotation: N/A; putative formula: C11H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.145,"smiles":null,"spectrum_id":"CCMSLIB00017226528","spectrum_index":10506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 358.4788 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.56,"smiles":null,"spectrum_id":"CCMSLIB00017226529","spectrum_index":10507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 363.173 Da; putative annotation: N/A; putative formula: C17H25N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.232,"smiles":null,"spectrum_id":"CCMSLIB00017226532","spectrum_index":10508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250806 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 134.0573 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.117,"smiles":null,"spectrum_id":"CCMSLIB00017226534","spectrum_index":10509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 219.1019 Da; putative annotation: N/A; putative formula: C9H18NO3P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.172,"smiles":null,"spectrum_id":"CCMSLIB00017226535","spectrum_index":10510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 39.0259 Da; putative annotation: N/A; putative formula: CHN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.075,"smiles":null,"spectrum_id":"CCMSLIB00017226538","spectrum_index":10511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 137.0838 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.165,"smiles":null,"spectrum_id":"CCMSLIB00017226540","spectrum_index":10512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heneicosapentaenoic acid (delta mass: 54.048 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.296,"smiles":null,"spectrum_id":"CCMSLIB00017226541","spectrum_index":10513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 112.0775 Da; putative annotation: N/A; putative formula: C4H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.185,"smiles":null,"spectrum_id":"CCMSLIB00017226545","spectrum_index":10514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 361.1377 Da; putative annotation: N/A; putative formula: C18H24N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.177,"smiles":null,"spectrum_id":"CCMSLIB00017226546","spectrum_index":10515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 304.1686 Da; putative annotation: N/A; putative formula: C19H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.229,"smiles":null,"spectrum_id":"CCMSLIB00017226548","spectrum_index":10516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol oxide A (delta mass: 230.043 Da; putative annotation: N/A; putative formula: C12H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.244,"smiles":null,"spectrum_id":"CCMSLIB00017226551","spectrum_index":10517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 265.0806 Da; putative annotation: N/A; putative formula: C10H19NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.281,"smiles":null,"spectrum_id":"CCMSLIB00017226552","spectrum_index":10518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-(3-Hydroxy-2,2,5a-trimethyl-7-methylidenedecahydro-1-benzoxepin-6-yl)ethyl)-2,2,5a,7-tetramethyldecahydro-1-benzoxepine-3,4,6-triol (delta mass: 126.0831 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.467,"smiles":null,"spectrum_id":"CCMSLIB00017226555","spectrum_index":10519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 262.1568 Da; putative annotation: N/A; putative formula: C16H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.28,"smiles":null,"spectrum_id":"CCMSLIB00017226557","spectrum_index":10520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Strobilactone A (delta mass: 94.078 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.237,"smiles":null,"spectrum_id":"CCMSLIB00017226559","spectrum_index":10521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tryptamine-C8:0 (delta mass: 171.162 Da; putative annotation: N/A; putative formula: C10H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.374,"smiles":null,"spectrum_id":"CCMSLIB00017226561","spectrum_index":10522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385919-01_C20H34O_2-Penten-1-ol, 5-[(1S,4aS,8aS)-decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]-3-methyl-, (2E)- (delta mass: 120.0928 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.361,"smiles":null,"spectrum_id":"CCMSLIB00017226564","spectrum_index":10523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 200.0823 Da; putative annotation: N/A; putative formula: C7H13N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.158,"smiles":null,"spectrum_id":"CCMSLIB00017226565","spectrum_index":10524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 267.1083 Da; putative annotation: N/A; putative formula: C14H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.189,"smiles":null,"spectrum_id":"CCMSLIB00017226568","spectrum_index":10525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 59.0194 Da; putative annotation: 2-Aminoethanethiol; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.107,"smiles":null,"spectrum_id":"CCMSLIB00017226570","spectrum_index":10526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Leu-DL-Val (delta mass: 113.0848 Da; putative annotation: LEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.255,"smiles":null,"spectrum_id":"CCMSLIB00017226572","spectrum_index":10527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-tryptophan; LC-tDDA; CE10 (delta mass: 186.0783 Da; putative annotation: L-Tryptophan; putative formula: C11H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.186,"smiles":null,"spectrum_id":"CCMSLIB00017226575","spectrum_index":10528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 146.0731 Da; putative annotation: 1-(2-Hydroxy-4,5-dimethylphenyl)ethanone; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.238,"smiles":null,"spectrum_id":"CCMSLIB00017226577","spectrum_index":10529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzaldehyde (delta mass: 134.0365 Da; putative annotation: 2-Hydroxy-4-methylbenzoic acid; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.076,"smiles":null,"spectrum_id":"CCMSLIB00017226579","spectrum_index":10530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Pro from NIST14 (delta mass: 97.0526 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.155,"smiles":null,"spectrum_id":"CCMSLIB00017226580","spectrum_index":10531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Gly-Gly (delta mass: 204.0901 Da; putative annotation: Phe-Gly; putative formula: C11H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.219,"smiles":null,"spectrum_id":"CCMSLIB00017226584","spectrum_index":10532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Azaindole (delta mass: 91.042 Da; putative annotation: 2-AMINOPHENOL; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.102,"smiles":null,"spectrum_id":"CCMSLIB00017226585","spectrum_index":10533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 260.2136 Da; putative annotation: Pinolenic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.435,"smiles":null,"spectrum_id":"CCMSLIB00017226587","spectrum_index":10534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 190.1724 Da; putative annotation: 1-Ethynylcyclododecanol; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.378,"smiles":null,"spectrum_id":"CCMSLIB00017226590","spectrum_index":10535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 312.2667 Da; putative annotation: Spectral Match to 1-Hexadecanoyl-sn-glycerol from NIST14; putative formula: C19H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.478,"smiles":null,"spectrum_id":"CCMSLIB00017226591","spectrum_index":10536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hexadec-15-en-7-ynyl-4-hydroxy-5-methyloxolan-2-one (delta mass: 90.0466 Da; putative annotation: 3-Methylphenol; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017226593","spectrum_index":10537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 58.0415 Da; putative annotation: 1,3-Propanediol; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.106,"smiles":null,"spectrum_id":"CCMSLIB00017226596","spectrum_index":10538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 454.3452 Da; putative annotation: (24E)-1,3-Dihydroxydammara-12,24-dien-26-oic acid; putative formula: C30H46O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":909.697,"smiles":null,"spectrum_id":"CCMSLIB00017226597","spectrum_index":10539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 345.2876 Da; putative annotation: (.+/-.)-2-Methylarachidonoyl-2'-fluoroethylamide; putative formula: C23H36FN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.509,"smiles":null,"spectrum_id":"CCMSLIB00017226600","spectrum_index":10540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-linoleoyl-rac-glycerol (delta mass: 295.2511 Da; putative annotation: N-Palmitoylglycine; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.781,"smiles":null,"spectrum_id":"CCMSLIB00017226602","spectrum_index":10541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonoylglycerol (delta mass: 138.1033 Da; putative annotation: (2-Hydroxymethylbicyclo[2.2.1]hept-2-yl)methanol; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.388,"smiles":null,"spectrum_id":"CCMSLIB00017226603","spectrum_index":10542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 158.0662 Da; putative annotation: Gly-Thr; putative formula: C6H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.158,"smiles":null,"spectrum_id":"CCMSLIB00017226607","spectrum_index":10543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 264.0998 Da; putative annotation: Methyl 4,6-O-benzylidene-.alpha.-D-glucopyranoside; putative formula: C14H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.16,"smiles":null,"spectrum_id":"CCMSLIB00017226608","spectrum_index":10544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 119.0734 Da; putative annotation: (R)-(-)-2-Phenylglycinol; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.134,"smiles":null,"spectrum_id":"CCMSLIB00017226609","spectrum_index":10545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,11-Tridecadienoic acid, 13-(3-pentyl-2-oxiranyl)-, (8Z,11Z)- (delta mass: 281.2726 Da; putative annotation: D-erythro-N-stearoylsphingosine; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.531,"smiles":null,"spectrum_id":"CCMSLIB00017226613","spectrum_index":10546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 152.0831 Da; putative annotation: 3-(2-Oxocyclohexyl)propanoic acid; putative formula: C9H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.305,"smiles":null,"spectrum_id":"CCMSLIB00017226614","spectrum_index":10547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 143.0953 Da; putative annotation: L-CARNITINE - 70.0 eV; putative formula: C7H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.155,"smiles":null,"spectrum_id":"CCMSLIB00017226616","spectrum_index":10548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 74.0499 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.277,"smiles":null,"spectrum_id":"CCMSLIB00017226619","spectrum_index":10549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 88.0676 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017226621","spectrum_index":10550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,6-Tetrahydrobenzylalcohol (delta mass: 44.9852 Da; putative annotation: N/A; putative formula: H-1NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017226623","spectrum_index":10551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 512.3961 Da; putative annotation: N/A; putative formula: C34H57O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":805.607,"smiles":null,"spectrum_id":"CCMSLIB00017226626","spectrum_index":10552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 40.0328 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.161,"smiles":null,"spectrum_id":"CCMSLIB00017226628","spectrum_index":10553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Hydroxy-15-kauren-19-oic acid (delta mass: 48.0362 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.263,"smiles":null,"spectrum_id":"CCMSLIB00017226631","spectrum_index":10554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 17.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.122,"smiles":null,"spectrum_id":"CCMSLIB00017226633","spectrum_index":10555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Di-.gamma.-linolenin (6c,9c,12c) from NIST14 (delta mass: 158.1487 Da; putative annotation: N/A; putative formula: C13H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.631,"smiles":null,"spectrum_id":"CCMSLIB00017226636","spectrum_index":10556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 87.0205 Da; putative annotation: N/A; putative formula: C5HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017226638","spectrum_index":10557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 228.1153 Da; putative annotation: N/A; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.181,"smiles":null,"spectrum_id":"CCMSLIB00017226639","spectrum_index":10558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 328.1657 Da; putative annotation: N/A; putative formula: C20H24O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.325,"smiles":null,"spectrum_id":"CCMSLIB00017226643","spectrum_index":10559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 62.0522 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017226644","spectrum_index":10560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 88.0521 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.3,"smiles":null,"spectrum_id":"CCMSLIB00017226645","spectrum_index":10561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 285.2313 Da; putative annotation: N/A; putative formula: C17H27N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":742.599,"smiles":null,"spectrum_id":"CCMSLIB00017226649","spectrum_index":10562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 16.9894 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.06,"smiles":null,"spectrum_id":"CCMSLIB00017226650","spectrum_index":10563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Norepiandrosterone (delta mass: 253.1169 Da; putative annotation: N/A; putative formula: C12H20N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.333,"smiles":null,"spectrum_id":"CCMSLIB00017226653","spectrum_index":10564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 123.0699 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.224,"smiles":null,"spectrum_id":"CCMSLIB00017226655","spectrum_index":10565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one (delta mass: 50.0518 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017226657","spectrum_index":10566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 669.284 Da; putative annotation: N/A; putative formula: C41H39N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.344,"smiles":null,"spectrum_id":"CCMSLIB00017226660","spectrum_index":10567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 102.9584 Da; putative annotation: N/A; putative formula: C2HNS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.05,"smiles":null,"spectrum_id":"CCMSLIB00017226662","spectrum_index":10568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 145.064 Da; putative annotation: N/A; putative formula: C8H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.124,"smiles":null,"spectrum_id":"CCMSLIB00017226664","spectrum_index":10569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4-(Difluoromethoxy)-3-methoxyphenyl]methanamine (delta mass: 22.0226 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.106,"smiles":null,"spectrum_id":"CCMSLIB00017226667","spectrum_index":10570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 298.1049 Da; putative annotation: N/A; putative formula: C9H23N4OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.202,"smiles":null,"spectrum_id":"CCMSLIB00017226668","spectrum_index":10571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 598.3748 Da; putative annotation: N/A; putative formula: C31H55N2O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":925.503,"smiles":null,"spectrum_id":"CCMSLIB00017226671","spectrum_index":10572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310798 Quinoxalinedione + 2Methyl + C5H11O4 (delta mass: 162.0555 Da; putative annotation: N/A; putative formula: C5H11N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.195,"smiles":null,"spectrum_id":"CCMSLIB00017226675","spectrum_index":10573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 148.0921 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.34,"smiles":null,"spectrum_id":"CCMSLIB00017226677","spectrum_index":10574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 192.077 Da; putative annotation: N/A; putative formula: C11H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.184,"smiles":null,"spectrum_id":"CCMSLIB00017226679","spectrum_index":10575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 72.0359 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.373,"smiles":null,"spectrum_id":"CCMSLIB00017226682","spectrum_index":10576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 327.0946 Da; putative annotation: N/A; putative formula: C19H13N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.165,"smiles":null,"spectrum_id":"CCMSLIB00017226683","spectrum_index":10577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Isobutyryl-4-piperidinamine (delta mass: 170.0938 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.243,"smiles":null,"spectrum_id":"CCMSLIB00017226686","spectrum_index":10578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 98.0225 Da; putative annotation: N/A; putative formula: C2H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.109,"smiles":null,"spectrum_id":"CCMSLIB00017226688","spectrum_index":10579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 99.09 Da; putative annotation: N/A; putative formula: C3H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.301,"smiles":null,"spectrum_id":"CCMSLIB00017226690","spectrum_index":10580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017226692","spectrum_index":10581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 268.2047 Da; putative annotation: N/A; putative formula: C17H24N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.296,"smiles":null,"spectrum_id":"CCMSLIB00017226694","spectrum_index":10582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLIC ACID (delta mass: 98.0725 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.111,"smiles":null,"spectrum_id":"CCMSLIB00017226696","spectrum_index":10583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 67.0779 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.112,"smiles":null,"spectrum_id":"CCMSLIB00017226698","spectrum_index":10584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 24.9188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017226701","spectrum_index":10585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 197.1423 Da; putative annotation: N/A; putative formula: C11H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.229,"smiles":null,"spectrum_id":"CCMSLIB00017226702","spectrum_index":10586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 179.0801 Da; putative annotation: N/A; putative formula: C7H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.234,"smiles":null,"spectrum_id":"CCMSLIB00017226705","spectrum_index":10587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 14.016 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.238,"smiles":null,"spectrum_id":"CCMSLIB00017226706","spectrum_index":10588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 446.2712 Da; putative annotation: N/A; putative formula: C26H35N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.384,"smiles":null,"spectrum_id":"CCMSLIB00017226708","spectrum_index":10589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 288.1472 Da; putative annotation: N/A; putative formula: C16H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.285,"smiles":null,"spectrum_id":"CCMSLIB00017226711","spectrum_index":10590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydronorketamine (delta mass: 41.0452 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.113,"smiles":null,"spectrum_id":"CCMSLIB00017226712","spectrum_index":10591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Ketodeoxycholic acid (delta mass: 135.07 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.354,"smiles":null,"spectrum_id":"CCMSLIB00017226715","spectrum_index":10592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monoolein from NIST14 (delta mass: 15.9917 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.292,"smiles":null,"spectrum_id":"CCMSLIB00017226717","spectrum_index":10593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 85.078 Da; putative annotation: N/A; putative formula: C2H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.138,"smiles":null,"spectrum_id":"CCMSLIB00017226718","spectrum_index":10594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 119.1016 Da; putative annotation: N/A; putative formula: H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.208,"smiles":null,"spectrum_id":"CCMSLIB00017226722","spectrum_index":10595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 114.1668 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.273,"smiles":null,"spectrum_id":"CCMSLIB00017226723","spectrum_index":10596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Uvaol from NIST14 (delta mass: 82.0783 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.467,"smiles":null,"spectrum_id":"CCMSLIB00017226726","spectrum_index":10597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethanolamide (delta mass: 74.0599 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.35,"smiles":null,"spectrum_id":"CCMSLIB00017226728","spectrum_index":10598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 116.1 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.389,"smiles":null,"spectrum_id":"CCMSLIB00017226730","spectrum_index":10599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 116.099 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.446,"smiles":null,"spectrum_id":"CCMSLIB00017226733","spectrum_index":10600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 154.1362 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.264,"smiles":null,"spectrum_id":"CCMSLIB00017226734","spectrum_index":10601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Guanidine, N-(4-fluorophenyl)-N'-hydroxy- (delta mass: 45.0666 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.139,"smiles":null,"spectrum_id":"CCMSLIB00017226736","spectrum_index":10602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU105302 cis-1,2,3,6-Tetrahydrophthalimide|(3aR,7aS)-3a,4,7,7a-tetrahydroisoindole-1,3-dione (delta mass: 217.0594 Da; putative annotation: N/A; putative formula: C9H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.13,"smiles":null,"spectrum_id":"CCMSLIB00017226739","spectrum_index":10603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ellagic acid (delta mass: 638.076 Da; putative annotation: N/A; putative formula: C33H34O-1S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":941.089,"smiles":null,"spectrum_id":"CCMSLIB00017226741","spectrum_index":10604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 387.2616 Da; putative annotation: N/A; putative formula: C20H37NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.348,"smiles":null,"spectrum_id":"CCMSLIB00017226742","spectrum_index":10605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 92.0739 Da; putative annotation: N/A; putative formula: C6H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.191,"smiles":null,"spectrum_id":"CCMSLIB00017226745","spectrum_index":10606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 15.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.143,"smiles":null,"spectrum_id":"CCMSLIB00017226747","spectrum_index":10607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxyquinoline-2-carboxylic acid CollisionEnergy:102040 (delta mass: 15.0344 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.1,"smiles":null,"spectrum_id":"CCMSLIB00017226750","spectrum_index":10608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Nitrosopiperazine (NPAZ) (delta mass: 89.9582 Da; putative annotation: N/A; putative formula: CH-2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017226752","spectrum_index":10609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017226754","spectrum_index":10610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 91.0422 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.123,"smiles":null,"spectrum_id":"CCMSLIB00017226757","spectrum_index":10611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017226759","spectrum_index":10612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 108.0901 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.39,"smiles":null,"spectrum_id":"CCMSLIB00017226762","spectrum_index":10613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 429.1972 Da; putative annotation: N/A; putative formula: C16H27N7O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.268,"smiles":null,"spectrum_id":"CCMSLIB00017226763","spectrum_index":10614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 312.1042 Da; putative annotation: N/A; putative formula: C15H22O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.19,"smiles":null,"spectrum_id":"CCMSLIB00017226765","spectrum_index":10615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 295.1428 Da; putative annotation: N/A; putative formula: C16H25NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.271,"smiles":null,"spectrum_id":"CCMSLIB00017226768","spectrum_index":10616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380958-01!2-[[2-[2-[2-[2-[[2-[2-(2-hydroxypropanoylamino)-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoyl]oxypropanoylamino]-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoic acid (delta mass: 775.4458 Da; putative annotation: N/A; putative formula: C42H61N7O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1534.88,"smiles":null,"spectrum_id":"CCMSLIB00017226770","spectrum_index":10617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384727-01_C48H78O18_ (delta mass: 78.0108 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1021.54,"smiles":null,"spectrum_id":"CCMSLIB00017226773","spectrum_index":10618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 77.0002 Da; putative annotation: N/A; putative formula: C3H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.118,"smiles":null,"spectrum_id":"CCMSLIB00017226774","spectrum_index":10619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 619.5544 Da; putative annotation: N/A; putative formula: C40H77NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":924.802,"smiles":null,"spectrum_id":"CCMSLIB00017226776","spectrum_index":10620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Pro (delta mass: 215.0905 Da; putative annotation: N/A; putative formula: C8H13N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.22,"smiles":null,"spectrum_id":"CCMSLIB00017226779","spectrum_index":10621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4a-Dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 63.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.274,"smiles":null,"spectrum_id":"CCMSLIB00017226781","spectrum_index":10622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ335604 N-Nitrosopiperazine (NPAZ)|1-nitrosopiperazine (delta mass: 10.9943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.076,"smiles":null,"spectrum_id":"CCMSLIB00017226784","spectrum_index":10623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 71.0256 Da; putative annotation: N/A; putative formula: HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.133,"smiles":null,"spectrum_id":"CCMSLIB00017226785","spectrum_index":10624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminobenzoic acid (delta mass: 94.0416 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.097,"smiles":null,"spectrum_id":"CCMSLIB00017226787","spectrum_index":10625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 55.0768 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.168,"smiles":null,"spectrum_id":"CCMSLIB00017226790","spectrum_index":10626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 32.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017226792","spectrum_index":10627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sebacic acid (delta mass: 193.0579 Da; putative annotation: N/A; putative formula: C10H13NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.186,"smiles":null,"spectrum_id":"CCMSLIB00017226796","spectrum_index":10628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 367.3449 Da; putative annotation: N/A; putative formula: C23H45NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.535,"smiles":null,"spectrum_id":"CCMSLIB00017226797","spectrum_index":10629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 325.2625 Da; putative annotation: N/A; putative formula: C20H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.5,"smiles":null,"spectrum_id":"CCMSLIB00017226800","spectrum_index":10630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 168.1509 Da; putative annotation: N/A; putative formula: C11H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.331,"smiles":null,"spectrum_id":"CCMSLIB00017226802","spectrum_index":10631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 373.3188 Da; putative annotation: N/A; putative formula: C21H43NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.573,"smiles":null,"spectrum_id":"CCMSLIB00017226803","spectrum_index":10632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 223.1061 Da; putative annotation: N/A; putative formula: C8H17NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.255,"smiles":null,"spectrum_id":"CCMSLIB00017226806","spectrum_index":10633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 50.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.41,"smiles":null,"spectrum_id":"CCMSLIB00017226808","spectrum_index":10634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 373.1191 Da; putative annotation: N/A; putative formula: C18H20N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.216,"smiles":null,"spectrum_id":"CCMSLIB00017226810","spectrum_index":10635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 108.0942 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017226813","spectrum_index":10636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 151.1131 Da; putative annotation: N/A; putative formula: C8H13N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.35,"smiles":null,"spectrum_id":"CCMSLIB00017226814","spectrum_index":10637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 134.0369 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.118,"smiles":null,"spectrum_id":"CCMSLIB00017226817","spectrum_index":10638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-methyl-2,6,8-trioxa-14-azapentacyclo[11.7.1.0,.0?,?.0?,]henicosa-1(21),3,5(9),10,17,19-hexaen-20-ol (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.134,"smiles":null,"spectrum_id":"CCMSLIB00017226819","spectrum_index":10639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Indolinone (delta mass: 262.1879 Da; putative annotation: N/A; putative formula: C16H26N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.248,"smiles":null,"spectrum_id":"CCMSLIB00017226820","spectrum_index":10640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Piperazinyl)thieno[2,3-d]pyrimidine (delta mass: 27.9904 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017226824","spectrum_index":10641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-hydroxy-5-nitrobenzoate (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.05,"smiles":null,"spectrum_id":"CCMSLIB00017226825","spectrum_index":10642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 19.151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.247,"smiles":null,"spectrum_id":"CCMSLIB00017226829","spectrum_index":10643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 86.0249 Da; putative annotation: N/A; putative formula: C6H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.111,"smiles":null,"spectrum_id":"CCMSLIB00017226830","spectrum_index":10644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 630.4104 Da; putative annotation: N/A; putative formula: C33H54N6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":793.471,"smiles":null,"spectrum_id":"CCMSLIB00017226832","spectrum_index":10645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 130.0525 Da; putative annotation: N/A; putative formula: C8H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.139,"smiles":null,"spectrum_id":"CCMSLIB00017226835","spectrum_index":10646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 98.0735 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017226838","spectrum_index":10647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 764.4109 Da; putative annotation: N/A; putative formula: C40H56N6O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.482,"smiles":null,"spectrum_id":"CCMSLIB00017226840","spectrum_index":10648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 208.1465 Da; putative annotation: N/A; putative formula: C13H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017226844","spectrum_index":10649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 227.0888 Da; putative annotation: N/A; putative formula: C13H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.139,"smiles":null,"spectrum_id":"CCMSLIB00017226845","spectrum_index":10650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 154.0398 Da; putative annotation: N/A; putative formula: C7H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.116,"smiles":null,"spectrum_id":"CCMSLIB00017226847","spectrum_index":10651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 52.0308 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.232,"smiles":null,"spectrum_id":"CCMSLIB00017226850","spectrum_index":10652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-7,12-Dihydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 112.0673 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.274,"smiles":null,"spectrum_id":"CCMSLIB00017226852","spectrum_index":10653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 64.0312 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.112,"smiles":null,"spectrum_id":"CCMSLIB00017226854","spectrum_index":10654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 259.1214 Da; putative annotation: N/A; putative formula: C8H17N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.192,"smiles":null,"spectrum_id":"CCMSLIB00017226857","spectrum_index":10655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Strepin P1 (delta mass: 678.5031 Da; putative annotation: N/A; putative formula: C48H62N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1183.82,"smiles":null,"spectrum_id":"CCMSLIB00017226858","spectrum_index":10656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 972.8279 Da; putative annotation: N/A; putative formula: C52H108N8O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1478.0,"smiles":null,"spectrum_id":"CCMSLIB00017226862","spectrum_index":10657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 534.4046 Da; putative annotation: N/A; putative formula: C32H50N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.631,"smiles":null,"spectrum_id":"CCMSLIB00017226863","spectrum_index":10658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:102040 (delta mass: 239.2225 Da; putative annotation: N/A; putative formula: C11H25N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.491,"smiles":null,"spectrum_id":"CCMSLIB00017226866","spectrum_index":10659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 519.3789 Da; putative annotation: N/A; putative formula: C28H49N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.663,"smiles":null,"spectrum_id":"CCMSLIB00017226868","spectrum_index":10660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 89.157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.222,"smiles":null,"spectrum_id":"CCMSLIB00017226869","spectrum_index":10661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU080703 Azacyclotridecan-2-one (delta mass: 40.9424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017226873","spectrum_index":10662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Isopropyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017226874","spectrum_index":10663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 187.0857 Da; putative annotation: N/A; putative formula: C9H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.146,"smiles":null,"spectrum_id":"CCMSLIB00017226876","spectrum_index":10664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000102 5-hydroxyculmorin|(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol (delta mass: 308.3187 Da; putative annotation: N/A; putative formula: C20H40N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.514,"smiles":null,"spectrum_id":"CCMSLIB00017226879","spectrum_index":10665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 274.2012 Da; putative annotation: N/A; putative formula: C13H22N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.251,"smiles":null,"spectrum_id":"CCMSLIB00017226880","spectrum_index":10666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 563.364 Da; putative annotation: N/A; putative formula: C34H50N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.412,"smiles":null,"spectrum_id":"CCMSLIB00017226881","spectrum_index":10667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 116.1088 Da; putative annotation: N/A; putative formula: C4H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.461,"smiles":null,"spectrum_id":"CCMSLIB00017226884","spectrum_index":10668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 133.0838 Da; putative annotation: N/A; putative formula: C4H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.165,"smiles":null,"spectrum_id":"CCMSLIB00017226886","spectrum_index":10669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 81.0428 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.217,"smiles":null,"spectrum_id":"CCMSLIB00017226888","spectrum_index":10670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 355.2242 Da; putative annotation: N/A; putative formula: C17H25N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.373,"smiles":null,"spectrum_id":"CCMSLIB00017226891","spectrum_index":10671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 340.2361 Da; putative annotation: N/A; putative formula: C18H32N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.343,"smiles":null,"spectrum_id":"CCMSLIB00017226894","spectrum_index":10672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 426.1215 Da; putative annotation: N/A; putative formula: C25H18N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.218,"smiles":null,"spectrum_id":"CCMSLIB00017226895","spectrum_index":10673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 138.0442 Da; putative annotation: N/A; putative formula: C6H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.125,"smiles":null,"spectrum_id":"CCMSLIB00017226898","spectrum_index":10674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 101.0472 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.171,"smiles":null,"spectrum_id":"CCMSLIB00017226900","spectrum_index":10675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 295.2518 Da; putative annotation: N/A; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.51,"smiles":null,"spectrum_id":"CCMSLIB00017226901","spectrum_index":10676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 193.0628 Da; putative annotation: N/A; putative formula: C4H11N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.18,"smiles":null,"spectrum_id":"CCMSLIB00017226904","spectrum_index":10677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11-Methyl-2-dodecenoic acid (delta mass: 74.0733 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.258,"smiles":null,"spectrum_id":"CCMSLIB00017226906","spectrum_index":10678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 128.0442 Da; putative annotation: N/A; putative formula: C2H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.221,"smiles":null,"spectrum_id":"CCMSLIB00017226907","spectrum_index":10679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 70.0386 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017226911","spectrum_index":10680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Orbifomitellic acid (delta mass: 142.0756 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.422,"smiles":null,"spectrum_id":"CCMSLIB00017226912","spectrum_index":10681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,7,8-trimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 104.0473 Da; putative annotation: N/A; putative formula: C4H8O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.154,"smiles":null,"spectrum_id":"CCMSLIB00017226914","spectrum_index":10682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 27.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.092,"smiles":null,"spectrum_id":"CCMSLIB00017226917","spectrum_index":10683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[1-(5-hydroxy-2,6,6-trimethyltetrahydro-2H-pyran-2-yl)ethyl]-2(1H)-quinolinone (delta mass: 18.0114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.197,"smiles":null,"spectrum_id":"CCMSLIB00017226918","spectrum_index":10684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-Lys (delta mass: 129.0416 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.191,"smiles":null,"spectrum_id":"CCMSLIB00017226921","spectrum_index":10685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 90.0541 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.145,"smiles":null,"spectrum_id":"CCMSLIB00017226923","spectrum_index":10686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 18.0602 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.12,"smiles":null,"spectrum_id":"CCMSLIB00017226925","spectrum_index":10687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 55.9838 Da; putative annotation: N/A; putative formula: CN2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.064,"smiles":null,"spectrum_id":"CCMSLIB00017226927","spectrum_index":10688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 317.2903 Da; putative annotation: N/A; putative formula: C14H35N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.522,"smiles":null,"spectrum_id":"CCMSLIB00017226929","spectrum_index":10689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 171.1993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.453,"smiles":null,"spectrum_id":"CCMSLIB00017226931","spectrum_index":10690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 304.2266 Da; putative annotation: N/A; putative formula: C17H28N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.302,"smiles":null,"spectrum_id":"CCMSLIB00017226934","spectrum_index":10691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 311.2209 Da; putative annotation: N/A; putative formula: C16H29N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.376,"smiles":null,"spectrum_id":"CCMSLIB00017226937","spectrum_index":10692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 64.161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.247,"smiles":null,"spectrum_id":"CCMSLIB00017226938","spectrum_index":10693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-isopropylthiophenethylamine (delta mass: 49.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.183,"smiles":null,"spectrum_id":"CCMSLIB00017226940","spectrum_index":10694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homogentisic acid (delta mass: 20.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.091,"smiles":null,"spectrum_id":"CCMSLIB00017226942","spectrum_index":10695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cresotinic acid (delta mass: 9.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.092,"smiles":null,"spectrum_id":"CCMSLIB00017226945","spectrum_index":10696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 66.0473 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.295,"smiles":null,"spectrum_id":"CCMSLIB00017226947","spectrum_index":10697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 443.3295 Da; putative annotation: N/A; putative formula: C22H45N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.614,"smiles":null,"spectrum_id":"CCMSLIB00017226948","spectrum_index":10698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 603.5357 Da; putative annotation: N/A; putative formula: C38H65N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.606,"smiles":null,"spectrum_id":"CCMSLIB00017226952","spectrum_index":10699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-C12:0 (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.264,"smiles":null,"spectrum_id":"CCMSLIB00017226953","spectrum_index":10700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,3-Dimethylbicyclo[2.2.1]hept-2-yl)-1-propanol (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.18,"smiles":null,"spectrum_id":"CCMSLIB00017226955","spectrum_index":10701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-trans-Chrysanthemic acid (delta mass: 211.0694 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.192,"smiles":null,"spectrum_id":"CCMSLIB00017226957","spectrum_index":10702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 48.0356 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.55,"smiles":null,"spectrum_id":"CCMSLIB00017226960","spectrum_index":10703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 106.027 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.071,"smiles":null,"spectrum_id":"CCMSLIB00017226962","spectrum_index":10704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 183.0765 Da; putative annotation: N/A; putative formula: C6H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.147,"smiles":null,"spectrum_id":"CCMSLIB00017226964","spectrum_index":10705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 172.004 Da; putative annotation: N/A; putative formula: C5H5N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.075,"smiles":null,"spectrum_id":"CCMSLIB00017226967","spectrum_index":10706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 69.3933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.5,"smiles":null,"spectrum_id":"CCMSLIB00017226969","spectrum_index":10707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-{3-[(1E)-2-Carboxyeth-1-en-1-yl]phenyl}prop-2-enoic acid (delta mass: 38.0525 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.118,"smiles":null,"spectrum_id":"CCMSLIB00017226972","spectrum_index":10708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 154.1354 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.232,"smiles":null,"spectrum_id":"CCMSLIB00017226974","spectrum_index":10709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[(2,5,5,8a-Tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.3,"smiles":null,"spectrum_id":"CCMSLIB00017226975","spectrum_index":10710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 447.081 Da; putative annotation: N/A; putative formula: C21H21NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.141,"smiles":null,"spectrum_id":"CCMSLIB00017226979","spectrum_index":10711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 19.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.05,"smiles":null,"spectrum_id":"CCMSLIB00017226980","spectrum_index":10712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 186.1789 Da; putative annotation: N/A; putative formula: C15H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.227,"smiles":null,"spectrum_id":"CCMSLIB00017226983","spectrum_index":10713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 156.0092 Da; putative annotation: N/A; putative formula: C5H5N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.147,"smiles":null,"spectrum_id":"CCMSLIB00017226985","spectrum_index":10714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.155,"smiles":null,"spectrum_id":"CCMSLIB00017226989","spectrum_index":10715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-6-Octadecenoic acid (delta mass: 231.2197 Da; putative annotation: N/A; putative formula: C9H25N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.483,"smiles":null,"spectrum_id":"CCMSLIB00017226990","spectrum_index":10716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 35.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017226991","spectrum_index":10717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7,10-Tetraazacyclododecane (delta mass: 143.1056 Da; putative annotation: N/A; putative formula: C6H13N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.282,"smiles":null,"spectrum_id":"CCMSLIB00017226995","spectrum_index":10718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 609.5323 Da; putative annotation: N/A; putative formula: C34H63N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":904.759,"smiles":null,"spectrum_id":"CCMSLIB00017226996","spectrum_index":10719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 373.1516 Da; putative annotation: N/A; putative formula: C14H24N5O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.222,"smiles":null,"spectrum_id":"CCMSLIB00017227000","spectrum_index":10720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of galanthamine (delta mass: 169.1343 Da; putative annotation: N/A; putative formula: C7H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.294,"smiles":null,"spectrum_id":"CCMSLIB00017227001","spectrum_index":10721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 30.0216 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.134,"smiles":null,"spectrum_id":"CCMSLIB00017227002","spectrum_index":10722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 46.0053 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017227006","spectrum_index":10723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 41.063 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017227007","spectrum_index":10724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 168.0668 Da; putative annotation: N/A; putative formula: C5H9N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.169,"smiles":null,"spectrum_id":"CCMSLIB00017227010","spectrum_index":10725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 45.8904 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.961,"smiles":null,"spectrum_id":"CCMSLIB00017227012","spectrum_index":10726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 123.0581 Da; putative annotation: N/A; putative formula: C7H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.134,"smiles":null,"spectrum_id":"CCMSLIB00017227016","spectrum_index":10727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 213.1833 Da; putative annotation: N/A; putative formula: C11H23N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.275,"smiles":null,"spectrum_id":"CCMSLIB00017227017","spectrum_index":10728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 43.0058 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.113,"smiles":null,"spectrum_id":"CCMSLIB00017227018","spectrum_index":10729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 193.0399 Da; putative annotation: N/A; putative formula: C8H8N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.146,"smiles":null,"spectrum_id":"CCMSLIB00017227022","spectrum_index":10730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 172.1094 Da; putative annotation: N/A; putative formula: C9H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.175,"smiles":null,"spectrum_id":"CCMSLIB00017227023","spectrum_index":10731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 136.0889 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.295,"smiles":null,"spectrum_id":"CCMSLIB00017227024","spectrum_index":10732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14(15)-Epoxy-5Z,8Z,11Z,17Z-eicosatetraenoic acid (delta mass: 14.0151 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017227028","spectrum_index":10733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5S-Hydroperoxy-6E,8Z,11Z,14Z,17Z-eicosapentaenoic acid (delta mass: 18.0099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.232,"smiles":null,"spectrum_id":"CCMSLIB00017227029","spectrum_index":10734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 117.0574 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.097,"smiles":null,"spectrum_id":"CCMSLIB00017227030","spectrum_index":10735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 810.4036 Da; putative annotation: N/A; putative formula: C39H50N14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.464,"smiles":null,"spectrum_id":"CCMSLIB00017227034","spectrum_index":10736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocortisol (delta mass: 193.0594 Da; putative annotation: N/A; putative formula: C7H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.307,"smiles":null,"spectrum_id":"CCMSLIB00017227036","spectrum_index":10737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 135.1261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.389,"smiles":null,"spectrum_id":"CCMSLIB00017227039","spectrum_index":10738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 165.0755 Da; putative annotation: N/A; putative formula: C4H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.156,"smiles":null,"spectrum_id":"CCMSLIB00017227042","spectrum_index":10739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 54.0838 Da; putative annotation: N/A; putative formula: C5H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.191,"smiles":null,"spectrum_id":"CCMSLIB00017227044","spectrum_index":10740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CINNAMIC ACID (delta mass: 62.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017227046","spectrum_index":10741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nervobscurine (delta mass: 428.1962 Da; putative annotation: N/A; putative formula: C16H38N4OP2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":811.393,"smiles":null,"spectrum_id":"CCMSLIB00017227049","spectrum_index":10742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 603.5419 Da; putative annotation: N/A; putative formula: C39H73NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":880.758,"smiles":null,"spectrum_id":"CCMSLIB00017227052","spectrum_index":10743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 52.0313 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.316,"smiles":null,"spectrum_id":"CCMSLIB00017227054","spectrum_index":10744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearoyl-L-carnitine (delta mass: 56.0614 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.435,"smiles":null,"spectrum_id":"CCMSLIB00017227055","spectrum_index":10745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 230.0419 Da; putative annotation: N/A; putative formula: C13H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.399,"smiles":null,"spectrum_id":"CCMSLIB00017227059","spectrum_index":10746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 68.0262 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.128,"smiles":null,"spectrum_id":"CCMSLIB00017227060","spectrum_index":10747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 59.0257 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017227061","spectrum_index":10748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 78.083 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.331,"smiles":null,"spectrum_id":"CCMSLIB00017227065","spectrum_index":10749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 797.3173 Da; putative annotation: N/A; putative formula: C44H43N7O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1126.59,"smiles":null,"spectrum_id":"CCMSLIB00017227066","spectrum_index":10750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 110.0367 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.248,"smiles":null,"spectrum_id":"CCMSLIB00017227068","spectrum_index":10751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15(R)-15-Methylprostaglandin D2 (delta mass: 45.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.306,"smiles":null,"spectrum_id":"CCMSLIB00017227071","spectrum_index":10752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-6-Octadecenoic acid (delta mass: 97.967 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.23,"smiles":null,"spectrum_id":"CCMSLIB00017227072","spectrum_index":10753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 456.3088 Da; putative annotation: N/A; putative formula: C25H44O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.346,"smiles":null,"spectrum_id":"CCMSLIB00017227074","spectrum_index":10754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 52.0157 Da; putative annotation: N/A; putative formula: CN4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.232,"smiles":null,"spectrum_id":"CCMSLIB00017227077","spectrum_index":10755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kirenol (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017227078","spectrum_index":10756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.154,"smiles":null,"spectrum_id":"CCMSLIB00017227080","spectrum_index":10757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 101.0152 Da; putative annotation: N/A; putative formula: CH3N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.112,"smiles":null,"spectrum_id":"CCMSLIB00017227083","spectrum_index":10758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 75.0396 Da; putative annotation: N/A; putative formula: CH5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.266,"smiles":null,"spectrum_id":"CCMSLIB00017227085","spectrum_index":10759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 102.0814 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.313,"smiles":null,"spectrum_id":"CCMSLIB00017227088","spectrum_index":10760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 85.9958 Da; putative annotation: N/A; putative formula: C2H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.071,"smiles":null,"spectrum_id":"CCMSLIB00017227089","spectrum_index":10761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 98.0478 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.113,"smiles":null,"spectrum_id":"CCMSLIB00017227091","spectrum_index":10762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvidin C (delta mass: 36.0359 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.231,"smiles":null,"spectrum_id":"CCMSLIB00017227094","spectrum_index":10763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.169,"smiles":null,"spectrum_id":"CCMSLIB00017227095","spectrum_index":10764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 137.9974 Da; putative annotation: N/A; putative formula: C5H3N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.109,"smiles":null,"spectrum_id":"CCMSLIB00017227098","spectrum_index":10765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 62.0516 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.304,"smiles":null,"spectrum_id":"CCMSLIB00017227100","spectrum_index":10766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10-Nonadecenoic acid (delta mass: 72.0357 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.315,"smiles":null,"spectrum_id":"CCMSLIB00017227102","spectrum_index":10767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 599.2168 Da; putative annotation: N/A; putative formula: C35H29N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1104.39,"smiles":null,"spectrum_id":"CCMSLIB00017227104","spectrum_index":10768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 258.1983 Da; putative annotation: N/A; putative formula: C18H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.305,"smiles":null,"spectrum_id":"CCMSLIB00017227106","spectrum_index":10769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 180.0919 Da; putative annotation: N/A; putative formula: C8H13N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.35,"smiles":null,"spectrum_id":"CCMSLIB00017227108","spectrum_index":10770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[2-(furan-3-yl)ethyl]-8-hydroxy-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid (delta mass: 132.0995 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.306,"smiles":null,"spectrum_id":"CCMSLIB00017227111","spectrum_index":10771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 375.128 Da; putative annotation: N/A; putative formula: C14H21N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.199,"smiles":null,"spectrum_id":"CCMSLIB00017227113","spectrum_index":10772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dimyristin (delta mass: 64.067 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.518,"smiles":null,"spectrum_id":"CCMSLIB00017227114","spectrum_index":10773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 250.1779 Da; putative annotation: N/A; putative formula: C9H18N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.227,"smiles":null,"spectrum_id":"CCMSLIB00017227117","spectrum_index":10774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Glutamic acid, dimethyl ester (delta mass: 70.0423 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.134,"smiles":null,"spectrum_id":"CCMSLIB00017227119","spectrum_index":10775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 143.7884 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.922,"smiles":null,"spectrum_id":"CCMSLIB00017227121","spectrum_index":10776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 311.3197 Da; putative annotation: N/A; putative formula: C20H41NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.39,"smiles":null,"spectrum_id":"CCMSLIB00017227124","spectrum_index":10777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 59.0367 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.112,"smiles":null,"spectrum_id":"CCMSLIB00017227126","spectrum_index":10778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ricinoleic acid methyl ester (delta mass: 70.0373 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.311,"smiles":null,"spectrum_id":"CCMSLIB00017227128","spectrum_index":10779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 98.0729 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.206,"smiles":null,"spectrum_id":"CCMSLIB00017227130","spectrum_index":10780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 147.0183 Da; putative annotation: N/A; putative formula: C5HN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.105,"smiles":null,"spectrum_id":"CCMSLIB00017227131","spectrum_index":10781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufalin (delta mass: 116.067 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.32,"smiles":null,"spectrum_id":"CCMSLIB00017227134","spectrum_index":10782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyltryptamine (delta mass: 55.9983 Da; putative annotation: N/A; putative formula: CN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.121,"smiles":null,"spectrum_id":"CCMSLIB00017227136","spectrum_index":10783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 76.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.154,"smiles":null,"spectrum_id":"CCMSLIB00017227138","spectrum_index":10784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 536.1145 Da; putative annotation: N/A; putative formula: C31H25N2OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.185,"smiles":null,"spectrum_id":"CCMSLIB00017227141","spectrum_index":10785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 62.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017227143","spectrum_index":10786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 50.0558 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.335,"smiles":null,"spectrum_id":"CCMSLIB00017227145","spectrum_index":10787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 31.0163 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.118,"smiles":null,"spectrum_id":"CCMSLIB00017227147","spectrum_index":10788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 156.1015 Da; putative annotation: N/A; putative formula: C6H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.156,"smiles":null,"spectrum_id":"CCMSLIB00017227149","spectrum_index":10789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 275.0905 Da; putative annotation: N/A; putative formula: C13H13N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.177,"smiles":null,"spectrum_id":"CCMSLIB00017227152","spectrum_index":10790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 483.3924 Da; putative annotation: N/A; putative formula: C28H53NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.651,"smiles":null,"spectrum_id":"CCMSLIB00017227155","spectrum_index":10791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Met-C14:0 (delta mass: 55.0499 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.307,"smiles":null,"spectrum_id":"CCMSLIB00017227156","spectrum_index":10792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyldanofloxacin (delta mass: 28.0037 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.144,"smiles":null,"spectrum_id":"CCMSLIB00017227160","spectrum_index":10793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 29.0337 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.281,"smiles":null,"spectrum_id":"CCMSLIB00017227161","spectrum_index":10794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 148.0721 Da; putative annotation: N/A; putative formula: C10H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.283,"smiles":null,"spectrum_id":"CCMSLIB00017227163","spectrum_index":10795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 351.2272 Da; putative annotation: N/A; putative formula: C17H29N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.314,"smiles":null,"spectrum_id":"CCMSLIB00017227166","spectrum_index":10796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.alpha.,9.Xi.)-3-Hydroxyolean-12-en-24-oic acid (delta mass: 96.0939 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.461,"smiles":null,"spectrum_id":"CCMSLIB00017227167","spectrum_index":10797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 195.1667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.22,"smiles":null,"spectrum_id":"CCMSLIB00017227171","spectrum_index":10798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 23.0977 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.168,"smiles":null,"spectrum_id":"CCMSLIB00017227172","spectrum_index":10799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine; LC-tDDA; CE10 (delta mass: 269.1522 Da; putative annotation: N/A; putative formula: C16H19N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.249,"smiles":null,"spectrum_id":"CCMSLIB00017227174","spectrum_index":10800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 111.105 Da; putative annotation: N/A; putative formula: C7H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.17,"smiles":null,"spectrum_id":"CCMSLIB00017227177","spectrum_index":10801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 74.037 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017227178","spectrum_index":10802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.alpha.-Mannobiose (delta mass: 247.0113 Da; putative annotation: N/A; putative formula: C7H13N3O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.135,"smiles":null,"spectrum_id":"CCMSLIB00017227181","spectrum_index":10803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 464.2616 Da; putative annotation: N/A; putative formula: C35H32N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.322,"smiles":null,"spectrum_id":"CCMSLIB00017227183","spectrum_index":10804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 17.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.237,"smiles":null,"spectrum_id":"CCMSLIB00017227184","spectrum_index":10805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 35.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.253,"smiles":null,"spectrum_id":"CCMSLIB00017227187","spectrum_index":10806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 693.5572 Da; putative annotation: N/A; putative formula: C40H76N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.654,"smiles":null,"spectrum_id":"CCMSLIB00017227189","spectrum_index":10807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid (delta mass: 103.0096 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.252,"smiles":null,"spectrum_id":"CCMSLIB00017227192","spectrum_index":10808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 492.014 Da; putative annotation: N/A; putative formula: C17H19O11P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.105,"smiles":null,"spectrum_id":"CCMSLIB00017227194","spectrum_index":10809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.28,"smiles":null,"spectrum_id":"CCMSLIB00017227195","spectrum_index":10810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 905.4961 Da; putative annotation: N/A; putative formula: C69H63N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1068.56,"smiles":null,"spectrum_id":"CCMSLIB00017227198","spectrum_index":10811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 91.9719 Da; putative annotation: N/A; putative formula: C5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.048,"smiles":null,"spectrum_id":"CCMSLIB00017227199","spectrum_index":10812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.2,"smiles":null,"spectrum_id":"CCMSLIB00017227201","spectrum_index":10813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 366.2026 Da; putative annotation: N/A; putative formula: C17H30N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.414,"smiles":null,"spectrum_id":"CCMSLIB00017227204","spectrum_index":10814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 160.0358 Da; putative annotation: N/A; putative formula: C3N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.122,"smiles":null,"spectrum_id":"CCMSLIB00017227205","spectrum_index":10815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 376.187 Da; putative annotation: N/A; putative formula: C18H20N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.342,"smiles":null,"spectrum_id":"CCMSLIB00017227209","spectrum_index":10816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 94.0509 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.112,"smiles":null,"spectrum_id":"CCMSLIB00017227210","spectrum_index":10817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 165.1755 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.28,"smiles":null,"spectrum_id":"CCMSLIB00017227211","spectrum_index":10818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,6-Dimethoxy-4-methylphenol CollisionEnergy:102040\"\" (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017227215","spectrum_index":10819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 232.1465 Da; putative annotation: N/A; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.254,"smiles":null,"spectrum_id":"CCMSLIB00017227216","spectrum_index":10820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 865.3251 Da; putative annotation: N/A; putative formula: C40H51N9O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.4,"smiles":null,"spectrum_id":"CCMSLIB00017227217","spectrum_index":10821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terephthalic acid (delta mass: 10.0205 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.054,"smiles":null,"spectrum_id":"CCMSLIB00017227221","spectrum_index":10822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 47.5087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.58,"smiles":null,"spectrum_id":"CCMSLIB00017227222","spectrum_index":10823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxybenzoic acid (delta mass: 117.9967 Da; putative annotation: N/A; putative formula: CH4N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.062,"smiles":null,"spectrum_id":"CCMSLIB00017227225","spectrum_index":10824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 86.0239 Da; putative annotation: N/A; putative formula: CH2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.12,"smiles":null,"spectrum_id":"CCMSLIB00017227227","spectrum_index":10825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 110.0725 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.32,"smiles":null,"spectrum_id":"CCMSLIB00017227229","spectrum_index":10826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dehydroabietic acid (delta mass: 48.0338 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.25,"smiles":null,"spectrum_id":"CCMSLIB00017227232","spectrum_index":10827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 59.0032 Da; putative annotation: N/A; putative formula: H2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.23,"smiles":null,"spectrum_id":"CCMSLIB00017227233","spectrum_index":10828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 15.0219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.124,"smiles":null,"spectrum_id":"CCMSLIB00017227235","spectrum_index":10829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 32.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.073,"smiles":null,"spectrum_id":"CCMSLIB00017227238","spectrum_index":10830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycerol (delta mass: 286.2369 Da; putative annotation: N/A; putative formula: C14H30N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":907.782,"smiles":null,"spectrum_id":"CCMSLIB00017227240","spectrum_index":10831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 101.1297 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.232,"smiles":null,"spectrum_id":"CCMSLIB00017227242","spectrum_index":10832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexamethylene\u00a0bisacetamide (delta mass: 226.1681 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.328,"smiles":null,"spectrum_id":"CCMSLIB00017227245","spectrum_index":10833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 17.9093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.985,"smiles":null,"spectrum_id":"CCMSLIB00017227246","spectrum_index":10834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-HYDANTOIN (delta mass: 72.0323 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.083,"smiles":null,"spectrum_id":"CCMSLIB00017227249","spectrum_index":10835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 82.0808 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.428,"smiles":null,"spectrum_id":"CCMSLIB00017227251","spectrum_index":10836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 35.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.284,"smiles":null,"spectrum_id":"CCMSLIB00017227252","spectrum_index":10837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(R)-Hydroxyprostaglandin E2 (delta mass: 64.0301 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.257,"smiles":null,"spectrum_id":"CCMSLIB00017227255","spectrum_index":10838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alsterpaullone (delta mass: 17.0356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.123,"smiles":null,"spectrum_id":"CCMSLIB00017227259","spectrum_index":10839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Nitroanilino)-2-pyrrolidinone (delta mass: 173.0881 Da; putative annotation: N/A; putative formula: CH7N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.175,"smiles":null,"spectrum_id":"CCMSLIB00017227261","spectrum_index":10840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 49.0533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.405,"smiles":null,"spectrum_id":"CCMSLIB00017227263","spectrum_index":10841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 246.0468 Da; putative annotation: N/A; putative formula: C6H13N6O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.255,"smiles":null,"spectrum_id":"CCMSLIB00017227265","spectrum_index":10842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 47.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.105,"smiles":null,"spectrum_id":"CCMSLIB00017227266","spectrum_index":10843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid CollisionEnergy:205060 (delta mass: 240.9432 Da; putative annotation: N/A; putative formula: C6H-1N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.972,"smiles":null,"spectrum_id":"CCMSLIB00017227269","spectrum_index":10844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 135.0394 Da; putative annotation: N/A; putative formula: CH5N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.115,"smiles":null,"spectrum_id":"CCMSLIB00017227271","spectrum_index":10845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 193.059 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.197,"smiles":null,"spectrum_id":"CCMSLIB00017227273","spectrum_index":10846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methylphenyl)-2,3,4,9-tetrahydro-1H-.beta.-carboline (delta mass: 46.0064 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.161,"smiles":null,"spectrum_id":"CCMSLIB00017227276","spectrum_index":10847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sumaresinolic acid (delta mass: 166.1213 Da; putative annotation: N/A; putative formula: C8H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.484,"smiles":null,"spectrum_id":"CCMSLIB00017227277","spectrum_index":10848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 78.973 Da; putative annotation: N/A; putative formula: HNO2S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.038,"smiles":null,"spectrum_id":"CCMSLIB00017227280","spectrum_index":10849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenyl)-1H-indole-3-carbaldehyde (delta mass: 50.0608 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.113,"smiles":null,"spectrum_id":"CCMSLIB00017227282","spectrum_index":10850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 90.0317 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.102,"smiles":null,"spectrum_id":"CCMSLIB00017227283","spectrum_index":10851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Mercaptobenzoic acid (delta mass: 35.016 Da; putative annotation: N/A; putative formula: C3HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.032,"smiles":null,"spectrum_id":"CCMSLIB00017227287","spectrum_index":10852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 497.1393 Da; putative annotation: N/A; putative formula: C19H23N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.21,"smiles":null,"spectrum_id":"CCMSLIB00017227288","spectrum_index":10853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 41.05 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.152,"smiles":null,"spectrum_id":"CCMSLIB00017227289","spectrum_index":10854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 212.1413 Da; putative annotation: N/A; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.207,"smiles":null,"spectrum_id":"CCMSLIB00017227293","spectrum_index":10855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 127.1359 Da; putative annotation: N/A; putative formula: C8H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.269,"smiles":null,"spectrum_id":"CCMSLIB00017227294","spectrum_index":10856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-palmitoyl-D-erythro-sphinganine (delta mass: 176.0688 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.604,"smiles":null,"spectrum_id":"CCMSLIB00017227295","spectrum_index":10857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 158.0218 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.139,"smiles":null,"spectrum_id":"CCMSLIB00017227299","spectrum_index":10858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 201.0994 Da; putative annotation: N/A; putative formula: C9H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.238,"smiles":null,"spectrum_id":"CCMSLIB00017227300","spectrum_index":10859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 66.0464 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.258,"smiles":null,"spectrum_id":"CCMSLIB00017227301","spectrum_index":10860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 118.0421 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.092,"smiles":null,"spectrum_id":"CCMSLIB00017227304","spectrum_index":10861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 29.0263 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.164,"smiles":null,"spectrum_id":"CCMSLIB00017227306","spectrum_index":10862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.117,"smiles":null,"spectrum_id":"CCMSLIB00017227307","spectrum_index":10863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311155 Vanillic acid (not validated) (delta mass: 40.9232 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.988,"smiles":null,"spectrum_id":"CCMSLIB00017227310","spectrum_index":10864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 76.0159 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.096,"smiles":null,"spectrum_id":"CCMSLIB00017227312","spectrum_index":10865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 76.0697 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.314,"smiles":null,"spectrum_id":"CCMSLIB00017227313","spectrum_index":10866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOIC ACID (delta mass: 18.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.102,"smiles":null,"spectrum_id":"CCMSLIB00017227317","spectrum_index":10867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 120.0244 Da; putative annotation: N/A; putative formula: C4H8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.122,"smiles":null,"spectrum_id":"CCMSLIB00017227318","spectrum_index":10868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 154.0998 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.166,"smiles":null,"spectrum_id":"CCMSLIB00017227319","spectrum_index":10869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 98.0368 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.17,"smiles":null,"spectrum_id":"CCMSLIB00017227323","spectrum_index":10870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 40.0317 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.185,"smiles":null,"spectrum_id":"CCMSLIB00017227324","spectrum_index":10871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 160.085 Da; putative annotation: N/A; putative formula: C6H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.14,"smiles":null,"spectrum_id":"CCMSLIB00017227325","spectrum_index":10872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 297.1212 Da; putative annotation: N/A; putative formula: C14H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.181,"smiles":null,"spectrum_id":"CCMSLIB00017227329","spectrum_index":10873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 437.2911 Da; putative annotation: N/A; putative formula: C21H44NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":933.631,"smiles":null,"spectrum_id":"CCMSLIB00017227330","spectrum_index":10874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 312.1174 Da; putative annotation: N/A; putative formula: C13H21N4OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.177,"smiles":null,"spectrum_id":"CCMSLIB00017227332","spectrum_index":10875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)(3-fluorophenyl)amine (delta mass: 162.0623 Da; putative annotation: N/A; putative formula: C9H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.192,"smiles":null,"spectrum_id":"CCMSLIB00017227335","spectrum_index":10876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 49.0223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.093,"smiles":null,"spectrum_id":"CCMSLIB00017227336","spectrum_index":10877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carbonitrile (delta mass: 18.0112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.072,"smiles":null,"spectrum_id":"CCMSLIB00017227340","spectrum_index":10878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3-(2-Hydroxyethyl)indole from NIST14 (delta mass: 80.1147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.206,"smiles":null,"spectrum_id":"CCMSLIB00017227341","spectrum_index":10879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyphenethyl alcohol (delta mass: 83.0827 Da; putative annotation: N/A; putative formula: C4H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.158,"smiles":null,"spectrum_id":"CCMSLIB00017227343","spectrum_index":10880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid (delta mass: 52.0684 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.321,"smiles":null,"spectrum_id":"CCMSLIB00017227346","spectrum_index":10881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 308.2716 Da; putative annotation: N/A; putative formula: C20H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.498,"smiles":null,"spectrum_id":"CCMSLIB00017227347","spectrum_index":10882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 591.4907 Da; putative annotation: N/A; putative formula: C42H61N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.718,"smiles":null,"spectrum_id":"CCMSLIB00017227350","spectrum_index":10883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxocholesterol (delta mass: 66.045 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.386,"smiles":null,"spectrum_id":"CCMSLIB00017227352","spectrum_index":10884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 38.0524 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.305,"smiles":null,"spectrum_id":"CCMSLIB00017227354","spectrum_index":10885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocorticosterone (delta mass: 394.2374 Da; putative annotation: N/A; putative formula: C23H30N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.49,"smiles":null,"spectrum_id":"CCMSLIB00017227357","spectrum_index":10886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 666.249 Da; putative annotation: N/A; putative formula: C30H43N4O9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":826.382,"smiles":null,"spectrum_id":"CCMSLIB00017227359","spectrum_index":10887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Hydroxybupropion from METLIN (delta mass: 454.0287 Da; putative annotation: N/A; putative formula: C13H18N4O8S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.139,"smiles":null,"spectrum_id":"CCMSLIB00017227361","spectrum_index":10888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 134.0368 Da; putative annotation: 2-Hydroxy-3-methoxybenzaldehyde; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.123,"smiles":null,"spectrum_id":"CCMSLIB00017227364","spectrum_index":10889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 311.0792 Da; putative annotation: Avenanthramide-C methyl ester; putative formula: C17H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.12,"smiles":null,"spectrum_id":"CCMSLIB00017227365","spectrum_index":10890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000069 Salsolinol (delta mass: 162.0709 Da; putative annotation: 4-Hydroxy-3-(2-hydroxyethyl)acetophenone; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.173,"smiles":null,"spectrum_id":"CCMSLIB00017227368","spectrum_index":10891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-hydroxy-4-methoxybenzoate (delta mass: 150.0305 Da; putative annotation: 2,6-Dihydroxy-4-methylbenzoic acid; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.096,"smiles":null,"spectrum_id":"CCMSLIB00017227370","spectrum_index":10892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 164.0467 Da; putative annotation: p-Hydroxyphenyllactic acid; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.143,"smiles":null,"spectrum_id":"CCMSLIB00017227372","spectrum_index":10893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 264.244 Da; putative annotation: Oleic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.502,"smiles":null,"spectrum_id":"CCMSLIB00017227375","spectrum_index":10894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 108.0938 Da; putative annotation: Bicyclo[2.2.1]heptane-2-methanol; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.237,"smiles":null,"spectrum_id":"CCMSLIB00017227376","spectrum_index":10895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 120.0569 Da; putative annotation: Beta-orcinol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.128,"smiles":null,"spectrum_id":"CCMSLIB00017227377","spectrum_index":10896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 297.2657 Da; putative annotation: Massbank:PR310830 Dehydrophytosphingosine (not validated, isomer of 1679); putative formula: C18H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.389,"smiles":null,"spectrum_id":"CCMSLIB00017227381","spectrum_index":10897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 142.099 Da; putative annotation: 3-Hydroxyvalproic acid; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.247,"smiles":null,"spectrum_id":"CCMSLIB00017227382","spectrum_index":10898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 144.0208 Da; putative annotation: 4-hydroxycoumarin; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.149,"smiles":null,"spectrum_id":"CCMSLIB00017227384","spectrum_index":10899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pristanic acid (delta mass: 122.1087 Da; putative annotation: trans,cis-3,6-Nonadien-1-ol; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.403,"smiles":null,"spectrum_id":"CCMSLIB00017227387","spectrum_index":10900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Genipin (delta mass: 172.052 Da; putative annotation: 6-Ethyl-4-hydroxycoumarin; putative formula: C11H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.143,"smiles":null,"spectrum_id":"CCMSLIB00017227388","spectrum_index":10901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-oleoyl-sn-glycerol (delta mass: 305.2701 Da; putative annotation: Linoleoyl ethanolamide; putative formula: C20H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.8,"smiles":null,"spectrum_id":"CCMSLIB00017227391","spectrum_index":10902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyibuprofen (delta mass: 222.1264 Da; putative annotation: 5-[(1E,3E)-Hepta-1,3-dienyl]-2,3-dihydroxycyclopentane-1-carboxylic acid; putative formula: C13H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.259,"smiles":null,"spectrum_id":"CCMSLIB00017227393","spectrum_index":10903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 334.2499 Da; putative annotation: N/A; putative formula: C15H35N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.341,"smiles":null,"spectrum_id":"CCMSLIB00017227396","spectrum_index":10904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitamide (delta mass: 224.25 Da; putative annotation: N/A; putative formula: C16H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.513,"smiles":null,"spectrum_id":"CCMSLIB00017227398","spectrum_index":10905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-hydroxybenzo(a)pyrene (delta mass: 152.1865 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.283,"smiles":null,"spectrum_id":"CCMSLIB00017227399","spectrum_index":10906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyphenylacetic acid (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.086,"smiles":null,"spectrum_id":"CCMSLIB00017227402","spectrum_index":10907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 162.1003 Da; putative annotation: N/A; putative formula: C6H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.203,"smiles":null,"spectrum_id":"CCMSLIB00017227403","spectrum_index":10908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epilupeol (delta mass: 127.0606 Da; putative annotation: N/A; putative formula: C2H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.454,"smiles":null,"spectrum_id":"CCMSLIB00017227405","spectrum_index":10909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 273.2667 Da; putative annotation: N/A; putative formula: C12H31N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.634,"smiles":null,"spectrum_id":"CCMSLIB00017227408","spectrum_index":10910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methoxybenzoic acid (delta mass: 116.0466 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.096,"smiles":null,"spectrum_id":"CCMSLIB00017227409","spectrum_index":10911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017227412","spectrum_index":10912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 227.1159 Da; putative annotation: N/A; putative formula: C11H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.16,"smiles":null,"spectrum_id":"CCMSLIB00017227414","spectrum_index":10913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Adamantanol (delta mass: 45.0216 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.149,"smiles":null,"spectrum_id":"CCMSLIB00017227415","spectrum_index":10914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 72.0209 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017227417","spectrum_index":10915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 201.0933 Da; putative annotation: N/A; putative formula: C8H15N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.195,"smiles":null,"spectrum_id":"CCMSLIB00017227419","spectrum_index":10916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 630.3436 Da; putative annotation: N/A; putative formula: C34H51N2O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.643,"smiles":null,"spectrum_id":"CCMSLIB00017227422","spectrum_index":10917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 165.1736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.421,"smiles":null,"spectrum_id":"CCMSLIB00017227424","spectrum_index":10918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU059904 2,6-Dimethoxybenzoic acid (delta mass: 716.9348 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.0,"smiles":null,"spectrum_id":"CCMSLIB00017227426","spectrum_index":10919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 128.0672 Da; putative annotation: N/A; putative formula: H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.117,"smiles":null,"spectrum_id":"CCMSLIB00017227429","spectrum_index":10920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 38.0518 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.096,"smiles":null,"spectrum_id":"CCMSLIB00017227430","spectrum_index":10921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 946.4652 Da; putative annotation: N/A; putative formula: C47H67N10O7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1207.5,"smiles":null,"spectrum_id":"CCMSLIB00017227433","spectrum_index":10922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.123,"smiles":null,"spectrum_id":"CCMSLIB00017227435","spectrum_index":10923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 231.1837 Da; putative annotation: N/A; putative formula: C12H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.384,"smiles":null,"spectrum_id":"CCMSLIB00017227436","spectrum_index":10924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 108.094 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017227440","spectrum_index":10925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Amino(cyclohexyl)acetic acid ethyl ester (delta mass: 80.0711 Da; putative annotation: N/A; putative formula: C5H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.22,"smiles":null,"spectrum_id":"CCMSLIB00017227441","spectrum_index":10926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 42.0507 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.22,"smiles":null,"spectrum_id":"CCMSLIB00017227442","spectrum_index":10927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 164.0837 Da; putative annotation: N/A; putative formula: C10H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.143,"smiles":null,"spectrum_id":"CCMSLIB00017227445","spectrum_index":10928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 100.0888 Da; putative annotation: N/A; putative formula: C6H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017227447","spectrum_index":10929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperazine (delta mass: 252.2818 Da; putative annotation: N/A; putative formula: C18H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.389,"smiles":null,"spectrum_id":"CCMSLIB00017227448","spectrum_index":10930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 203.0793 Da; putative annotation: N/A; putative formula: C8H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.166,"smiles":null,"spectrum_id":"CCMSLIB00017227451","spectrum_index":10931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 31.9894 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.263,"smiles":null,"spectrum_id":"CCMSLIB00017227452","spectrum_index":10932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.115,"smiles":null,"spectrum_id":"CCMSLIB00017227454","spectrum_index":10933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 27.047 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.102,"smiles":null,"spectrum_id":"CCMSLIB00017227457","spectrum_index":10934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 280.1242 Da; putative annotation: N/A; putative formula: C16H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.31,"smiles":null,"spectrum_id":"CCMSLIB00017227458","spectrum_index":10935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentanedioic acid, 3-(1E)-1-propen-1-yl- (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.076,"smiles":null,"spectrum_id":"CCMSLIB00017227460","spectrum_index":10936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-17-ol-3,20-dione (delta mass: 106.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.315,"smiles":null,"spectrum_id":"CCMSLIB00017227463","spectrum_index":10937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 118.053 Da; putative annotation: N/A; putative formula: C7H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.171,"smiles":null,"spectrum_id":"CCMSLIB00017227464","spectrum_index":10938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 150.1044 Da; putative annotation: N/A; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.18,"smiles":null,"spectrum_id":"CCMSLIB00017227466","spectrum_index":10939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 229.0846 Da; putative annotation: N/A; putative formula: C12H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.155,"smiles":null,"spectrum_id":"CCMSLIB00017227468","spectrum_index":10940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 214.0522 Da; putative annotation: N/A; putative formula: C9H7N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.164,"smiles":null,"spectrum_id":"CCMSLIB00017227470","spectrum_index":10941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 244.0586 Da; putative annotation: N/A; putative formula: C13H13N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.098,"smiles":null,"spectrum_id":"CCMSLIB00017227471","spectrum_index":10942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 38.0523 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.342,"smiles":null,"spectrum_id":"CCMSLIB00017227475","spectrum_index":10943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 53.0366 Da; putative annotation: N/A; putative formula: C2H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.223,"smiles":null,"spectrum_id":"CCMSLIB00017227476","spectrum_index":10944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Azaindole (delta mass: 18.0021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.062,"smiles":null,"spectrum_id":"CCMSLIB00017227478","spectrum_index":10945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 193.0537 Da; putative annotation: N/A; putative formula: C10H11NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.14,"smiles":null,"spectrum_id":"CCMSLIB00017227481","spectrum_index":10946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 393.1429 Da; putative annotation: N/A; putative formula: C20H27NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.203,"smiles":null,"spectrum_id":"CCMSLIB00017227482","spectrum_index":10947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 465.2003 Da; putative annotation: N/A; putative formula: C26H32N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.26,"smiles":null,"spectrum_id":"CCMSLIB00017227485","spectrum_index":10948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,11E,13E)-18-(2,6-Dioxopiperidin-4-yl)-9-hydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11,13-tetraenoic acid (delta mass: 141.0741 Da; putative annotation: N/A; putative formula: C6H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.354,"smiles":null,"spectrum_id":"CCMSLIB00017227487","spectrum_index":10949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 15.0183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.106,"smiles":null,"spectrum_id":"CCMSLIB00017227488","spectrum_index":10950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 750.2842 Da; putative annotation: N/A; putative formula: C48H38N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1052.35,"smiles":null,"spectrum_id":"CCMSLIB00017227492","spectrum_index":10951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 45.0597 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.166,"smiles":null,"spectrum_id":"CCMSLIB00017227493","spectrum_index":10952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tropic acid (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.122,"smiles":null,"spectrum_id":"CCMSLIB00017227494","spectrum_index":10953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 651.6132 Da; putative annotation: N/A; putative formula: C45H81NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":928.829,"smiles":null,"spectrum_id":"CCMSLIB00017227497","spectrum_index":10954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 613.5609 Da; putative annotation: N/A; putative formula: C34H67N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":908.788,"smiles":null,"spectrum_id":"CCMSLIB00017227498","spectrum_index":10955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 149.0459 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.11,"smiles":null,"spectrum_id":"CCMSLIB00017227501","spectrum_index":10956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eicosapentaenoyl ethanolamide (delta mass: 54.0474 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.322,"smiles":null,"spectrum_id":"CCMSLIB00017227503","spectrum_index":10957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-3-pyrrolidin-1-yl-1H-pyrazole-4-carbonitrile (delta mass: 57.0577 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.166,"smiles":null,"spectrum_id":"CCMSLIB00017227505","spectrum_index":10958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 78.0581 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.113,"smiles":null,"spectrum_id":"CCMSLIB00017227508","spectrum_index":10959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 310.0779 Da; putative annotation: N/A; putative formula: C10H22N4O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.119,"smiles":null,"spectrum_id":"CCMSLIB00017227509","spectrum_index":10960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 264.2464 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.328,"smiles":null,"spectrum_id":"CCMSLIB00017227512","spectrum_index":10961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 109.9106 Da; putative annotation: N/A; putative formula: H-2O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.971,"smiles":null,"spectrum_id":"CCMSLIB00017227514","spectrum_index":10962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 146.0939 Da; putative annotation: N/A; putative formula: C7H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.16,"smiles":null,"spectrum_id":"CCMSLIB00017227515","spectrum_index":10963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS000860079-01!L-741,626\"\" (delta mass: 111.0397 Da; putative annotation: N/A; putative formula: HN9O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.181,"smiles":null,"spectrum_id":"CCMSLIB00017227518","spectrum_index":10964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 285.0847 Da; putative annotation: N/A; putative formula: C12H15NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.218,"smiles":null,"spectrum_id":"CCMSLIB00017227519","spectrum_index":10965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 53.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.274,"smiles":null,"spectrum_id":"CCMSLIB00017227522","spectrum_index":10966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10Z,14E)-6,14-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid (delta mass: 42.0101 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.201,"smiles":null,"spectrum_id":"CCMSLIB00017227523","spectrum_index":10967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10Z,14E)-6,14-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid (delta mass: 59.0366 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.227,"smiles":null,"spectrum_id":"CCMSLIB00017227525","spectrum_index":10968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 157.1095 Da; putative annotation: N/A; putative formula: C8H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.238,"smiles":null,"spectrum_id":"CCMSLIB00017227527","spectrum_index":10969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 116.047 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.133,"smiles":null,"spectrum_id":"CCMSLIB00017227529","spectrum_index":10970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperazineethanol (delta mass: 209.1052 Da; putative annotation: N/A; putative formula: C11H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.223,"smiles":null,"spectrum_id":"CCMSLIB00017227532","spectrum_index":10971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 233.1244 Da; putative annotation: N/A; putative formula: C7H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.388,"smiles":null,"spectrum_id":"CCMSLIB00017227533","spectrum_index":10972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 23.0256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.086,"smiles":null,"spectrum_id":"CCMSLIB00017227535","spectrum_index":10973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyltapentadol (delta mass: 18.0097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.179,"smiles":null,"spectrum_id":"CCMSLIB00017227537","spectrum_index":10974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxo-5Z,8Z,10E,14Z-eicosatetraenoic acid (delta mass: 28.0675 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.294,"smiles":null,"spectrum_id":"CCMSLIB00017227539","spectrum_index":10975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Pyrrole-3,4-dicarboxylic acid (delta mass: 177.042 Da; putative annotation: N/A; putative formula: C3H8N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.071,"smiles":null,"spectrum_id":"CCMSLIB00017227541","spectrum_index":10976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lithocholic acid (delta mass: 38.0524 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.357,"smiles":null,"spectrum_id":"CCMSLIB00017227543","spectrum_index":10977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 43.042 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.321,"smiles":null,"spectrum_id":"CCMSLIB00017227544","spectrum_index":10978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 118.0778 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017227548","spectrum_index":10979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 262.0683 Da; putative annotation: N/A; putative formula: C10H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.134,"smiles":null,"spectrum_id":"CCMSLIB00017227549","spectrum_index":10980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 203.1148 Da; putative annotation: N/A; putative formula: C9H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.362,"smiles":null,"spectrum_id":"CCMSLIB00017227551","spectrum_index":10981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 160.1246 Da; putative annotation: N/A; putative formula: C12H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.383,"smiles":null,"spectrum_id":"CCMSLIB00017227554","spectrum_index":10982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 140.1006 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.453,"smiles":null,"spectrum_id":"CCMSLIB00017227556","spectrum_index":10983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 159.1234 Da; putative annotation: N/A; putative formula: C4H13N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.173,"smiles":null,"spectrum_id":"CCMSLIB00017227558","spectrum_index":10984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 113.0844 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.134,"smiles":null,"spectrum_id":"CCMSLIB00017227560","spectrum_index":10985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 376.1428 Da; putative annotation: N/A; putative formula: C14H26N4O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.224,"smiles":null,"spectrum_id":"CCMSLIB00017227562","spectrum_index":10986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Dehydroretinol (delta mass: 419.3218 Da; putative annotation: N/A; putative formula: C18H41N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.543,"smiles":null,"spectrum_id":"CCMSLIB00017227565","spectrum_index":10987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenol (delta mass: 162.0681 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.159,"smiles":null,"spectrum_id":"CCMSLIB00017227567","spectrum_index":10988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 352.2215 Da; putative annotation: N/A; putative formula: C15H32N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.272,"smiles":null,"spectrum_id":"CCMSLIB00017227568","spectrum_index":10989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 72.0663 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017227571","spectrum_index":10990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phthalic acid (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.097,"smiles":null,"spectrum_id":"CCMSLIB00017227573","spectrum_index":10991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 70.0776 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017227576","spectrum_index":10992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 109.0522 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.129,"smiles":null,"spectrum_id":"CCMSLIB00017227578","spectrum_index":10993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Hydroxymethylbicyclo[2.2.1]hept-2-yl)methanol (delta mass: 64.0311 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017227579","spectrum_index":10994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 52.0423 Da; putative annotation: N/A; putative formula: C3H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.092,"smiles":null,"spectrum_id":"CCMSLIB00017227582","spectrum_index":10995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 278.1292 Da; putative annotation: N/A; putative formula: C19H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.288,"smiles":null,"spectrum_id":"CCMSLIB00017227584","spectrum_index":10996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 84.0197 Da; putative annotation: N/A; putative formula: N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.268,"smiles":null,"spectrum_id":"CCMSLIB00017227586","spectrum_index":10997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 72.0343 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.209,"smiles":null,"spectrum_id":"CCMSLIB00017227589","spectrum_index":10998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 103.0601 Da; putative annotation: N/A; putative formula: C3H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.082,"smiles":null,"spectrum_id":"CCMSLIB00017227590","spectrum_index":10999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethcathinone (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017227593","spectrum_index":11000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1153.6446 Da; putative annotation: N/A; putative formula: C58H91N9O13S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1316.7,"smiles":null,"spectrum_id":"CCMSLIB00017227595","spectrum_index":11001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 327.3124 Da; putative annotation: N/A; putative formula: C20H41NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.619,"smiles":null,"spectrum_id":"CCMSLIB00017227597","spectrum_index":11002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 198.1242 Da; putative annotation: N/A; putative formula: C7H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.205,"smiles":null,"spectrum_id":"CCMSLIB00017227600","spectrum_index":11003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 47.9985 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.044,"smiles":null,"spectrum_id":"CCMSLIB00017227601","spectrum_index":11004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 133.0603 Da; putative annotation: N/A; putative formula: C2H7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.12,"smiles":null,"spectrum_id":"CCMSLIB00017227604","spectrum_index":11005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 404.148 Da; putative annotation: N/A; putative formula: C22H28O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.208,"smiles":null,"spectrum_id":"CCMSLIB00017227606","spectrum_index":11006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 194.0792 Da; putative annotation: N/A; putative formula: C7H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.29,"smiles":null,"spectrum_id":"CCMSLIB00017227608","spectrum_index":11007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 286.2139 Da; putative annotation: N/A; putative formula: C16H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.311,"smiles":null,"spectrum_id":"CCMSLIB00017227611","spectrum_index":11008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 8.1206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.216,"smiles":null,"spectrum_id":"CCMSLIB00017227612","spectrum_index":11009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 193.0749 Da; putative annotation: N/A; putative formula: C11H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.172,"smiles":null,"spectrum_id":"CCMSLIB00017227615","spectrum_index":11010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxynaphthalen-2-amine (delta mass: 18.0127 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.104,"smiles":null,"spectrum_id":"CCMSLIB00017227617","spectrum_index":11011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-methyl-2,6,8-trioxa-14-azapentacyclo[11.7.1.0,.0?,?.0?,]henicosa-1(21),3,5(9),10,17,19-hexaen-20-ol (delta mass: 114.0033 Da; putative annotation: N/A; putative formula: C8H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.126,"smiles":null,"spectrum_id":"CCMSLIB00017227618","spectrum_index":11012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3S)-3-Hydroxyleucine (delta mass: 278.2241 Da; putative annotation: N/A; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.321,"smiles":null,"spectrum_id":"CCMSLIB00017227622","spectrum_index":11013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 165.0639 Da; putative annotation: N/A; putative formula: C5H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.327,"smiles":null,"spectrum_id":"CCMSLIB00017227623","spectrum_index":11014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 141.079 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.217,"smiles":null,"spectrum_id":"CCMSLIB00017227624","spectrum_index":11015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 171.1624 Da; putative annotation: N/A; putative formula: C10H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.254,"smiles":null,"spectrum_id":"CCMSLIB00017227628","spectrum_index":11016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 175.1447 Da; putative annotation: N/A; putative formula: C6H17N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.299,"smiles":null,"spectrum_id":"CCMSLIB00017227629","spectrum_index":11017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 141.1154 Da; putative annotation: N/A; putative formula: C8H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.213,"smiles":null,"spectrum_id":"CCMSLIB00017227631","spectrum_index":11018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 71.0736 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017227634","spectrum_index":11019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Sitosterol (delta mass: 503.2741 Da; putative annotation: N/A; putative formula: C35H38NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":918.667,"smiles":null,"spectrum_id":"CCMSLIB00017227635","spectrum_index":11020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 131.0686 Da; putative annotation: N/A; putative formula: C4H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.408,"smiles":null,"spectrum_id":"CCMSLIB00017227637","spectrum_index":11021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.081,"smiles":null,"spectrum_id":"CCMSLIB00017227639","spectrum_index":11022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 130.1205 Da; putative annotation: N/A; putative formula: C5H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.217,"smiles":null,"spectrum_id":"CCMSLIB00017227640","spectrum_index":11023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 67.1804 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.277,"smiles":null,"spectrum_id":"CCMSLIB00017227642","spectrum_index":11024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 73.0534 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.114,"smiles":null,"spectrum_id":"CCMSLIB00017227645","spectrum_index":11025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 678.4618 Da; putative annotation: N/A; putative formula: C42H66N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.548,"smiles":null,"spectrum_id":"CCMSLIB00017227647","spectrum_index":11026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 553.2778 Da; putative annotation: N/A; putative formula: C24H40N7O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1049.62,"smiles":null,"spectrum_id":"CCMSLIB00017227650","spectrum_index":11027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 244.0965 Da; putative annotation: N/A; putative formula: C5H12N10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.22,"smiles":null,"spectrum_id":"CCMSLIB00017227651","spectrum_index":11028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-(3-Hydroxy-2,2,5a-trimethyl-7-methylidenedecahydro-1-benzoxepin-6-yl)ethyl)-2,2,5a,7-tetramethyldecahydro-1-benzoxepine-3,4,6-triol (delta mass: 45.0463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.43,"smiles":null,"spectrum_id":"CCMSLIB00017227653","spectrum_index":11029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 520.3038 Da; putative annotation: N/A; putative formula: C24H41N8O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.375,"smiles":null,"spectrum_id":"CCMSLIB00017227656","spectrum_index":11030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 128.027 Da; putative annotation: N/A; putative formula: C2H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.29,"smiles":null,"spectrum_id":"CCMSLIB00017227658","spectrum_index":11031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 971.8265 Da; putative annotation: N/A; putative formula: C59H109N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1477.0,"smiles":null,"spectrum_id":"CCMSLIB00017227659","spectrum_index":11032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 829.2836 Da; putative annotation: N/A; putative formula: C59H35N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1172.41,"smiles":null,"spectrum_id":"CCMSLIB00017227662","spectrum_index":11033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olaquindox (delta mass: 231.1305 Da; putative annotation: N/A; putative formula: C11H23NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.228,"smiles":null,"spectrum_id":"CCMSLIB00017227664","spectrum_index":11034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 62.0513 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.309,"smiles":null,"spectrum_id":"CCMSLIB00017227665","spectrum_index":11035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Mercaptobenzoic acid (delta mass: 90.049 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.065,"smiles":null,"spectrum_id":"CCMSLIB00017227669","spectrum_index":11036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyphenylalanine (delta mass: 116.0106 Da; putative annotation: N/A; putative formula: C4H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.092,"smiles":null,"spectrum_id":"CCMSLIB00017227670","spectrum_index":11037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017227671","spectrum_index":11038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 42.0101 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.06,"smiles":null,"spectrum_id":"CCMSLIB00017227675","spectrum_index":11039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 167.0943 Da; putative annotation: N/A; putative formula: C9H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.144,"smiles":null,"spectrum_id":"CCMSLIB00017227676","spectrum_index":11040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 728.484 Da; putative annotation: N/A; putative formula: C39H64N6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1005.7,"smiles":null,"spectrum_id":"CCMSLIB00017227679","spectrum_index":11041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 645.5517 Da; putative annotation: N/A; putative formula: C33H71N7O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.768,"smiles":null,"spectrum_id":"CCMSLIB00017227681","spectrum_index":11042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 133.9537 Da; putative annotation: N/A; putative formula: H-2N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.994,"smiles":null,"spectrum_id":"CCMSLIB00017227682","spectrum_index":11043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclovirobuxine D (delta mass: 175.9126 Da; putative annotation: N/A; putative formula: CN4O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.281,"smiles":null,"spectrum_id":"CCMSLIB00017227686","spectrum_index":11044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 178.0205 Da; putative annotation: N/A; putative formula: C16H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.07,"smiles":null,"spectrum_id":"CCMSLIB00017227687","spectrum_index":11045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 114.1402 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.216,"smiles":null,"spectrum_id":"CCMSLIB00017227688","spectrum_index":11046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 348.3083 Da; putative annotation: N/A; putative formula: C22H41N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.379,"smiles":null,"spectrum_id":"CCMSLIB00017227692","spectrum_index":11047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 106.0376 Da; putative annotation: N/A; putative formula: C2H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.176,"smiles":null,"spectrum_id":"CCMSLIB00017227693","spectrum_index":11048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 506.3623 Da; putative annotation: N/A; putative formula: C31H46N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":977.709,"smiles":null,"spectrum_id":"CCMSLIB00017227694","spectrum_index":11049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 123.0086 Da; putative annotation: N/A; putative formula: C2H6NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.293,"smiles":null,"spectrum_id":"CCMSLIB00017227698","spectrum_index":11050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-methyl-2-pyrone (delta mass: 97.977 Da; putative annotation: N/A; putative formula: CH-1N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.016,"smiles":null,"spectrum_id":"CCMSLIB00017227699","spectrum_index":11051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.4]nonane-2,4-dione (delta mass: 17.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017227701","spectrum_index":11052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 70.042 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.123,"smiles":null,"spectrum_id":"CCMSLIB00017227704","spectrum_index":11053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 150.9434 Da; putative annotation: N/A; putative formula: HN5O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.024,"smiles":null,"spectrum_id":"CCMSLIB00017227705","spectrum_index":11054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 528.3758 Da; putative annotation: N/A; putative formula: C40H48)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.561,"smiles":null,"spectrum_id":"CCMSLIB00017227707","spectrum_index":11055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-11.alpha.,16R-dihydroxy-17-cyclobutyl-5Z,13E-dien-1-oic acid (delta mass: 78.0464 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.31,"smiles":null,"spectrum_id":"CCMSLIB00017227710","spectrum_index":11056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 14(15)-EpETE from NIST14 (delta mass: 63.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.296,"smiles":null,"spectrum_id":"CCMSLIB00017227711","spectrum_index":11057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 191.0577 Da; putative annotation: N/A; putative formula: C10H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017227713","spectrum_index":11058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 453.321 Da; putative annotation: N/A; putative formula: C25H47N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.428,"smiles":null,"spectrum_id":"CCMSLIB00017227715","spectrum_index":11059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 95.0566 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.132,"smiles":null,"spectrum_id":"CCMSLIB00017227718","spectrum_index":11060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 87.0684 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017227719","spectrum_index":11061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00865 alpha-Codeimethine (delta mass: 159.0966 Da; putative annotation: N/A; putative formula: C2H9N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.272,"smiles":null,"spectrum_id":"CCMSLIB00017227720","spectrum_index":11062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-methyl-2-aminoindane (delta mass: 99.0359 Da; putative annotation: N/A; putative formula: C3H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.148,"smiles":null,"spectrum_id":"CCMSLIB00017227723","spectrum_index":11063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 111.0319 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.108,"smiles":null,"spectrum_id":"CCMSLIB00017227725","spectrum_index":11064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 25.9455 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.043,"smiles":null,"spectrum_id":"CCMSLIB00017227726","spectrum_index":11065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 24.0753 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.115,"smiles":null,"spectrum_id":"CCMSLIB00017227730","spectrum_index":11066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 115.0634 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017227731","spectrum_index":11067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 447.0704 Da; putative annotation: N/A; putative formula: C22H13N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.162,"smiles":null,"spectrum_id":"CCMSLIB00017227732","spectrum_index":11068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 326.3181 Da; putative annotation: N/A; putative formula: C21H42O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.355,"smiles":null,"spectrum_id":"CCMSLIB00017227735","spectrum_index":11069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 73.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.337,"smiles":null,"spectrum_id":"CCMSLIB00017227737","spectrum_index":11070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 196.0738 Da; putative annotation: N/A; putative formula: C10H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.134,"smiles":null,"spectrum_id":"CCMSLIB00017227738","spectrum_index":11071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 59.0077 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.099,"smiles":null,"spectrum_id":"CCMSLIB00017227741","spectrum_index":11072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 272.1048 Da; putative annotation: N/A; putative formula: C16H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017227743","spectrum_index":11073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 39.9949 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.049,"smiles":null,"spectrum_id":"CCMSLIB00017227744","spectrum_index":11074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.185,"smiles":null,"spectrum_id":"CCMSLIB00017227748","spectrum_index":11075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Misoprostol (free acid) (delta mass: 110.0788 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.342,"smiles":null,"spectrum_id":"CCMSLIB00017227749","spectrum_index":11076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 70.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.123,"smiles":null,"spectrum_id":"CCMSLIB00017227750","spectrum_index":11077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 15.0135 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.073,"smiles":null,"spectrum_id":"CCMSLIB00017227754","spectrum_index":11078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 126.0677 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.258,"smiles":null,"spectrum_id":"CCMSLIB00017227755","spectrum_index":11079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 68.0628 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.232,"smiles":null,"spectrum_id":"CCMSLIB00017227757","spectrum_index":11080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 287.1918 Da; putative annotation: N/A; putative formula: C15H29NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.346,"smiles":null,"spectrum_id":"CCMSLIB00017227760","spectrum_index":11081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 171.0304 Da; putative annotation: N/A; putative formula: C4H6N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.56,"smiles":null,"spectrum_id":"CCMSLIB00017227761","spectrum_index":11082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2,3-dihydrobenzoic acid (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017227763","spectrum_index":11083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 204.2067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.282,"smiles":null,"spectrum_id":"CCMSLIB00017227766","spectrum_index":11084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 56.0266 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.144,"smiles":null,"spectrum_id":"CCMSLIB00017227768","spectrum_index":11085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML01053 Harmine (delta mass: 45.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.17,"smiles":null,"spectrum_id":"CCMSLIB00017227769","spectrum_index":11086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 9.984 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.033,"smiles":null,"spectrum_id":"CCMSLIB00017227773","spectrum_index":11087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.081,"smiles":null,"spectrum_id":"CCMSLIB00017227774","spectrum_index":11088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 138.0757 Da; putative annotation: N/A; putative formula: C3H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.178,"smiles":null,"spectrum_id":"CCMSLIB00017227776","spectrum_index":11089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 272.1528 Da; putative annotation: N/A; putative formula: C16H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.239,"smiles":null,"spectrum_id":"CCMSLIB00017227779","spectrum_index":11090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 210.0376 Da; putative annotation: N/A; putative formula: C10H10O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.118,"smiles":null,"spectrum_id":"CCMSLIB00017227780","spectrum_index":11091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017227783","spectrum_index":11092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 173.1417 Da; putative annotation: N/A; putative formula: C9H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.207,"smiles":null,"spectrum_id":"CCMSLIB00017227785","spectrum_index":11093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of URIDINE-5-MONOPHOSPHATE (delta mass: 226.0596 Da; putative annotation: N/A; putative formula: C11H17O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.103,"smiles":null,"spectrum_id":"CCMSLIB00017227786","spectrum_index":11094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 76.0677 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017227790","spectrum_index":11095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde (delta mass: 119.0232 Da; putative annotation: N/A; putative formula: C4HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.067,"smiles":null,"spectrum_id":"CCMSLIB00017227791","spectrum_index":11096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid CollisionEnergy:102040 (delta mass: 27.0391 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.11,"smiles":null,"spectrum_id":"CCMSLIB00017227792","spectrum_index":11097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 130.1149 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.357,"smiles":null,"spectrum_id":"CCMSLIB00017227796","spectrum_index":11098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 45.0218 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.103,"smiles":null,"spectrum_id":"CCMSLIB00017227797","spectrum_index":11099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 64.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.123,"smiles":null,"spectrum_id":"CCMSLIB00017227798","spectrum_index":11100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 62.0157 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017227802","spectrum_index":11101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 17.8889 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.079,"smiles":null,"spectrum_id":"CCMSLIB00017227803","spectrum_index":11102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 36.0368 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.269,"smiles":null,"spectrum_id":"CCMSLIB00017227805","spectrum_index":11103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 68.0665 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.206,"smiles":null,"spectrum_id":"CCMSLIB00017227808","spectrum_index":11104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 216.2966 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.445,"smiles":null,"spectrum_id":"CCMSLIB00017227809","spectrum_index":11105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-(Benzoylamino)propyl]benzamide (delta mass: 73.0052 Da; putative annotation: N/A; putative formula: C4H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.149,"smiles":null,"spectrum_id":"CCMSLIB00017227812","spectrum_index":11106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 3.3719 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.5,"smiles":null,"spectrum_id":"CCMSLIB00017227814","spectrum_index":11107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 325.137 Da; putative annotation: N/A; putative formula: C10H11N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.254,"smiles":null,"spectrum_id":"CCMSLIB00017227817","spectrum_index":11108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 4.3667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.5,"smiles":null,"spectrum_id":"CCMSLIB00017227819","spectrum_index":11109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 211.0697 Da; putative annotation: N/A; putative formula: C9H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.333,"smiles":null,"spectrum_id":"CCMSLIB00017227821","spectrum_index":11110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 10.9918 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.093,"smiles":null,"spectrum_id":"CCMSLIB00017227823","spectrum_index":11111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017227825","spectrum_index":11112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of aminoadipic-acid-C10:0 (delta mass: 56.063 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017227827","spectrum_index":11113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)- (delta mass: 18.0077 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.077,"smiles":null,"spectrum_id":"CCMSLIB00017227828","spectrum_index":11114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 80.0266 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.092,"smiles":null,"spectrum_id":"CCMSLIB00017227831","spectrum_index":11115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 34.9738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.07,"smiles":null,"spectrum_id":"CCMSLIB00017227833","spectrum_index":11116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 10.0294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":126.1,"smiles":null,"spectrum_id":"CCMSLIB00017227835","spectrum_index":11117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 261.1581 Da; putative annotation: N/A; putative formula: C13H27NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.249,"smiles":null,"spectrum_id":"CCMSLIB00017227838","spectrum_index":11118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.212,"smiles":null,"spectrum_id":"CCMSLIB00017227840","spectrum_index":11119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 9.9753 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.056,"smiles":null,"spectrum_id":"CCMSLIB00017227841","spectrum_index":11120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C5:0 (delta mass: 112.0882 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.232,"smiles":null,"spectrum_id":"CCMSLIB00017227844","spectrum_index":11121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 195.9207 Da; putative annotation: N/A; putative formula: C6N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.96,"smiles":null,"spectrum_id":"CCMSLIB00017227846","spectrum_index":11122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 537.2135 Da; putative annotation: N/A; putative formula: C30H31N7O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.482,"smiles":null,"spectrum_id":"CCMSLIB00017227847","spectrum_index":11123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 419.1619 Da; putative annotation: N/A; putative formula: C19H33NO3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.451,"smiles":null,"spectrum_id":"CCMSLIB00017227851","spectrum_index":11124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 104.0628 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.263,"smiles":null,"spectrum_id":"CCMSLIB00017227852","spectrum_index":11125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Docosenoic acid (delta mass: 79.9569 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.283,"smiles":null,"spectrum_id":"CCMSLIB00017227854","spectrum_index":11126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 129.0787 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.358,"smiles":null,"spectrum_id":"CCMSLIB00017227857","spectrum_index":11127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 86.0153 Da; putative annotation: N/A; putative formula: C7H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.07,"smiles":null,"spectrum_id":"CCMSLIB00017227858","spectrum_index":11128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017227860","spectrum_index":11129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 178.9858 Da; putative annotation: N/A; putative formula: C7HNO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.202,"smiles":null,"spectrum_id":"CCMSLIB00017227863","spectrum_index":11130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 19.0059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.196,"smiles":null,"spectrum_id":"CCMSLIB00017227865","spectrum_index":11131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Butenoic acid, 2-ethyl-, (Z)- (delta mass: 308.2194 Da; putative annotation: N/A; putative formula: C19H34O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.295,"smiles":null,"spectrum_id":"CCMSLIB00017227868","spectrum_index":11132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 93.0791 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017227869","spectrum_index":11133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 73.0534 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.124,"smiles":null,"spectrum_id":"CCMSLIB00017227871","spectrum_index":11134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 69.0592 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.119,"smiles":null,"spectrum_id":"CCMSLIB00017227873","spectrum_index":11135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 28.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.13,"smiles":null,"spectrum_id":"CCMSLIB00017227876","spectrum_index":11136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 281.1593 Da; putative annotation: N/A; putative formula: C10H23N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.23,"smiles":null,"spectrum_id":"CCMSLIB00017227877","spectrum_index":11137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 97.0539 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.109,"smiles":null,"spectrum_id":"CCMSLIB00017227879","spectrum_index":11138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 73.0157 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.087,"smiles":null,"spectrum_id":"CCMSLIB00017227882","spectrum_index":11139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 382.2124 Da; putative annotation: N/A; putative formula: C17H35O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.283,"smiles":null,"spectrum_id":"CCMSLIB00017227884","spectrum_index":11140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Ethyl-2,4-dihydroxy-3-methylbenzaldehyde (delta mass: 227.1881 Da; putative annotation: N/A; putative formula: C13H25NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.274,"smiles":null,"spectrum_id":"CCMSLIB00017227885","spectrum_index":11141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 142.0986 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.205,"smiles":null,"spectrum_id":"CCMSLIB00017227888","spectrum_index":11142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 124.8487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.92,"smiles":null,"spectrum_id":"CCMSLIB00017227890","spectrum_index":11143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 130.0542 Da; putative annotation: N/A; putative formula: C6H11OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.262,"smiles":null,"spectrum_id":"CCMSLIB00017227893","spectrum_index":11144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 114.032 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.285,"smiles":null,"spectrum_id":"CCMSLIB00017227894","spectrum_index":11145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 100.0158 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.076,"smiles":null,"spectrum_id":"CCMSLIB00017227896","spectrum_index":11146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 232.0692 Da; putative annotation: N/A; putative formula: C13H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.171,"smiles":null,"spectrum_id":"CCMSLIB00017227898","spectrum_index":11147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 349.0861 Da; putative annotation: N/A; putative formula: C12H20N3O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.177,"smiles":null,"spectrum_id":"CCMSLIB00017227900","spectrum_index":11148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Genistein 8-C-glucoside (delta mass: 162.0526 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.166,"smiles":null,"spectrum_id":"CCMSLIB00017227903","spectrum_index":11149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 300.2092 Da; putative annotation: N/A; putative formula: C20H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.338,"smiles":null,"spectrum_id":"CCMSLIB00017227904","spectrum_index":11150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 17.8214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.965,"smiles":null,"spectrum_id":"CCMSLIB00017227905","spectrum_index":11151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 322.8881 Da; putative annotation: N/A; putative formula: HN7O6S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.089,"smiles":null,"spectrum_id":"CCMSLIB00017227909","spectrum_index":11152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 113.0478 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.128,"smiles":null,"spectrum_id":"CCMSLIB00017227910","spectrum_index":11153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 9.0004 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.027,"smiles":null,"spectrum_id":"CCMSLIB00017227911","spectrum_index":11154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dexrazoxane (delta mass: 440.1471 Da; putative annotation: N/A; putative formula: C24H24O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.271,"smiles":null,"spectrum_id":"CCMSLIB00017227915","spectrum_index":11155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 132.0579 Da; putative annotation: N/A; putative formula: C2H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.207,"smiles":null,"spectrum_id":"CCMSLIB00017227916","spectrum_index":11156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 103.0344 Da; putative annotation: N/A; putative formula: CH5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.24,"smiles":null,"spectrum_id":"CCMSLIB00017227917","spectrum_index":11157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 61.0238 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.24,"smiles":null,"spectrum_id":"CCMSLIB00017227920","spectrum_index":11158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 318.2565 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.38,"smiles":null,"spectrum_id":"CCMSLIB00017227921","spectrum_index":11159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloropurine riboside (delta mass: 162.0153 Da; putative annotation: N/A; putative formula: C9H8O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.069,"smiles":null,"spectrum_id":"CCMSLIB00017227923","spectrum_index":11160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 331.1997 Da; putative annotation: N/A; putative formula: C16H29NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.26,"smiles":null,"spectrum_id":"CCMSLIB00017227926","spectrum_index":11161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 131.0942 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.227,"smiles":null,"spectrum_id":"CCMSLIB00017227927","spectrum_index":11162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 29.0029 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.1,"smiles":null,"spectrum_id":"CCMSLIB00017227929","spectrum_index":11163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 205.1673 Da; putative annotation: N/A; putative formula: C11H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.206,"smiles":null,"spectrum_id":"CCMSLIB00017227932","spectrum_index":11164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 50.0513 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.289,"smiles":null,"spectrum_id":"CCMSLIB00017227934","spectrum_index":11165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 168.1345 Da; putative annotation: N/A; putative formula: C11H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.33,"smiles":null,"spectrum_id":"CCMSLIB00017227936","spectrum_index":11166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 429.2119 Da; putative annotation: N/A; putative formula: C20H35N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.309,"smiles":null,"spectrum_id":"CCMSLIB00017227937","spectrum_index":11167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 86.0727 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.175,"smiles":null,"spectrum_id":"CCMSLIB00017227939","spectrum_index":11168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 16.9425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.06,"smiles":null,"spectrum_id":"CCMSLIB00017227942","spectrum_index":11169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 138.013 Da; putative annotation: N/A; putative formula: C7H6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.125,"smiles":null,"spectrum_id":"CCMSLIB00017227943","spectrum_index":11170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 355.828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.915,"smiles":null,"spectrum_id":"CCMSLIB00017227945","spectrum_index":11171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S,4aR)-4-(Hydroxymethyl)-3,4a,8,8-tetramethyl-4a,5,6,7,8,8a-hexahydronaphthalen-1(4H)-one (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.179,"smiles":null,"spectrum_id":"CCMSLIB00017227948","spectrum_index":11172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 688.2392 Da; putative annotation: N/A; putative formula: C28H54N2O5P2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":887.326,"smiles":null,"spectrum_id":"CCMSLIB00017227949","spectrum_index":11173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetamide (delta mass: 53.0153 Da; putative annotation: N/A; putative formula: H-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.102,"smiles":null,"spectrum_id":"CCMSLIB00017227953","spectrum_index":11174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(2-methoxybenzyl)ethanamine (delta mass: 130.0104 Da; putative annotation: N/A; putative formula: C5H8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.155,"smiles":null,"spectrum_id":"CCMSLIB00017227954","spectrum_index":11175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 110.0424 Da; putative annotation: N/A; putative formula: C5H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.144,"smiles":null,"spectrum_id":"CCMSLIB00017227955","spectrum_index":11176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 248.1158 Da; putative annotation: N/A; putative formula: C13H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.228,"smiles":null,"spectrum_id":"CCMSLIB00017227958","spectrum_index":11177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-[(Z)-oct-2-enyl]pentanedioic acid (delta mass: 90.0829 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017227960","spectrum_index":11178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 96.9915 Da; putative annotation: N/A; putative formula: C2H-1N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.052,"smiles":null,"spectrum_id":"CCMSLIB00017227961","spectrum_index":11179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of stepharine (delta mass: 28.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.211,"smiles":null,"spectrum_id":"CCMSLIB00017227965","spectrum_index":11180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 446.2855 Da; putative annotation: N/A; putative formula: C27H42O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.356,"smiles":null,"spectrum_id":"CCMSLIB00017227966","spectrum_index":11181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 85.089 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.218,"smiles":null,"spectrum_id":"CCMSLIB00017227968","spectrum_index":11182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-N-{2-[(2-hydroxybenzoyl)amino]ethyl}benzamide (delta mass: 46.0303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.149,"smiles":null,"spectrum_id":"CCMSLIB00017227970","spectrum_index":11183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phlorin (delta mass: 162.0489 Da; putative annotation: N/A; putative formula: C4H11N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.141,"smiles":null,"spectrum_id":"CCMSLIB00017227971","spectrum_index":11184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.3,"smiles":null,"spectrum_id":"CCMSLIB00017227972","spectrum_index":11185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophol (delta mass: 113.0487 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.14,"smiles":null,"spectrum_id":"CCMSLIB00017227976","spectrum_index":11186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-amino-4-methylbenzoate (delta mass: 45.0215 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.108,"smiles":null,"spectrum_id":"CCMSLIB00017227977","spectrum_index":11187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyprostaglandin E2 (delta mass: 38.0135 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.241,"smiles":null,"spectrum_id":"CCMSLIB00017227979","spectrum_index":11188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 84.0569 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.117,"smiles":null,"spectrum_id":"CCMSLIB00017227982","spectrum_index":11189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 390.271 Da; putative annotation: N/A; putative formula: C31H34O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.342,"smiles":null,"spectrum_id":"CCMSLIB00017227983","spectrum_index":11190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 319.2353 Da; putative annotation: N/A; putative formula: C16H33NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.368,"smiles":null,"spectrum_id":"CCMSLIB00017227987","spectrum_index":11191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 304.3123 Da; putative annotation: N/A; putative formula: C22H40)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.424,"smiles":null,"spectrum_id":"CCMSLIB00017227988","spectrum_index":11192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 84.057 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017227990","spectrum_index":11193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 872.0543 Da; putative annotation: N/A; putative formula: C32H32N2O19P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1094.15,"smiles":null,"spectrum_id":"CCMSLIB00017227992","spectrum_index":11194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 70.0796 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.139,"smiles":null,"spectrum_id":"CCMSLIB00017227993","spectrum_index":11195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.179,"smiles":null,"spectrum_id":"CCMSLIB00017227997","spectrum_index":11196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 51.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.16,"smiles":null,"spectrum_id":"CCMSLIB00017227998","spectrum_index":11197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 70.0517 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.279,"smiles":null,"spectrum_id":"CCMSLIB00017228000","spectrum_index":11198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 269.2312 Da; putative annotation: N/A; putative formula: C12H27N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.761,"smiles":null,"spectrum_id":"CCMSLIB00017228002","spectrum_index":11199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 130.0617 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.137,"smiles":null,"spectrum_id":"CCMSLIB00017228003","spectrum_index":11200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid (delta mass: 421.2846 Da; putative annotation: N/A; putative formula: C25H35N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.527,"smiles":null,"spectrum_id":"CCMSLIB00017228007","spectrum_index":11201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 908.243 Da; putative annotation: N/A; putative formula: C50H40N2O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1251.37,"smiles":null,"spectrum_id":"CCMSLIB00017228008","spectrum_index":11202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 104.0287 Da; putative annotation: N/A; putative formula: C4H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.11,"smiles":null,"spectrum_id":"CCMSLIB00017228010","spectrum_index":11203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 986.4996 Da; putative annotation: N/A; putative formula: C52H70N6O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1149.56,"smiles":null,"spectrum_id":"CCMSLIB00017228013","spectrum_index":11204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Hydroxy-7-oxoabiet-8(14)-en-18-oic acid (delta mass: 74.0508 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.272,"smiles":null,"spectrum_id":"CCMSLIB00017228014","spectrum_index":11205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosahexaenoylglycine (delta mass: 197.1439 Da; putative annotation: N/A; putative formula: C10H20N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.413,"smiles":null,"spectrum_id":"CCMSLIB00017228016","spectrum_index":11206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 332.2552 Da; putative annotation: N/A; putative formula: C15H28N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.487,"smiles":null,"spectrum_id":"CCMSLIB00017228019","spectrum_index":11207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Strevertene A (delta mass: 68.0245 Da; putative annotation: N/A; putative formula: N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.357,"smiles":null,"spectrum_id":"CCMSLIB00017228020","spectrum_index":11208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 112.0877 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.163,"smiles":null,"spectrum_id":"CCMSLIB00017228024","spectrum_index":11209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 74.9093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.027,"smiles":null,"spectrum_id":"CCMSLIB00017228025","spectrum_index":11210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 694.3099 Da; putative annotation: N/A; putative formula: C37H46N2O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.427,"smiles":null,"spectrum_id":"CCMSLIB00017228027","spectrum_index":11211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 282.1505 Da; putative annotation: N/A; putative formula: C5H18N10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.268,"smiles":null,"spectrum_id":"CCMSLIB00017228030","spectrum_index":11212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 83.9823 Da; putative annotation: N/A; putative formula: C3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.042,"smiles":null,"spectrum_id":"CCMSLIB00017228032","spectrum_index":11213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine, 6-sulfate (delta mass: 259.0362 Da; putative annotation: N/A; putative formula: C6H13NO8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.08,"smiles":null,"spectrum_id":"CCMSLIB00017228035","spectrum_index":11214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 255.1932 Da; putative annotation: N/A; putative formula: C9H21N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.333,"smiles":null,"spectrum_id":"CCMSLIB00017228037","spectrum_index":11215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 293.1471 Da; putative annotation: N/A; putative formula: C12H23NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.369,"smiles":null,"spectrum_id":"CCMSLIB00017228039","spectrum_index":11216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 510.275 Da; putative annotation: N/A; putative formula: C27H43O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.378,"smiles":null,"spectrum_id":"CCMSLIB00017228042","spectrum_index":11217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylpinosylvic acid (delta mass: 42.0114 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.108,"smiles":null,"spectrum_id":"CCMSLIB00017228044","spectrum_index":11218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 137.0513 Da; putative annotation: N/A; putative formula: C6H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.294,"smiles":null,"spectrum_id":"CCMSLIB00017228045","spectrum_index":11219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.,27-Dihydroxycholesterol (delta mass: 61.9452 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.297,"smiles":null,"spectrum_id":"CCMSLIB00017228049","spectrum_index":11220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Pregnen-3.beta.-ol-20-one (delta mass: 80.0622 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017228050","spectrum_index":11221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 74.0513 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.289,"smiles":null,"spectrum_id":"CCMSLIB00017228052","spectrum_index":11222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 86.0733 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.191,"smiles":null,"spectrum_id":"CCMSLIB00017228055","spectrum_index":11223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 58.0164 Da; putative annotation: N/A; putative formula: CH2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.113,"smiles":null,"spectrum_id":"CCMSLIB00017228056","spectrum_index":11224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 95.0825 Da; putative annotation: N/A; putative formula: C5H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.33,"smiles":null,"spectrum_id":"CCMSLIB00017228058","spectrum_index":11225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 238.1134 Da; putative annotation: N/A; putative formula: C12H18N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.18,"smiles":null,"spectrum_id":"CCMSLIB00017228061","spectrum_index":11226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 229.1451 Da; putative annotation: N/A; putative formula: C10H19N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.295,"smiles":null,"spectrum_id":"CCMSLIB00017228063","spectrum_index":11227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 10.0141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.074,"smiles":null,"spectrum_id":"CCMSLIB00017228066","spectrum_index":11228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Thienyl)-1H-imidazole (delta mass: 26.0221 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.055,"smiles":null,"spectrum_id":"CCMSLIB00017228068","spectrum_index":11229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coniferyl aldehyde (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017228069","spectrum_index":11230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017228072","spectrum_index":11231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Loliolide (delta mass: 46.0027 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.12,"smiles":null,"spectrum_id":"CCMSLIB00017228074","spectrum_index":11232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 252.1729 Da; putative annotation: N/A; putative formula: C15H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.244,"smiles":null,"spectrum_id":"CCMSLIB00017228075","spectrum_index":11233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 116.0839 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.144,"smiles":null,"spectrum_id":"CCMSLIB00017228079","spectrum_index":11234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-arginine (delta mass: 161.0515 Da; putative annotation: N/A; putative formula: C6H11NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.181,"smiles":null,"spectrum_id":"CCMSLIB00017228080","spectrum_index":11235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 133.0409 Da; putative annotation: N/A; putative formula: C3H8N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.101,"smiles":null,"spectrum_id":"CCMSLIB00017228082","spectrum_index":11236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 90.047 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.19,"smiles":null,"spectrum_id":"CCMSLIB00017228085","spectrum_index":11237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 30.0101 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.065,"smiles":null,"spectrum_id":"CCMSLIB00017228086","spectrum_index":11238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 14.9995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017228088","spectrum_index":11239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 572.4821 Da; putative annotation: N/A; putative formula: C38H60N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":891.745,"smiles":null,"spectrum_id":"CCMSLIB00017228091","spectrum_index":11240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 187.1675 Da; putative annotation: N/A; putative formula: C9H21N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.243,"smiles":null,"spectrum_id":"CCMSLIB00017228093","spectrum_index":11241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 112.8637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.946,"smiles":null,"spectrum_id":"CCMSLIB00017228096","spectrum_index":11242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Dihydrotestosterone (delta mass: 118.0807 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.313,"smiles":null,"spectrum_id":"CCMSLIB00017228098","spectrum_index":11243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 84.115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.217,"smiles":null,"spectrum_id":"CCMSLIB00017228099","spectrum_index":11244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 67.0638 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017228102","spectrum_index":11245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 132.1149 Da; putative annotation: N/A; putative formula: C3H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.19,"smiles":null,"spectrum_id":"CCMSLIB00017228104","spectrum_index":11246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 108.0604 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.23,"smiles":null,"spectrum_id":"CCMSLIB00017228106","spectrum_index":11247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 252.2451 Da; putative annotation: N/A; putative formula: C17H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.284,"smiles":null,"spectrum_id":"CCMSLIB00017228108","spectrum_index":11248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 31.0448 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.105,"smiles":null,"spectrum_id":"CCMSLIB00017228109","spectrum_index":11249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 311.2942 Da; putative annotation: N/A; putative formula: C18H37N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":904.57,"smiles":null,"spectrum_id":"CCMSLIB00017228112","spectrum_index":11250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 268.2184 Da; putative annotation: N/A; putative formula: C14H29N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.388,"smiles":null,"spectrum_id":"CCMSLIB00017228114","spectrum_index":11251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 79.0291 Da; putative annotation: N/A; putative formula: C2HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.1,"smiles":null,"spectrum_id":"CCMSLIB00017228117","spectrum_index":11252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 114.0681 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.109,"smiles":null,"spectrum_id":"CCMSLIB00017228119","spectrum_index":11253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 421.3188 Da; putative annotation: N/A; putative formula: C25H43NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.426,"smiles":null,"spectrum_id":"CCMSLIB00017228120","spectrum_index":11254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 152.1817 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.232,"smiles":null,"spectrum_id":"CCMSLIB00017228124","spectrum_index":11255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Carboxybenzeneboronic acid (delta mass: 13.0145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.066,"smiles":null,"spectrum_id":"CCMSLIB00017228125","spectrum_index":11256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 156.7857 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.903,"smiles":null,"spectrum_id":"CCMSLIB00017228127","spectrum_index":11257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 136.0383 Da; putative annotation: N/A; putative formula: C5H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.124,"smiles":null,"spectrum_id":"CCMSLIB00017228130","spectrum_index":11258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 225.1596 Da; putative annotation: N/A; putative formula: C10H19N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.444,"smiles":null,"spectrum_id":"CCMSLIB00017228131","spectrum_index":11259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 88.0686 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.295,"smiles":null,"spectrum_id":"CCMSLIB00017228133","spectrum_index":11260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhistamine (delta mass: 44.0502 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017228135","spectrum_index":11261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclooctatin (delta mass: 88.0683 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017228138","spectrum_index":11262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 62.0514 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.247,"smiles":null,"spectrum_id":"CCMSLIB00017228140","spectrum_index":11263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thymol (delta mass: 120.0414 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.153,"smiles":null,"spectrum_id":"CCMSLIB00017228142","spectrum_index":11264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Aminobenzoic acid (delta mass: 169.075 Da; putative annotation: N/A; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.13,"smiles":null,"spectrum_id":"CCMSLIB00017228145","spectrum_index":11265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4-Hydroxycyclohexanecarboxylic acid (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017228147","spectrum_index":11266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asperlactone (delta mass: 42.0135 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.094,"smiles":null,"spectrum_id":"CCMSLIB00017228148","spectrum_index":11267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 113.0412 Da; putative annotation: N/A; putative formula: C4H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.081,"smiles":null,"spectrum_id":"CCMSLIB00017228151","spectrum_index":11268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 89.0844 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.155,"smiles":null,"spectrum_id":"CCMSLIB00017228153","spectrum_index":11269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 372.3788 Da; putative annotation: N/A; putative formula: C27H48)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.491,"smiles":null,"spectrum_id":"CCMSLIB00017228154","spectrum_index":11270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid (delta mass: 104.0997 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017228158","spectrum_index":11271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-(2-hydroxypropan-2-yl)oxan-3-ol (delta mass: 130.0781 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.456,"smiles":null,"spectrum_id":"CCMSLIB00017228159","spectrum_index":11272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 126.0321 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.108,"smiles":null,"spectrum_id":"CCMSLIB00017228161","spectrum_index":11273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 74.0009 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.056,"smiles":null,"spectrum_id":"CCMSLIB00017228164","spectrum_index":11274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 60.0366 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.206,"smiles":null,"spectrum_id":"CCMSLIB00017228165","spectrum_index":11275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 167.0948 Da; putative annotation: N/A; putative formula: C9H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.176,"smiles":null,"spectrum_id":"CCMSLIB00017228168","spectrum_index":11276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 366.2413 Da; putative annotation: N/A; putative formula: C14H34N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.301,"smiles":null,"spectrum_id":"CCMSLIB00017228170","spectrum_index":11277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 137.0487 Da; putative annotation: N/A; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.119,"smiles":null,"spectrum_id":"CCMSLIB00017228172","spectrum_index":11278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 217.029 Da; putative annotation: N/A; putative formula: C11H8NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.104,"smiles":null,"spectrum_id":"CCMSLIB00017228174","spectrum_index":11279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 108.0565 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.216,"smiles":null,"spectrum_id":"CCMSLIB00017228175","spectrum_index":11280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 146.0574 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.294,"smiles":null,"spectrum_id":"CCMSLIB00017228178","spectrum_index":11281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 323.2837 Da; putative annotation: N/A; putative formula: C20H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.51,"smiles":null,"spectrum_id":"CCMSLIB00017228180","spectrum_index":11282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 112.0681 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.405,"smiles":null,"spectrum_id":"CCMSLIB00017228181","spectrum_index":11283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 15.0728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.264,"smiles":null,"spectrum_id":"CCMSLIB00017228185","spectrum_index":11284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 74.0731 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017228186","spectrum_index":11285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 82.0419 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.149,"smiles":null,"spectrum_id":"CCMSLIB00017228188","spectrum_index":11286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 314.1598 Da; putative annotation: N/A; putative formula: C14H26N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.251,"smiles":null,"spectrum_id":"CCMSLIB00017228191","spectrum_index":11287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 190.0268 Da; putative annotation: N/A; putative formula: C8H5F3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.081,"smiles":null,"spectrum_id":"CCMSLIB00017228193","spectrum_index":11288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacetonitrile (delta mass: 207.0844 Da; putative annotation: N/A; putative formula: C3H5N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.16,"smiles":null,"spectrum_id":"CCMSLIB00017228196","spectrum_index":11289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.159,"smiles":null,"spectrum_id":"CCMSLIB00017228197","spectrum_index":11290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 114.0829 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.346,"smiles":null,"spectrum_id":"CCMSLIB00017228199","spectrum_index":11291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norverapamil (delta mass: 306.1945 Da; putative annotation: N/A; putative formula: C17H26N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.469,"smiles":null,"spectrum_id":"CCMSLIB00017228201","spectrum_index":11292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM876702 Lauryl diethanolamide|N,N-bis(2-hydroxyethyl)dodecanamide (delta mass: 176.032 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.285,"smiles":null,"spectrum_id":"CCMSLIB00017228204","spectrum_index":11293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 261.157 Da; putative annotation: N/A; putative formula: C12H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.3,"smiles":null,"spectrum_id":"CCMSLIB00017228205","spectrum_index":11294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 146.0352 Da; putative annotation: p-Coumaric acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.127,"smiles":null,"spectrum_id":"CCMSLIB00017228208","spectrum_index":11295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 135.0315 Da; putative annotation: 4-Aminosalicylic acid; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.102,"smiles":null,"spectrum_id":"CCMSLIB00017228210","spectrum_index":11296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 288.2094 Da; putative annotation: Oxandrolone; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.42,"smiles":null,"spectrum_id":"CCMSLIB00017228212","spectrum_index":11297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 280.2398 Da; putative annotation: 8-(3-Octyl-2-oxiranyl)octanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.461,"smiles":null,"spectrum_id":"CCMSLIB00017228214","spectrum_index":11298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Linolenoyl ethanolamide (delta mass: 260.2134 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.487,"smiles":null,"spectrum_id":"CCMSLIB00017228215","spectrum_index":11299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 160.0725 Da; putative annotation: 2-[2-(2-Methoxyethoxy)ethoxy]acetic acid; putative formula: C7H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.138,"smiles":null,"spectrum_id":"CCMSLIB00017228218","spectrum_index":11300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,19-Dihydroxyurs-12-ene-23,28-dioic acid (delta mass: 484.3188 Da; putative annotation: 3,19-Dihydroxyurs-12-ene-23,28-dioic acid; putative formula: C30H44O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.656,"smiles":null,"spectrum_id":"CCMSLIB00017228220","spectrum_index":11301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 168.115 Da; putative annotation: Ethyl (1-hydroxycyclohexyl)acetate; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017228221","spectrum_index":11302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(6-Aminohexanamido)hexanoic acid (delta mass: 112.1001 Da; putative annotation: 6-Aminohexanamide; putative formula: C6H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.286,"smiles":null,"spectrum_id":"CCMSLIB00017228225","spectrum_index":11303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 178.0987 Da; putative annotation: 5-(4-Hydroxypentyl)benzene-1,3-diol; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.169,"smiles":null,"spectrum_id":"CCMSLIB00017228226","spectrum_index":11304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 113.0831 Da; putative annotation: L-Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.228,"smiles":null,"spectrum_id":"CCMSLIB00017228227","spectrum_index":11305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 130.0633 Da; putative annotation: 6-Methyltetrahydro-2H-pyran-2,4,5-triol; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.134,"smiles":null,"spectrum_id":"CCMSLIB00017228231","spectrum_index":11306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,9-Dihydroxy-5Z,11Z,14Z-eicosatrienoic acid (delta mass: 80.0634 Da; putative annotation: 1,5-Hexadien-3-ol; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.316,"smiles":null,"spectrum_id":"CCMSLIB00017228232","spectrum_index":11307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 345.2683 Da; putative annotation: Gly-C20:3; putative formula: C22H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.49,"smiles":null,"spectrum_id":"CCMSLIB00017228234","spectrum_index":11308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 161.0689 Da; putative annotation: Glucosamine - 30.0 eV; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.192,"smiles":null,"spectrum_id":"CCMSLIB00017228237","spectrum_index":11309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 312.2334 Da; putative annotation: (Z)-5,8,11-trihydroxyoctadec-9-enoic acid; putative formula: C18H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.46,"smiles":null,"spectrum_id":"CCMSLIB00017228238","spectrum_index":11310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 326.1163 Da; putative annotation: 2'-Hydroxy-2,4,4',5-tetramethoxychalcone; putative formula: C19H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.166,"smiles":null,"spectrum_id":"CCMSLIB00017228241","spectrum_index":11311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 295.246 Da; putative annotation: N-Palmitoylglycine; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.76,"smiles":null,"spectrum_id":"CCMSLIB00017228243","spectrum_index":11312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOIC ACID (delta mass: 137.0473 Da; putative annotation: 5-Isopropyl-3-isoxazolecarboxylic acid; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.102,"smiles":null,"spectrum_id":"CCMSLIB00017228244","spectrum_index":11313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 146.0575 Da; putative annotation: 2-DEOXY-D-GLUCOSE - 20.0 eV; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.181,"smiles":null,"spectrum_id":"CCMSLIB00017228248","spectrum_index":11314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 327.253 Da; putative annotation: Eicosapentaenoyl ethanolamide; putative formula: C22H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.475,"smiles":null,"spectrum_id":"CCMSLIB00017228249","spectrum_index":11315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 160.0372 Da; putative annotation: D-Gluconic acid, .delta.-lactone; putative formula: C6H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.139,"smiles":null,"spectrum_id":"CCMSLIB00017228251","spectrum_index":11316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 84.0575 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.258,"smiles":null,"spectrum_id":"CCMSLIB00017228254","spectrum_index":11317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 305.1619 Da; putative annotation: N/A; putative formula: C11H24N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.237,"smiles":null,"spectrum_id":"CCMSLIB00017228255","spectrum_index":11318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-L-phenylalanine (delta mass: 24.0002 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.076,"smiles":null,"spectrum_id":"CCMSLIB00017228258","spectrum_index":11319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:102040 (delta mass: 39.0108 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.055,"smiles":null,"spectrum_id":"CCMSLIB00017228260","spectrum_index":11320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 299.0666 Da; putative annotation: N/A; putative formula: C14H5N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.253,"smiles":null,"spectrum_id":"CCMSLIB00017228262","spectrum_index":11321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 114.0816 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.439,"smiles":null,"spectrum_id":"CCMSLIB00017228266","spectrum_index":11322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 118.0628 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.112,"smiles":null,"spectrum_id":"CCMSLIB00017228267","spectrum_index":11323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3aS,5S,11bR,E)-12-Ethylidene-1,2,3a,4,5,7-hexahydro-3,5-ethanopyrrolo[2,3-d]carbazole-6-carbaldehyde (delta mass: 81.0482 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.213,"smiles":null,"spectrum_id":"CCMSLIB00017228269","spectrum_index":11324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ329006 Meptazinol|3-(3-ethyl-1-methylazepan-3-yl)phenol (delta mass: 130.0476 Da; putative annotation: N/A; putative formula: C6H12O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.233,"smiles":null,"spectrum_id":"CCMSLIB00017228271","spectrum_index":11325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 14.9996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.102,"smiles":null,"spectrum_id":"CCMSLIB00017228273","spectrum_index":11326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 96.066 Da; putative annotation: N/A; putative formula: C5H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017228276","spectrum_index":11327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 370.2217 Da; putative annotation: N/A; putative formula: C17H30N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.303,"smiles":null,"spectrum_id":"CCMSLIB00017228278","spectrum_index":11328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 161.9377 Da; putative annotation: N/A; putative formula: C3H2N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.046,"smiles":null,"spectrum_id":"CCMSLIB00017228280","spectrum_index":11329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 263.1402 Da; putative annotation: N/A; putative formula: C10H22N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.253,"smiles":null,"spectrum_id":"CCMSLIB00017228282","spectrum_index":11330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam A (delta mass: 92.0435 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.125,"smiles":null,"spectrum_id":"CCMSLIB00017228285","spectrum_index":11331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 240.1825 Da; putative annotation: N/A; putative formula: C13H24N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.237,"smiles":null,"spectrum_id":"CCMSLIB00017228287","spectrum_index":11332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3-(2-Hydroxyethyl)indole from NIST14 (delta mass: 32.0556 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.147,"smiles":null,"spectrum_id":"CCMSLIB00017228289","spectrum_index":11333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid CollisionEnergy:102040 (delta mass: 441.1113 Da; putative annotation: N/A; putative formula: C28H15N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.479,"smiles":null,"spectrum_id":"CCMSLIB00017228292","spectrum_index":11334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 92.0839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.154,"smiles":null,"spectrum_id":"CCMSLIB00017228293","spectrum_index":11335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-tridecylpiperidine (delta mass: 36.9683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.284,"smiles":null,"spectrum_id":"CCMSLIB00017228296","spectrum_index":11336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 104.0983 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.309,"smiles":null,"spectrum_id":"CCMSLIB00017228298","spectrum_index":11337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 90.0832 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017228300","spectrum_index":11338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 82.0269 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.087,"smiles":null,"spectrum_id":"CCMSLIB00017228303","spectrum_index":11339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 32.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.132,"smiles":null,"spectrum_id":"CCMSLIB00017228304","spectrum_index":11340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,11E,13E)-18-(2,6-Dioxopiperidin-4-yl)-9-hydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11,13-tetraenoic acid (delta mass: 140.0971 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.377,"smiles":null,"spectrum_id":"CCMSLIB00017228308","spectrum_index":11341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 27.9845 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.129,"smiles":null,"spectrum_id":"CCMSLIB00017228309","spectrum_index":11342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 60.0216 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.248,"smiles":null,"spectrum_id":"CCMSLIB00017228311","spectrum_index":11343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,13,15-Trihydroxy-5-methyl-4-oxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-3,11-dione (delta mass: 42.0098 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.143,"smiles":null,"spectrum_id":"CCMSLIB00017228314","spectrum_index":11344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-O-((2.alpha.,3.beta.,5.Xi.,9.Xi.,18.Xi.,19.alpha.)-2,3,19-Trihydroxy-28-oxoolean-12-en-28-yl)-.beta.-D-glucopyranose (delta mass: 118.0763 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.487,"smiles":null,"spectrum_id":"CCMSLIB00017228315","spectrum_index":11345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleamide (delta mass: 80.063 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.342,"smiles":null,"spectrum_id":"CCMSLIB00017228317","spectrum_index":11346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 81.0426 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.254,"smiles":null,"spectrum_id":"CCMSLIB00017228320","spectrum_index":11347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 269.1992 Da; putative annotation: N/A; putative formula: C15H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.415,"smiles":null,"spectrum_id":"CCMSLIB00017228321","spectrum_index":11348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-dihydroxy-9,12,13-trimethyl-14-(2-methylpropyl)-2H,5H,6H,7H,8H,13H,13aH,14H,15H,16H,16bH-oxacyclododeca[3,2-e]isoindole-2,16-dione (delta mass: 154.118 Da; putative annotation: N/A; putative formula: C10H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.377,"smiles":null,"spectrum_id":"CCMSLIB00017228325","spectrum_index":11349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrophaseic acid (delta mass: 265.08 Da; putative annotation: N/A; putative formula: C9H15NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.234,"smiles":null,"spectrum_id":"CCMSLIB00017228326","spectrum_index":11350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 128.0954 Da; putative annotation: N/A; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.234,"smiles":null,"spectrum_id":"CCMSLIB00017228327","spectrum_index":11351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 182.0177 Da; putative annotation: N/A; putative formula: C5H13OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.088,"smiles":null,"spectrum_id":"CCMSLIB00017228330","spectrum_index":11352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 310.2144 Da; putative annotation: N/A; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.301,"smiles":null,"spectrum_id":"CCMSLIB00017228331","spectrum_index":11353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 420.2125 Da; putative annotation: N/A; putative formula: C20H40N2O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.382,"smiles":null,"spectrum_id":"CCMSLIB00017228333","spectrum_index":11354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 144.0426 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.41,"smiles":null,"spectrum_id":"CCMSLIB00017228336","spectrum_index":11355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 109.0383 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.254,"smiles":null,"spectrum_id":"CCMSLIB00017228337","spectrum_index":11356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 56.0987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.32,"smiles":null,"spectrum_id":"CCMSLIB00017228341","spectrum_index":11357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 89.8792 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.939,"smiles":null,"spectrum_id":"CCMSLIB00017228342","spectrum_index":11358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 412.3029 Da; putative annotation: N/A; putative formula: C25H40N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.394,"smiles":null,"spectrum_id":"CCMSLIB00017228343","spectrum_index":11359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 9.868 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.917,"smiles":null,"spectrum_id":"CCMSLIB00017228346","spectrum_index":11360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 164.1203 Da; putative annotation: N/A; putative formula: C11H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.222,"smiles":null,"spectrum_id":"CCMSLIB00017228348","spectrum_index":11361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 196.0737 Da; putative annotation: N/A; putative formula: C10H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.16,"smiles":null,"spectrum_id":"CCMSLIB00017228349","spectrum_index":11362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenecarboxylic acid, 1,2,4a,5,6,7,8,8a-octahydro-2-(2-hydroxybutyl)-1,3-dimethyl-, [1R-[1.alpha.,2.beta.(R*),4a.alpha.,8a.alpha.]]- (delta mass: 88.0686 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.28,"smiles":null,"spectrum_id":"CCMSLIB00017228353","spectrum_index":11363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3,4-dimethoxybenzoic acid (delta mass: 197.1048 Da; putative annotation: N/A; putative formula: C10H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.165,"smiles":null,"spectrum_id":"CCMSLIB00017228354","spectrum_index":11364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-methoxybenzenemethanol (delta mass: 24.0001 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.07,"smiles":null,"spectrum_id":"CCMSLIB00017228355","spectrum_index":11365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 29.0148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017228359","spectrum_index":11366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corytuberine (delta mass: 120.1877 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.342,"smiles":null,"spectrum_id":"CCMSLIB00017228360","spectrum_index":11367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 127.0995 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.223,"smiles":null,"spectrum_id":"CCMSLIB00017228362","spectrum_index":11368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Oxohexanoic acid (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017228365","spectrum_index":11369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,3-Difluoroazetidin-1-yl)piperidine (delta mass: 17.8802 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017228366","spectrum_index":11370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 512.2271 Da; putative annotation: N/A; putative formula: C26H32N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.292,"smiles":null,"spectrum_id":"CCMSLIB00017228369","spectrum_index":11371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 274.132 Da; putative annotation: N/A; putative formula: C15H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.27,"smiles":null,"spectrum_id":"CCMSLIB00017228371","spectrum_index":11372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 268.0887 Da; putative annotation: N/A; putative formula: C20H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.16,"smiles":null,"spectrum_id":"CCMSLIB00017228373","spectrum_index":11373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 117.8987 Da; putative annotation: N/A; putative formula: C2H-2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.97,"smiles":null,"spectrum_id":"CCMSLIB00017228376","spectrum_index":11374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 318.2559 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.483,"smiles":null,"spectrum_id":"CCMSLIB00017228377","spectrum_index":11375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Hydroxy-4Z,7Z,10Z,14E,16Z,19Z-docosahexaenoic acid (delta mass: 35.0364 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.279,"smiles":null,"spectrum_id":"CCMSLIB00017228379","spectrum_index":11376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosahexaenoylglycine (delta mass: 98.0495 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.319,"smiles":null,"spectrum_id":"CCMSLIB00017228382","spectrum_index":11377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 18.0069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.12,"smiles":null,"spectrum_id":"CCMSLIB00017228384","spectrum_index":11378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 268.2041 Da; putative annotation: N/A; putative formula: C16H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.484,"smiles":null,"spectrum_id":"CCMSLIB00017228386","spectrum_index":11379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 90.0299 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.069,"smiles":null,"spectrum_id":"CCMSLIB00017228389","spectrum_index":11380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 15.0107 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.098,"smiles":null,"spectrum_id":"CCMSLIB00017228390","spectrum_index":11381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 170.1545 Da; putative annotation: N/A; putative formula: C8H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.35,"smiles":null,"spectrum_id":"CCMSLIB00017228393","spectrum_index":11382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin C (delta mass: 24.0361 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.216,"smiles":null,"spectrum_id":"CCMSLIB00017228395","spectrum_index":11383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 454.3544 Da; putative annotation: N/A; putative formula: C30H46O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.395,"smiles":null,"spectrum_id":"CCMSLIB00017228397","spectrum_index":11384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethanolamine (delta mass: 280.2405 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.327,"smiles":null,"spectrum_id":"CCMSLIB00017228400","spectrum_index":11385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 251.0791 Da; putative annotation: N/A; putative formula: C12H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.212,"smiles":null,"spectrum_id":"CCMSLIB00017228402","spectrum_index":11386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 561.4385 Da; putative annotation: N/A; putative formula: C31H51N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":742.509,"smiles":null,"spectrum_id":"CCMSLIB00017228403","spectrum_index":11387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Syringaresinol (delta mass: 225.121 Da; putative annotation: N/A; putative formula: C12H21NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.291,"smiles":null,"spectrum_id":"CCMSLIB00017228406","spectrum_index":11388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 274.1892 Da; putative annotation: N/A; putative formula: C13H26N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.276,"smiles":null,"spectrum_id":"CCMSLIB00017228408","spectrum_index":11389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 161.5739 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.634,"smiles":null,"spectrum_id":"CCMSLIB00017228409","spectrum_index":11390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 81.0428 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.108,"smiles":null,"spectrum_id":"CCMSLIB00017228413","spectrum_index":11391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Hydroxyphenyllactic acid (delta mass: 91.0422 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.107,"smiles":null,"spectrum_id":"CCMSLIB00017228414","spectrum_index":11392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 64.0163 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.284,"smiles":null,"spectrum_id":"CCMSLIB00017228415","spectrum_index":11393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 151.0845 Da; putative annotation: N/A; putative formula: H10N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.254,"smiles":null,"spectrum_id":"CCMSLIB00017228418","spectrum_index":11394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 423.1891 Da; putative annotation: N/A; putative formula: C21H29NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.354,"smiles":null,"spectrum_id":"CCMSLIB00017228419","spectrum_index":11395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 298.2048 Da; putative annotation: N/A; putative formula: C19H26N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.27,"smiles":null,"spectrum_id":"CCMSLIB00017228421","spectrum_index":11396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lithocholic acid (delta mass: 78.0838 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.389,"smiles":null,"spectrum_id":"CCMSLIB00017228424","spectrum_index":11397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylcyclohexanol (delta mass: 69.9303 Da; putative annotation: N/A; putative formula: C2H-2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.058,"smiles":null,"spectrum_id":"CCMSLIB00017228425","spectrum_index":11398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017228428","spectrum_index":11399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 59.0366 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017228430","spectrum_index":11400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 645.2574 Da; putative annotation: N/A; putative formula: C36H39NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.396,"smiles":null,"spectrum_id":"CCMSLIB00017228431","spectrum_index":11401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 434.1414 Da; putative annotation: N/A; putative formula: C23H22N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.212,"smiles":null,"spectrum_id":"CCMSLIB00017228435","spectrum_index":11402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.-ol-17-one (delta mass: 102.9574 Da; putative annotation: N/A; putative formula: C2HNS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.174,"smiles":null,"spectrum_id":"CCMSLIB00017228436","spectrum_index":11403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Amphetamine (delta mass: 90.0536 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.166,"smiles":null,"spectrum_id":"CCMSLIB00017228437","spectrum_index":11404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 104.0112 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.123,"smiles":null,"spectrum_id":"CCMSLIB00017228441","spectrum_index":11405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-((E)-2-((1R,2S,3R,5S)-3,5-Dihydroxy-2-((Z)-oct-2-enyl)cyclopentyl)vinyl)tetrahydro-2H-pyran-2-one (delta mass: 31.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.28,"smiles":null,"spectrum_id":"CCMSLIB00017228442","spectrum_index":11406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 163.0311 Da; putative annotation: N/A; putative formula: C5H11NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.133,"smiles":null,"spectrum_id":"CCMSLIB00017228444","spectrum_index":11407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 311.2473 Da; putative annotation: N/A; putative formula: C19H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.505,"smiles":null,"spectrum_id":"CCMSLIB00017228447","spectrum_index":11408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mangiferin (delta mass: 152.0102 Da; putative annotation: N/A; putative formula: CH5N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.102,"smiles":null,"spectrum_id":"CCMSLIB00017228448","spectrum_index":11409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; CorrDec (delta mass: 109.0529 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.113,"smiles":null,"spectrum_id":"CCMSLIB00017228451","spectrum_index":11410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 199.0125 Da; putative annotation: N/A; putative formula: C8H9NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.073,"smiles":null,"spectrum_id":"CCMSLIB00017228453","spectrum_index":11411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 46.0089 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.137,"smiles":null,"spectrum_id":"CCMSLIB00017228454","spectrum_index":11412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 118.0777 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017228457","spectrum_index":11413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 259.1529 Da; putative annotation: N/A; putative formula: C11H21N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.228,"smiles":null,"spectrum_id":"CCMSLIB00017228458","spectrum_index":11414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 72.0351 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.22,"smiles":null,"spectrum_id":"CCMSLIB00017228460","spectrum_index":11415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 64.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.118,"smiles":null,"spectrum_id":"CCMSLIB00017228463","spectrum_index":11416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-3-piperidinamine (delta mass: 71.0371 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.155,"smiles":null,"spectrum_id":"CCMSLIB00017228464","spectrum_index":11417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 110.5298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.601,"smiles":null,"spectrum_id":"CCMSLIB00017228468","spectrum_index":11418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 289.1887 Da; putative annotation: N/A; putative formula: C14H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.259,"smiles":null,"spectrum_id":"CCMSLIB00017228469","spectrum_index":11419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 687.5655 Da; putative annotation: N/A; putative formula: C39H77NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":964.782,"smiles":null,"spectrum_id":"CCMSLIB00017228472","spectrum_index":11420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 112.0265 Da; putative annotation: N/A; putative formula: C4H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.102,"smiles":null,"spectrum_id":"CCMSLIB00017228474","spectrum_index":11421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 74.0517 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.3,"smiles":null,"spectrum_id":"CCMSLIB00017228476","spectrum_index":11422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 102.0106 Da; putative annotation: N/A; putative formula: C7H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.216,"smiles":null,"spectrum_id":"CCMSLIB00017228479","spectrum_index":11423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetic acid methyl ester (delta mass: 63.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.432,"smiles":null,"spectrum_id":"CCMSLIB00017228481","spectrum_index":11424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 100.0681 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.42,"smiles":null,"spectrum_id":"CCMSLIB00017228483","spectrum_index":11425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 50.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.076,"smiles":null,"spectrum_id":"CCMSLIB00017228486","spectrum_index":11426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 162.0311 Da; putative annotation: N/A; putative formula: C3H7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.289,"smiles":null,"spectrum_id":"CCMSLIB00017228487","spectrum_index":11427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 122.1103 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017228489","spectrum_index":11428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 44.024 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.079,"smiles":null,"spectrum_id":"CCMSLIB00017228491","spectrum_index":11429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Indolinone (delta mass: 60.0215 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017228493","spectrum_index":11430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 338.2255 Da; putative annotation: N/A; putative formula: C16H30N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.306,"smiles":null,"spectrum_id":"CCMSLIB00017228496","spectrum_index":11431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 219.1827 Da; putative annotation: N/A; putative formula: C12H21N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.243,"smiles":null,"spectrum_id":"CCMSLIB00017228497","spectrum_index":11432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GallicAcid (delta mass: 134.0362 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.065,"smiles":null,"spectrum_id":"CCMSLIB00017228499","spectrum_index":11433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 573.4899 Da; putative annotation: N/A; putative formula: C40H63NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.561,"smiles":null,"spectrum_id":"CCMSLIB00017228501","spectrum_index":11434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl 2-(aminomethyl)phenylcarbamate (delta mass: 44.0301 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.174,"smiles":null,"spectrum_id":"CCMSLIB00017228503","spectrum_index":11435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethyl-4-hydroxybenzaldehyde (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.112,"smiles":null,"spectrum_id":"CCMSLIB00017228506","spectrum_index":11436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl-4-fluoroindole-2-carboxylate (delta mass: 46.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.114,"smiles":null,"spectrum_id":"CCMSLIB00017228508","spectrum_index":11437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 216.1003 Da; putative annotation: N/A; putative formula: C11H20S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.38,"smiles":null,"spectrum_id":"CCMSLIB00017228511","spectrum_index":11438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 308.2605 Da; putative annotation: N/A; putative formula: C22H32N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.477,"smiles":null,"spectrum_id":"CCMSLIB00017228513","spectrum_index":11439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hexadecanoyl-L-homoserine lactone (delta mass: 101.0483 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.333,"smiles":null,"spectrum_id":"CCMSLIB00017228515","spectrum_index":11440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 182.0888 Da; putative annotation: N/A; putative formula: C2H6N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.201,"smiles":null,"spectrum_id":"CCMSLIB00017228518","spectrum_index":11441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 408.1103 Da; putative annotation: N/A; putative formula: C16H26O8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.207,"smiles":null,"spectrum_id":"CCMSLIB00017228519","spectrum_index":11442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-homoserine CollisionEnergy:102040 (delta mass: 28.0345 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.1,"smiles":null,"spectrum_id":"CCMSLIB00017228521","spectrum_index":11443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Ferulic acid; [M+H-H2O]+ (delta mass: 197.0688 Da; putative annotation: N/A; putative formula: C9H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.134,"smiles":null,"spectrum_id":"CCMSLIB00017228523","spectrum_index":11444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 195.0628 Da; putative annotation: N/A; putative formula: C10H14NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.14,"smiles":null,"spectrum_id":"CCMSLIB00017228525","spectrum_index":11445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cedrol (delta mass: 92.0483 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.254,"smiles":null,"spectrum_id":"CCMSLIB00017228528","spectrum_index":11446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 135.0528 Da; putative annotation: N/A; putative formula: C4H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.092,"smiles":null,"spectrum_id":"CCMSLIB00017228530","spectrum_index":11447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 250.0831 Da; putative annotation: N/A; putative formula: C7H15N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.232,"smiles":null,"spectrum_id":"CCMSLIB00017228531","spectrum_index":11448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 121.938 Da; putative annotation: N/A; putative formula: C4H-2N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.977,"smiles":null,"spectrum_id":"CCMSLIB00017228533","spectrum_index":11449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 176.032 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.301,"smiles":null,"spectrum_id":"CCMSLIB00017228535","spectrum_index":11450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,19-Dihydroxy-3-oxo-12-ursen-28-oic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.352,"smiles":null,"spectrum_id":"CCMSLIB00017228538","spectrum_index":11451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 194.0773 Da; putative annotation: N/A; putative formula: C4H14N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.179,"smiles":null,"spectrum_id":"CCMSLIB00017228540","spectrum_index":11452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 73.9638 Da; putative annotation: N/A; putative formula: CH-2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.211,"smiles":null,"spectrum_id":"CCMSLIB00017228541","spectrum_index":11453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 273.1688 Da; putative annotation: N/A; putative formula: C12H23N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.245,"smiles":null,"spectrum_id":"CCMSLIB00017228545","spectrum_index":11454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 383.2514 Da; putative annotation: N/A; putative formula: C22H33N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.4,"smiles":null,"spectrum_id":"CCMSLIB00017228546","spectrum_index":11455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Diphenyl-1H-indole-7-carboxylic acid (delta mass: 43.9873 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.105,"smiles":null,"spectrum_id":"CCMSLIB00017228548","spectrum_index":11456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 149.0691 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.155,"smiles":null,"spectrum_id":"CCMSLIB00017228551","spectrum_index":11457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 26.95 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.046,"smiles":null,"spectrum_id":"CCMSLIB00017228553","spectrum_index":11458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 64.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.111,"smiles":null,"spectrum_id":"CCMSLIB00017228556","spectrum_index":11459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Myrtenol (delta mass: 42.0097 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.137,"smiles":null,"spectrum_id":"CCMSLIB00017228558","spectrum_index":11460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 41.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.091,"smiles":null,"spectrum_id":"CCMSLIB00017228559","spectrum_index":11461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU100601 Sulfaclozine|4-amino-N-(6-chloropyrazin-2-yl)benzenesulfonamide (delta mass: 287.0116 Da; putative annotation: N/A; putative formula: C11H5N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.032,"smiles":null,"spectrum_id":"CCMSLIB00017228563","spectrum_index":11462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 57.0559 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.163,"smiles":null,"spectrum_id":"CCMSLIB00017228564","spectrum_index":11463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 418.1563 Da; putative annotation: N/A; putative formula: C21H26N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.232,"smiles":null,"spectrum_id":"CCMSLIB00017228567","spectrum_index":11464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 100.0539 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.301,"smiles":null,"spectrum_id":"CCMSLIB00017228569","spectrum_index":11465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Benzyloxy)-1H-indole (delta mass: 15.9906 Da; putative annotation: N/A; putative formula: HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.098,"smiles":null,"spectrum_id":"CCMSLIB00017228571","spectrum_index":11466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 95.0581 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.274,"smiles":null,"spectrum_id":"CCMSLIB00017228574","spectrum_index":11467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 579.326 Da; putative annotation: N/A; putative formula: C33H41N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":856.542,"smiles":null,"spectrum_id":"CCMSLIB00017228575","spectrum_index":11468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 450.2618 Da; putative annotation: N/A; putative formula: C25H38O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":743.473,"smiles":null,"spectrum_id":"CCMSLIB00017228577","spectrum_index":11469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 36.0356 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.262,"smiles":null,"spectrum_id":"CCMSLIB00017228579","spectrum_index":11470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-9H-pyrido[2,3-b]indole (AalphaC) (delta mass: 45.031 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017228581","spectrum_index":11471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 690.4599 Da; putative annotation: N/A; putative formula: C44H67O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.541,"smiles":null,"spectrum_id":"CCMSLIB00017228583","spectrum_index":11472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 36.0215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.259,"smiles":null,"spectrum_id":"CCMSLIB00017228586","spectrum_index":11473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 393.2874 Da; putative annotation: N/A; putative formula: C23H39NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.509,"smiles":null,"spectrum_id":"CCMSLIB00017228587","spectrum_index":11474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 78.0465 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.127,"smiles":null,"spectrum_id":"CCMSLIB00017228589","spectrum_index":11475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethylbenzoic acid (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017228592","spectrum_index":11476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-oxoheptadecanedioic acid CollisionEnergy:102040 (delta mass: 17.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.243,"smiles":null,"spectrum_id":"CCMSLIB00017228594","spectrum_index":11477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 150.104 Da; putative annotation: N/A; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.222,"smiles":null,"spectrum_id":"CCMSLIB00017228596","spectrum_index":11478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 54.047 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.206,"smiles":null,"spectrum_id":"CCMSLIB00017228598","spectrum_index":11479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100394 5,6-Dihydrouracil|Hydrouracil|5,6-Dihydro-2,4-dihydroxypyrimidine|2,4-Dioxotetrahydropyrimidine (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.081,"smiles":null,"spectrum_id":"CCMSLIB00017228599","spectrum_index":11480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 70.0786 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017228602","spectrum_index":11481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 4.1939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.248,"smiles":null,"spectrum_id":"CCMSLIB00017228604","spectrum_index":11482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 15.9947 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017228606","spectrum_index":11483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 85.0375 Da; putative annotation: N/A; putative formula: CH3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017228609","spectrum_index":11484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 128.0952 Da; putative annotation: N/A; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.134,"smiles":null,"spectrum_id":"CCMSLIB00017228610","spectrum_index":11485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 294.0956 Da; putative annotation: N/A; putative formula: C14H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.135,"smiles":null,"spectrum_id":"CCMSLIB00017228612","spectrum_index":11486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 176.0318 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.118,"smiles":null,"spectrum_id":"CCMSLIB00017228615","spectrum_index":11487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(1H-Indol-3-yl)ethyl]propanamide (delta mass: 315.214 Da; putative annotation: N/A; putative formula: C19H29N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.347,"smiles":null,"spectrum_id":"CCMSLIB00017228616","spectrum_index":11488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 72.0578 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.207,"smiles":null,"spectrum_id":"CCMSLIB00017228618","spectrum_index":11489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 442.1049 Da; putative annotation: N/A; putative formula: C13H19N10O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.186,"smiles":null,"spectrum_id":"CCMSLIB00017228621","spectrum_index":11490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 55.9557 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.057,"smiles":null,"spectrum_id":"CCMSLIB00017228622","spectrum_index":11491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Cys (delta mass: 83.0692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.191,"smiles":null,"spectrum_id":"CCMSLIB00017228625","spectrum_index":11492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 200.1348 Da; putative annotation: N/A; putative formula: C10H20N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.2,"smiles":null,"spectrum_id":"CCMSLIB00017228626","spectrum_index":11493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 17.0448 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.122,"smiles":null,"spectrum_id":"CCMSLIB00017228628","spectrum_index":11494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 88.0673 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.315,"smiles":null,"spectrum_id":"CCMSLIB00017228631","spectrum_index":11495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 28.0302 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.231,"smiles":null,"spectrum_id":"CCMSLIB00017228633","spectrum_index":11496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 117.0785 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.117,"smiles":null,"spectrum_id":"CCMSLIB00017228635","spectrum_index":11497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of aloesin (delta mass: 410.1219 Da; putative annotation: N/A; putative formula: C22H23N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":805.256,"smiles":null,"spectrum_id":"CCMSLIB00017228637","spectrum_index":11498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 193.0584 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.322,"smiles":null,"spectrum_id":"CCMSLIB00017228639","spectrum_index":11499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 48.0361 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.315,"smiles":null,"spectrum_id":"CCMSLIB00017228641","spectrum_index":11500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 527.2733 Da; putative annotation: N/A; putative formula: C29H42N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.344,"smiles":null,"spectrum_id":"CCMSLIB00017228643","spectrum_index":11501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 821.4208 Da; putative annotation: N/A; putative formula: C43H59N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1002.49,"smiles":null,"spectrum_id":"CCMSLIB00017228645","spectrum_index":11502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 726.3458 Da; putative annotation: N/A; putative formula: C34H50N10O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":889.406,"smiles":null,"spectrum_id":"CCMSLIB00017228647","spectrum_index":11503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 897.49 Da; putative annotation: N/A; putative formula: C51H63N9O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1060.55,"smiles":null,"spectrum_id":"CCMSLIB00017228650","spectrum_index":11504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 23.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.16,"smiles":null,"spectrum_id":"CCMSLIB00017228652","spectrum_index":11505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Myristoleic acid from NIST14 (delta mass: 179.0815 Da; putative annotation: N/A; putative formula: C5H14N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.282,"smiles":null,"spectrum_id":"CCMSLIB00017228654","spectrum_index":11506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxyquinoline-2-carboxylic acid CollisionEnergy:102040 (delta mass: 32.0625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.128,"smiles":null,"spectrum_id":"CCMSLIB00017228656","spectrum_index":11507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 82.0416 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.289,"smiles":null,"spectrum_id":"CCMSLIB00017228658","spectrum_index":11508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 95.0954 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.343,"smiles":null,"spectrum_id":"CCMSLIB00017228661","spectrum_index":11509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzoic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.029,"smiles":null,"spectrum_id":"CCMSLIB00017228663","spectrum_index":11510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 655.4145 Da; putative annotation: N/A; putative formula: C31H61NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.453,"smiles":null,"spectrum_id":"CCMSLIB00017228666","spectrum_index":11511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 149.1095 Da; putative annotation: N/A; putative formula: C7H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.196,"smiles":null,"spectrum_id":"CCMSLIB00017228667","spectrum_index":11512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 545.1939 Da; putative annotation: N/A; putative formula: C27H28N7O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.265,"smiles":null,"spectrum_id":"CCMSLIB00017228670","spectrum_index":11513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 158.1088 Da; putative annotation: N/A; putative formula: C6H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.237,"smiles":null,"spectrum_id":"CCMSLIB00017228672","spectrum_index":11514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 36.0373 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.145,"smiles":null,"spectrum_id":"CCMSLIB00017228674","spectrum_index":11515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 335.2822 Da; putative annotation: N/A; putative formula: C21H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.347,"smiles":null,"spectrum_id":"CCMSLIB00017228677","spectrum_index":11516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017228679","spectrum_index":11517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 56.0316 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.09,"smiles":null,"spectrum_id":"CCMSLIB00017228680","spectrum_index":11518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid (delta mass: 28.0312 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.274,"smiles":null,"spectrum_id":"CCMSLIB00017228682","spectrum_index":11519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5S)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one (delta mass: 63.9937 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.116,"smiles":null,"spectrum_id":"CCMSLIB00017228684","spectrum_index":11520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hexadec-15-en-7-ynyl-4-hydroxy-5-methyloxolan-2-one (delta mass: 92.0621 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017228687","spectrum_index":11521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310825 N-Fructosyl isoleucine (delta mass: 144.0425 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.197,"smiles":null,"spectrum_id":"CCMSLIB00017228689","spectrum_index":11522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 57.0805 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.13,"smiles":null,"spectrum_id":"CCMSLIB00017228690","spectrum_index":11523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 78.0828 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.315,"smiles":null,"spectrum_id":"CCMSLIB00017228693","spectrum_index":11524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 656.3571 Da; putative annotation: N/A; putative formula: C48H49P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":985.543,"smiles":null,"spectrum_id":"CCMSLIB00017228695","spectrum_index":11525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (4R,4aS,10R,13aR)-14-hydroxy-4,13a-dimethyl-9,13-dioxo-2,3,4,4a,5,6,9,10,11,12,13,13a-dodecahydro-1H-7,10-methanobenzo[11]annulene-4-carboxylate (delta mass: 106.0777 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.279,"smiles":null,"spectrum_id":"CCMSLIB00017228696","spectrum_index":11526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 115.0587 Da; putative annotation: N/A; putative formula: C4H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.187,"smiles":null,"spectrum_id":"CCMSLIB00017228700","spectrum_index":11527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 82.0766 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.236,"smiles":null,"spectrum_id":"CCMSLIB00017228701","spectrum_index":11528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,17-diol, (3.alpha.,5.alpha.,17.beta.)- (delta mass: 104.0999 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.347,"smiles":null,"spectrum_id":"CCMSLIB00017228703","spectrum_index":11529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 230.0904 Da; putative annotation: N/A; putative formula: C9H14N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.193,"smiles":null,"spectrum_id":"CCMSLIB00017228705","spectrum_index":11530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 358.2508 Da; putative annotation: N/A; putative formula: C23H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.483,"smiles":null,"spectrum_id":"CCMSLIB00017228707","spectrum_index":11531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-trans-Prostaglandin D2 (delta mass: 307.1271 Da; putative annotation: N/A; putative formula: C15H22N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.359,"smiles":null,"spectrum_id":"CCMSLIB00017228710","spectrum_index":11532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 12.9838 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.086,"smiles":null,"spectrum_id":"CCMSLIB00017228711","spectrum_index":11533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylpiperidine (delta mass: 227.1766 Da; putative annotation: N/A; putative formula: C15H21N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017228714","spectrum_index":11534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 66.0464 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017228716","spectrum_index":11535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 88.0159 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017228718","spectrum_index":11536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoleoylglycine (delta mass: 194.0433 Da; putative annotation: N/A; putative formula: C9H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.312,"smiles":null,"spectrum_id":"CCMSLIB00017228721","spectrum_index":11537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxocholesterol (delta mass: 118.0686 Da; putative annotation: N/A; putative formula: C3H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.41,"smiles":null,"spectrum_id":"CCMSLIB00017228722","spectrum_index":11538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 102.0333 Da; putative annotation: N/A; putative formula: C5H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.265,"smiles":null,"spectrum_id":"CCMSLIB00017228725","spectrum_index":11539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 73.0525 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.128,"smiles":null,"spectrum_id":"CCMSLIB00017228727","spectrum_index":11540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 106.0533 Da; putative annotation: N/A; putative formula: C6H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.114,"smiles":null,"spectrum_id":"CCMSLIB00017228729","spectrum_index":11541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Pyrimidyl)piperazine (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.124,"smiles":null,"spectrum_id":"CCMSLIB00017228732","spectrum_index":11542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 296.0909 Da; putative annotation: N/A; putative formula: C15H12N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.156,"smiles":null,"spectrum_id":"CCMSLIB00017228733","spectrum_index":11543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 265.161 Da; putative annotation: N/A; putative formula: C14H23N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.202,"smiles":null,"spectrum_id":"CCMSLIB00017228736","spectrum_index":11544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 135.0518 Da; putative annotation: N/A; putative formula: C8H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.304,"smiles":null,"spectrum_id":"CCMSLIB00017228738","spectrum_index":11545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 9.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.091,"smiles":null,"spectrum_id":"CCMSLIB00017228740","spectrum_index":11546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naproxen (delta mass: 18.0024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.104,"smiles":null,"spectrum_id":"CCMSLIB00017228743","spectrum_index":11547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zymosterol (delta mass: 41.9743 Da; putative annotation: N/A; putative formula: CH-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017228744","spectrum_index":11548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 171.1451 Da; putative annotation: N/A; putative formula: C10H21NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.33,"smiles":null,"spectrum_id":"CCMSLIB00017228747","spectrum_index":11549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 204.0992 Da; putative annotation: N/A; putative formula: C9H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.159,"smiles":null,"spectrum_id":"CCMSLIB00017228749","spectrum_index":11550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.164,"smiles":null,"spectrum_id":"CCMSLIB00017228750","spectrum_index":11551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cresotinic acid (delta mass: 40.0426 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017228754","spectrum_index":11552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrimidinylacetic acid (delta mass: 74.0357 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.086,"smiles":null,"spectrum_id":"CCMSLIB00017228755","spectrum_index":11553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 229.9853 Da; putative annotation: N/A; putative formula: C4H10N2O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.264,"smiles":null,"spectrum_id":"CCMSLIB00017228758","spectrum_index":11554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 36.0359 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.231,"smiles":null,"spectrum_id":"CCMSLIB00017228760","spectrum_index":11555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-Lys (delta mass: 71.0352 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.185,"smiles":null,"spectrum_id":"CCMSLIB00017228761","spectrum_index":11556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 45.9481 Da; putative annotation: N/A; putative formula: H-2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.087,"smiles":null,"spectrum_id":"CCMSLIB00017228764","spectrum_index":11557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 52.9269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.029,"smiles":null,"spectrum_id":"CCMSLIB00017228766","spectrum_index":11558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 166.0819 Da; putative annotation: N/A; putative formula: C10H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.162,"smiles":null,"spectrum_id":"CCMSLIB00017228767","spectrum_index":11559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 180.0626 Da; putative annotation: N/A; putative formula: C10H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.263,"smiles":null,"spectrum_id":"CCMSLIB00017228771","spectrum_index":11560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 120.0426 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.217,"smiles":null,"spectrum_id":"CCMSLIB00017228772","spectrum_index":11561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 146.0701 Da; putative annotation: N/A; putative formula: C6H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.188,"smiles":null,"spectrum_id":"CCMSLIB00017228774","spectrum_index":11562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 956.3335 Da; putative annotation: N/A; putative formula: C49H56N4O12S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.43,"smiles":null,"spectrum_id":"CCMSLIB00017228777","spectrum_index":11563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 261.1205 Da; putative annotation: N/A; putative formula: C15H21NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.181,"smiles":null,"spectrum_id":"CCMSLIB00017228778","spectrum_index":11564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvaol (delta mass: 102.0826 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.471,"smiles":null,"spectrum_id":"CCMSLIB00017228780","spectrum_index":11565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 262.9844 Da; putative annotation: N/A; putative formula: C6H5N3O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.039,"smiles":null,"spectrum_id":"CCMSLIB00017228783","spectrum_index":11566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzaldehyde (delta mass: 68.0472 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.086,"smiles":null,"spectrum_id":"CCMSLIB00017228785","spectrum_index":11567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 385.3189 Da; putative annotation: N/A; putative formula: C22H43NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.379,"smiles":null,"spectrum_id":"CCMSLIB00017228787","spectrum_index":11568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 304.0794 Da; putative annotation: N/A; putative formula: C12H16O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.208,"smiles":null,"spectrum_id":"CCMSLIB00017228790","spectrum_index":11569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroeburicoic acid (delta mass: 479.1837 Da; putative annotation: N/A; putative formula: C31H30NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":948.551,"smiles":null,"spectrum_id":"CCMSLIB00017228791","spectrum_index":11570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 144.0424 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.103,"smiles":null,"spectrum_id":"CCMSLIB00017228793","spectrum_index":11571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 76.0313 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.128,"smiles":null,"spectrum_id":"CCMSLIB00017228796","spectrum_index":11572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 42.0466 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.169,"smiles":null,"spectrum_id":"CCMSLIB00017228797","spectrum_index":11573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA001623 Tomatidine (delta mass: 120.0856 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.438,"smiles":null,"spectrum_id":"CCMSLIB00017228801","spectrum_index":11574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 99.0477 Da; putative annotation: N/A; putative formula: C8H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.125,"smiles":null,"spectrum_id":"CCMSLIB00017228802","spectrum_index":11575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 111.0321 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.108,"smiles":null,"spectrum_id":"CCMSLIB00017228804","spectrum_index":11576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 230.0788 Da; putative annotation: N/A; putative formula: C10H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.15,"smiles":null,"spectrum_id":"CCMSLIB00017228807","spectrum_index":11577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 42.01 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.221,"smiles":null,"spectrum_id":"CCMSLIB00017228808","spectrum_index":11578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maslinic acid (delta mass: 112.0623 Da; putative annotation: N/A; putative formula: CH4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.425,"smiles":null,"spectrum_id":"CCMSLIB00017228810","spectrum_index":11579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Ergothioneine (delta mass: 170.0488 Da; putative annotation: N/A; putative formula: C3H6N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.145,"smiles":null,"spectrum_id":"CCMSLIB00017228813","spectrum_index":11580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 161.0689 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.192,"smiles":null,"spectrum_id":"CCMSLIB00017228815","spectrum_index":11581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Bromo-2-formylphenoxy)acetic acid (delta mass: 69.0248 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.985,"smiles":null,"spectrum_id":"CCMSLIB00017228817","spectrum_index":11582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 180.2094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.333,"smiles":null,"spectrum_id":"CCMSLIB00017228820","spectrum_index":11583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 149.084 Da; putative annotation: N/A; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.197,"smiles":null,"spectrum_id":"CCMSLIB00017228821","spectrum_index":11584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 63.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.327,"smiles":null,"spectrum_id":"CCMSLIB00017228824","spectrum_index":11585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 373.2832 Da; putative annotation: N/A; putative formula: C20H39NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.416,"smiles":null,"spectrum_id":"CCMSLIB00017228826","spectrum_index":11586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 621.3722 Da; putative annotation: N/A; putative formula: C30H55NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.432,"smiles":null,"spectrum_id":"CCMSLIB00017228828","spectrum_index":11587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4a-Dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 46.0052 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.211,"smiles":null,"spectrum_id":"CCMSLIB00017228831","spectrum_index":11588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU203801 Carbamazepine-10,11-epoxide|Carbamazepine epoxide (delta mass: 194.0419 Da; putative annotation: N/A; putative formula: C10H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.139,"smiles":null,"spectrum_id":"CCMSLIB00017228832","spectrum_index":11589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 54.9694 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.045,"smiles":null,"spectrum_id":"CCMSLIB00017228834","spectrum_index":11590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .gamma.-Glu-.epsilon.-Lys (delta mass: 325.2616 Da; putative annotation: N/A; putative formula: C19H35NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.417,"smiles":null,"spectrum_id":"CCMSLIB00017228837","spectrum_index":11591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 116.0668 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.33,"smiles":null,"spectrum_id":"CCMSLIB00017228839","spectrum_index":11592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Castanospermine (delta mass: 134.0483 Da; putative annotation: N/A; putative formula: C7H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.156,"smiles":null,"spectrum_id":"CCMSLIB00017228842","spectrum_index":11593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 71.0434 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.13,"smiles":null,"spectrum_id":"CCMSLIB00017228844","spectrum_index":11594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 26.0728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.078,"smiles":null,"spectrum_id":"CCMSLIB00017228845","spectrum_index":11595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 64.0664 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.256,"smiles":null,"spectrum_id":"CCMSLIB00017228848","spectrum_index":11596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid (delta mass: 284.2708 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.534,"smiles":null,"spectrum_id":"CCMSLIB00017228849","spectrum_index":11597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 166.2082 Da; putative annotation: N/A; putative formula: C13H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.294,"smiles":null,"spectrum_id":"CCMSLIB00017228852","spectrum_index":11598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jasmonoyl-S-Isoleucine CollisionEnergy:102040 (delta mass: 179.0792 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.296,"smiles":null,"spectrum_id":"CCMSLIB00017228854","spectrum_index":11599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Deoxy-12-hydroxyandrographolide (delta mass: 102.0832 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.3,"smiles":null,"spectrum_id":"CCMSLIB00017228856","spectrum_index":11600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 86.0527 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.29,"smiles":null,"spectrum_id":"CCMSLIB00017228858","spectrum_index":11601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 400.2294 Da; putative annotation: N/A; putative formula: C21H38O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.388,"smiles":null,"spectrum_id":"CCMSLIB00017228860","spectrum_index":11602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(11),16,(5.alpha.)-Pregnadien-3.beta.-ol-20-one (delta mass: 38.0513 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.283,"smiles":null,"spectrum_id":"CCMSLIB00017228862","spectrum_index":11603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 112.1331 Da; putative annotation: N/A; putative formula: C7H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.248,"smiles":null,"spectrum_id":"CCMSLIB00017228864","spectrum_index":11604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3aR,6aR,8R,9S,10S,10aR,11R)-2,8,10-Trihydroxy-3a-methyl-12-methylenedodecahydro-1H,7H-5,7,10b-(epimethanetriyl)-6a,9-ethanodibenzo[cd,f]indole (delta mass: 86.0514 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.258,"smiles":null,"spectrum_id":"CCMSLIB00017228867","spectrum_index":11605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Resorcylic acid (delta mass: 54.0661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017228869","spectrum_index":11606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heptaethylene glycol p-tert-octylphenyl ether (delta mass: 14.184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.542,"smiles":null,"spectrum_id":"CCMSLIB00017228870","spectrum_index":11607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 191.0425 Da; putative annotation: N/A; putative formula: C6H9NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.103,"smiles":null,"spectrum_id":"CCMSLIB00017228873","spectrum_index":11608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 279.2557 Da; putative annotation: N/A; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.389,"smiles":null,"spectrum_id":"CCMSLIB00017228875","spectrum_index":11609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 86.2147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.262,"smiles":null,"spectrum_id":"CCMSLIB00017228877","spectrum_index":11610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 658.3585 Da; putative annotation: N/A; putative formula: C35H54N4O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":935.575,"smiles":null,"spectrum_id":"CCMSLIB00017228880","spectrum_index":11611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 33.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017228881","spectrum_index":11612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 79.9665 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.214,"smiles":null,"spectrum_id":"CCMSLIB00017228884","spectrum_index":11613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 329.6231 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.714,"smiles":null,"spectrum_id":"CCMSLIB00017228886","spectrum_index":11614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 48.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.222,"smiles":null,"spectrum_id":"CCMSLIB00017228887","spectrum_index":11615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 94.0533 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.156,"smiles":null,"spectrum_id":"CCMSLIB00017228891","spectrum_index":11616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gelsemine (delta mass: 77.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.233,"smiles":null,"spectrum_id":"CCMSLIB00017228892","spectrum_index":11617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE0; CorrDec (delta mass: 60.115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.191,"smiles":null,"spectrum_id":"CCMSLIB00017228894","spectrum_index":11618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 159.14 Da; putative annotation: N/A; putative formula: C12H17NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.226,"smiles":null,"spectrum_id":"CCMSLIB00017228897","spectrum_index":11619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 219.1102 Da; putative annotation: N/A; putative formula: C9H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.191,"smiles":null,"spectrum_id":"CCMSLIB00017228898","spectrum_index":11620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 83.0728 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.352,"smiles":null,"spectrum_id":"CCMSLIB00017228901","spectrum_index":11621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,7,8-trimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 61.0161 Da; putative annotation: N/A; putative formula: CH3NO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017228902","spectrum_index":11622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid (delta mass: 40.0312 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.07,"smiles":null,"spectrum_id":"CCMSLIB00017228904","spectrum_index":11623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 52.0297 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.096,"smiles":null,"spectrum_id":"CCMSLIB00017228907","spectrum_index":11624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coumaroyl putrescin (delta mass: 92.0467 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.191,"smiles":null,"spectrum_id":"CCMSLIB00017228908","spectrum_index":11625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 135.0672 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.192,"smiles":null,"spectrum_id":"CCMSLIB00017228910","spectrum_index":11626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 130.1154 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.363,"smiles":null,"spectrum_id":"CCMSLIB00017228913","spectrum_index":11627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 122.1101 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.342,"smiles":null,"spectrum_id":"CCMSLIB00017228914","spectrum_index":11628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 227.0956 Da; putative annotation: N/A; putative formula: C7H13N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.192,"smiles":null,"spectrum_id":"CCMSLIB00017228918","spectrum_index":11629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heptadecasphinganine (delta mass: 61.9203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.21,"smiles":null,"spectrum_id":"CCMSLIB00017228919","spectrum_index":11630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 375.1421 Da; putative annotation: N/A; putative formula: C12H22N7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.197,"smiles":null,"spectrum_id":"CCMSLIB00017228920","spectrum_index":11631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 128.0996 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.358,"smiles":null,"spectrum_id":"CCMSLIB00017228924","spectrum_index":11632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 112.1001 Da; putative annotation: N/A; putative formula: C6H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.191,"smiles":null,"spectrum_id":"CCMSLIB00017228925","spectrum_index":11633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 357.2505 Da; putative annotation: N/A; putative formula: C16H27N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.493,"smiles":null,"spectrum_id":"CCMSLIB00017228926","spectrum_index":11634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 315.2047 Da; putative annotation: N/A; putative formula: C16H29NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.275,"smiles":null,"spectrum_id":"CCMSLIB00017228930","spectrum_index":11635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 78.0474 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017228931","spectrum_index":11636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 15.995 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.102,"smiles":null,"spectrum_id":"CCMSLIB00017228933","spectrum_index":11637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 290.1194 Da; putative annotation: N/A; putative formula: C14H26S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.296,"smiles":null,"spectrum_id":"CCMSLIB00017228936","spectrum_index":11638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 462.2648 Da; putative annotation: N/A; putative formula: C25H39N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.325,"smiles":null,"spectrum_id":"CCMSLIB00017228937","spectrum_index":11639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 175.0474 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.134,"smiles":null,"spectrum_id":"CCMSLIB00017228940","spectrum_index":11640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 282.2198 Da; putative annotation: N/A; putative formula: C17H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.41,"smiles":null,"spectrum_id":"CCMSLIB00017228941","spectrum_index":11641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydromorphine (delta mass: 325.0804 Da; putative annotation: N/A; putative formula: C17H16N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.24,"smiles":null,"spectrum_id":"CCMSLIB00017228943","spectrum_index":11642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 377.1132 Da; putative annotation: N/A; putative formula: C20H19N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.246,"smiles":null,"spectrum_id":"CCMSLIB00017228946","spectrum_index":11643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 278.2239 Da; putative annotation: (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.477,"smiles":null,"spectrum_id":"CCMSLIB00017228947","spectrum_index":11644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 178.0646 Da; putative annotation: Methyl 2,4-dihydroxy-3,6-dimethylbenzoate; putative formula: C10H10O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.13,"smiles":null,"spectrum_id":"CCMSLIB00017228951","spectrum_index":11645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 324.1058 Da; putative annotation: Palatinose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.166,"smiles":null,"spectrum_id":"CCMSLIB00017228952","spectrum_index":11646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxopimara-8(14),15-dien-20-oic acid (delta mass: 316.2033 Da; putative annotation: Prostaglandin A2; putative formula: C20H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.414,"smiles":null,"spectrum_id":"CCMSLIB00017228954","spectrum_index":11647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-N-stearoylsphingosine (delta mass: 264.2459 Da; putative annotation: Oleic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.536,"smiles":null,"spectrum_id":"CCMSLIB00017228957","spectrum_index":11648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 115.026 Da; putative annotation: Massbank:RP001601 L-Aspartic acid|(2S)-2-aminobutanedioic acid; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.107,"smiles":null,"spectrum_id":"CCMSLIB00017228959","spectrum_index":11649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 260.2164 Da; putative annotation: Spectral Match to Pinolenic acid from NIST14; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.454,"smiles":null,"spectrum_id":"CCMSLIB00017228960","spectrum_index":11650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 262.2311 Da; putative annotation: linoleic acid; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.745,"smiles":null,"spectrum_id":"CCMSLIB00017228964","spectrum_index":11651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 332.236 Da; putative annotation: 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one; putative formula: C21H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.468,"smiles":null,"spectrum_id":"CCMSLIB00017228965","spectrum_index":11652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 100.0524 Da; putative annotation: 2-Hydroxy-2-methylbutyric acid; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.112,"smiles":null,"spectrum_id":"CCMSLIB00017228967","spectrum_index":11653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 115.0628 Da; putative annotation: N-Methyl-L-threonine; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.144,"smiles":null,"spectrum_id":"CCMSLIB00017228970","spectrum_index":11654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,13-Dihydrolactucin (delta mass: 278.1153 Da; putative annotation: Porritoxinol; putative formula: C15H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.238,"smiles":null,"spectrum_id":"CCMSLIB00017228971","spectrum_index":11655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 294.2197 Da; putative annotation: (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid; putative formula: C18H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.436,"smiles":null,"spectrum_id":"CCMSLIB00017228973","spectrum_index":11656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 216.0787 Da; putative annotation: 7-Acetyl-3,6-dihydroxy-8-methyl-3,4-dihydronaphthalen-1(2H)-one; putative formula: C13H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.149,"smiles":null,"spectrum_id":"CCMSLIB00017228975","spectrum_index":11657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 226.1566 Da; putative annotation: 1,11-Undecanedicarboxylic acid; putative formula: C13H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.404,"smiles":null,"spectrum_id":"CCMSLIB00017228977","spectrum_index":11658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 279.2576 Da; putative annotation: Palmitoleoyl ethanolamide; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.5,"smiles":null,"spectrum_id":"CCMSLIB00017228980","spectrum_index":11659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grandiflorenic acid (delta mass: 132.0939 Da; putative annotation: Cuminyl alcohol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.31,"smiles":null,"spectrum_id":"CCMSLIB00017228981","spectrum_index":11660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 206.1679 Da; putative annotation: 5-Tetradecynoic acid; putative formula: C14H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017228984","spectrum_index":11661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 152.1206 Da; putative annotation: (R)-(+)-Citronellic acid; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.306,"smiles":null,"spectrum_id":"CCMSLIB00017228986","spectrum_index":11662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 372.2676 Da; putative annotation: Spectral Match to 12-Ketodeoxycholic acid from NIST14; putative formula: C24H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.396,"smiles":null,"spectrum_id":"CCMSLIB00017228988","spectrum_index":11663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 381.2713 Da; putative annotation: Ala-C22:6; putative formula: C25H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.482,"smiles":null,"spectrum_id":"CCMSLIB00017228990","spectrum_index":11664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 314.2245 Da; putative annotation: NCGC00381032-01_C21H32O3_(3R,4R,5R)-3-[(11E)-11,15-Hexadecadien-9-yn-1-yl]-4-hydroxy-5-methyldihydro-2(3H)-furanone; putative formula: C21H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.348,"smiles":null,"spectrum_id":"CCMSLIB00017228991","spectrum_index":11665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 265.204 Da; putative annotation: Gly-C14:1; putative formula: C16H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.504,"smiles":null,"spectrum_id":"CCMSLIB00017228994","spectrum_index":11666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 222.1972 Da; putative annotation: NCGC00385844-01_C15H28O2_7-(2-Hydroxy-2-propanyl)-1,4a-dimethyldecahydro-1-naphthalenol; putative formula: C15H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.241,"smiles":null,"spectrum_id":"CCMSLIB00017228996","spectrum_index":11667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 295.2493 Da; putative annotation: N/A; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.502,"smiles":null,"spectrum_id":"CCMSLIB00017228997","spectrum_index":11668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 112.0673 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.127,"smiles":null,"spectrum_id":"CCMSLIB00017229001","spectrum_index":11669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 182.0666 Da; putative annotation: N/A; putative formula: C4H6N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.128,"smiles":null,"spectrum_id":"CCMSLIB00017229002","spectrum_index":11670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Protocatechuic acid (delta mass: 24.0075 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.041,"smiles":null,"spectrum_id":"CCMSLIB00017229005","spectrum_index":11671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 67.0062 Da; putative annotation: N/A; putative formula: C3HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.046,"smiles":null,"spectrum_id":"CCMSLIB00017229006","spectrum_index":11672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 242.2258 Da; putative annotation: N/A; putative formula: C15H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.303,"smiles":null,"spectrum_id":"CCMSLIB00017229008","spectrum_index":11673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vincamine (delta mass: 114.0685 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.27,"smiles":null,"spectrum_id":"CCMSLIB00017229011","spectrum_index":11674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 608.4907 Da; putative annotation: N/A; putative formula: C39H64N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.556,"smiles":null,"spectrum_id":"CCMSLIB00017229012","spectrum_index":11675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 140.0623 Da; putative annotation: N/A; putative formula: C11H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.186,"smiles":null,"spectrum_id":"CCMSLIB00017229015","spectrum_index":11676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 115.0266 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.108,"smiles":null,"spectrum_id":"CCMSLIB00017229017","spectrum_index":11677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufalin (delta mass: 175.1204 Da; putative annotation: N/A; putative formula: C8H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.373,"smiles":null,"spectrum_id":"CCMSLIB00017229019","spectrum_index":11678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 168.1151 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017229022","spectrum_index":11679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 178.0989 Da; putative annotation: N/A; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.369,"smiles":null,"spectrum_id":"CCMSLIB00017229024","spectrum_index":11680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenol (delta mass: 192.1773 Da; putative annotation: N/A; putative formula: C11H20N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.248,"smiles":null,"spectrum_id":"CCMSLIB00017229026","spectrum_index":11681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 53.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017229028","spectrum_index":11682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetamide (delta mass: 27.0108 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.097,"smiles":null,"spectrum_id":"CCMSLIB00017229030","spectrum_index":11683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 64.0181 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.12,"smiles":null,"spectrum_id":"CCMSLIB00017229033","spectrum_index":11684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 180.063 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.326,"smiles":null,"spectrum_id":"CCMSLIB00017229035","spectrum_index":11685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D3 (delta mass: 83.0738 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.415,"smiles":null,"spectrum_id":"CCMSLIB00017229037","spectrum_index":11686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 118.0782 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.31,"smiles":null,"spectrum_id":"CCMSLIB00017229039","spectrum_index":11687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 245.1632 Da; putative annotation: N/A; putative formula: C13H27NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.275,"smiles":null,"spectrum_id":"CCMSLIB00017229041","spectrum_index":11688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 209.1418 Da; putative annotation: N/A; putative formula: C12H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.364,"smiles":null,"spectrum_id":"CCMSLIB00017229043","spectrum_index":11689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxybenzoic acid (delta mass: 178.0628 Da; putative annotation: N/A; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.138,"smiles":null,"spectrum_id":"CCMSLIB00017229046","spectrum_index":11690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arachidonoylglycine (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.28,"smiles":null,"spectrum_id":"CCMSLIB00017229048","spectrum_index":11691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 96.0574 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017229050","spectrum_index":11692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 106.1144 Da; putative annotation: N/A; putative formula: C9H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017229052","spectrum_index":11693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-Gentiobiose (delta mass: 1045.3979 Da; putative annotation: N/A; putative formula: C51H67NO20S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1388.52,"smiles":null,"spectrum_id":"CCMSLIB00017229054","spectrum_index":11694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 265.0799 Da; putative annotation: N/A; putative formula: C9H15NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.161,"smiles":null,"spectrum_id":"CCMSLIB00017229056","spectrum_index":11695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 855.497 Da; putative annotation: N/A; putative formula: C49H69N5O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1018.56,"smiles":null,"spectrum_id":"CCMSLIB00017229059","spectrum_index":11696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 781.4974 Da; putative annotation: N/A; putative formula: C40H59N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.568,"smiles":null,"spectrum_id":"CCMSLIB00017229060","spectrum_index":11697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 131.9854 Da; putative annotation: N/A; putative formula: N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.124,"smiles":null,"spectrum_id":"CCMSLIB00017229063","spectrum_index":11698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 179.9135 Da; putative annotation: N/A; putative formula: CH-2N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.984,"smiles":null,"spectrum_id":"CCMSLIB00017229065","spectrum_index":11699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385206-01_C20H26O7_(3aR,4S,10Z,11aR)-10-(Hydroxymethyl)-6-methyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl 3,4-dihydroxy-2-methylenebutanoate (delta mass: 98.0388 Da; putative annotation: N/A; putative formula: C4H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.214,"smiles":null,"spectrum_id":"CCMSLIB00017229066","spectrum_index":11700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 36.0364 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.279,"smiles":null,"spectrum_id":"CCMSLIB00017229070","spectrum_index":11701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-4-ol, 3-[2-(dimethylamino)ethyl]-, 4-acetate (delta mass: 115.0989 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.243,"smiles":null,"spectrum_id":"CCMSLIB00017229071","spectrum_index":11702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 66.083 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.31,"smiles":null,"spectrum_id":"CCMSLIB00017229072","spectrum_index":11703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 83.0374 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.161,"smiles":null,"spectrum_id":"CCMSLIB00017229076","spectrum_index":11704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 14,15-EE-(8Z)-E from NIST14 (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.305,"smiles":null,"spectrum_id":"CCMSLIB00017229077","spectrum_index":11705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Chlorophenyl)-1H-pyrazol-5-amine (delta mass: 18.0077 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.056,"smiles":null,"spectrum_id":"CCMSLIB00017229078","spectrum_index":11706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 121.0533 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.177,"smiles":null,"spectrum_id":"CCMSLIB00017229082","spectrum_index":11707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 137.0804 Da; putative annotation: N/A; putative formula: C4H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.177,"smiles":null,"spectrum_id":"CCMSLIB00017229083","spectrum_index":11708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.4]nonane-2,4-dione (delta mass: 245.1739 Da; putative annotation: N/A; putative formula: C11H23N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.255,"smiles":null,"spectrum_id":"CCMSLIB00017229084","spectrum_index":11709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 141.0489 Da; putative annotation: N/A; putative formula: C4H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.26,"smiles":null,"spectrum_id":"CCMSLIB00017229088","spectrum_index":11710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 275.1983 Da; putative annotation: N/A; putative formula: C12H21N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.42,"smiles":null,"spectrum_id":"CCMSLIB00017229089","spectrum_index":11711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(6-methyl-6-azabicyclo[4.4.0]dec-2-yl)methyl 3-aminopropanoate, iodide CollisionEnergy:205060\"\" (delta mass: 45.0101 Da; putative annotation: N/A; putative formula: CH4NO-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.217,"smiles":null,"spectrum_id":"CCMSLIB00017229090","spectrum_index":11712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 130.0789 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.28,"smiles":null,"spectrum_id":"CCMSLIB00017229094","spectrum_index":11713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 132.0422 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.102,"smiles":null,"spectrum_id":"CCMSLIB00017229095","spectrum_index":11714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-amino-1-piperidinecarboxylate (delta mass: 31.0027 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.131,"smiles":null,"spectrum_id":"CCMSLIB00017229098","spectrum_index":11715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile/Leu-gMCA (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.405,"smiles":null,"spectrum_id":"CCMSLIB00017229100","spectrum_index":11716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hexyldecanoic acid (delta mass: 64.0671 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.315,"smiles":null,"spectrum_id":"CCMSLIB00017229101","spectrum_index":11717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 444.2732 Da; putative annotation: N/A; putative formula: C24H44O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.339,"smiles":null,"spectrum_id":"CCMSLIB00017229105","spectrum_index":11718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine, 2-(diphenylmethyl)-, (2S)- (delta mass: 53.0359 Da; putative annotation: N/A; putative formula: C2H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017229106","spectrum_index":11719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 90.0667 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.309,"smiles":null,"spectrum_id":"CCMSLIB00017229108","spectrum_index":11720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 30.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.134,"smiles":null,"spectrum_id":"CCMSLIB00017229111","spectrum_index":11721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroeburicoic acid (delta mass: 110.0362 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.404,"smiles":null,"spectrum_id":"CCMSLIB00017229113","spectrum_index":11722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thymol (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017229114","spectrum_index":11723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 173.1501 Da; putative annotation: N/A; putative formula: C4H15N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.209,"smiles":null,"spectrum_id":"CCMSLIB00017229118","spectrum_index":11724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 291.2278 Da; putative annotation: N/A; putative formula: C13H25N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.324,"smiles":null,"spectrum_id":"CCMSLIB00017229119","spectrum_index":11725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 222.4188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.5,"smiles":null,"spectrum_id":"CCMSLIB00017229120","spectrum_index":11726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetic acid methyl ester (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.357,"smiles":null,"spectrum_id":"CCMSLIB00017229124","spectrum_index":11727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D2 (delta mass: 36.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.362,"smiles":null,"spectrum_id":"CCMSLIB00017229125","spectrum_index":11728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Allyl-4-hydroxy-5-methoxybenzaldehyde (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017229126","spectrum_index":11729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 116.03 Da; putative annotation: N/A; putative formula: C5H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.133,"smiles":null,"spectrum_id":"CCMSLIB00017229130","spectrum_index":11730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 131.0579 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.165,"smiles":null,"spectrum_id":"CCMSLIB00017229131","spectrum_index":11731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 262.298 Da; putative annotation: N/A; putative formula: C20H38O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.426,"smiles":null,"spectrum_id":"CCMSLIB00017229133","spectrum_index":11732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ELAIDIC ACID (delta mass: 60.0565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.32,"smiles":null,"spectrum_id":"CCMSLIB00017229136","spectrum_index":11733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 189.0815 Da; putative annotation: N/A; putative formula: C10H12N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.179,"smiles":null,"spectrum_id":"CCMSLIB00017229137","spectrum_index":11734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 113.029 Da; putative annotation: N/A; putative formula: C5H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.094,"smiles":null,"spectrum_id":"CCMSLIB00017229140","spectrum_index":11735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethoxybenzoic acid (delta mass: 27.0824 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.153,"smiles":null,"spectrum_id":"CCMSLIB00017229142","spectrum_index":11736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 411.0665 Da; putative annotation: N/A; putative formula: C15H25NO4S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.158,"smiles":null,"spectrum_id":"CCMSLIB00017229143","spectrum_index":11737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-((E)-2-((1R,2S,3R,5S)-3,5-Dihydroxy-2-((Z)-oct-2-enyl)cyclopentyl)vinyl)tetrahydro-2H-pyran-2-one (delta mass: 56.0227 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.26,"smiles":null,"spectrum_id":"CCMSLIB00017229147","spectrum_index":11738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 56.026 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017229148","spectrum_index":11739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-[2-(Furan-3-yl)ethyl]-5-hydroxy-7,8-dimethyl-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-3-one (delta mass: 74.0373 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.228,"smiles":null,"spectrum_id":"CCMSLIB00017229149","spectrum_index":11740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 79.9561 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.074,"smiles":null,"spectrum_id":"CCMSLIB00017229153","spectrum_index":11741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Oxo-6E,8Z,11Z,14Z-eicosatetraenoic acid (delta mass: 28.0314 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.258,"smiles":null,"spectrum_id":"CCMSLIB00017229154","spectrum_index":11742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 58.0425 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.155,"smiles":null,"spectrum_id":"CCMSLIB00017229155","spectrum_index":11743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 146.1087 Da; putative annotation: N/A; putative formula: C5H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.377,"smiles":null,"spectrum_id":"CCMSLIB00017229159","spectrum_index":11744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 194.0101 Da; putative annotation: N/A; putative formula: C5H11N2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.086,"smiles":null,"spectrum_id":"CCMSLIB00017229160","spectrum_index":11745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 162.0523 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.242,"smiles":null,"spectrum_id":"CCMSLIB00017229161","spectrum_index":11746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 46.0061 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.077,"smiles":null,"spectrum_id":"CCMSLIB00017229165","spectrum_index":11747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-METHOXYBENZOIC ACID CollisionEnergy:102040 (delta mass: 40.0545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.109,"smiles":null,"spectrum_id":"CCMSLIB00017229166","spectrum_index":11748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 145.0789 Da; putative annotation: N/A; putative formula: C4H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.181,"smiles":null,"spectrum_id":"CCMSLIB00017229168","spectrum_index":11749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 297.2665 Da; putative annotation: N/A; putative formula: C18H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.332,"smiles":null,"spectrum_id":"CCMSLIB00017229171","spectrum_index":11750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 320.0682 Da; putative annotation: N/A; putative formula: C14H17N4O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.128,"smiles":null,"spectrum_id":"CCMSLIB00017229173","spectrum_index":11751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017229174","spectrum_index":11752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 223.104 Da; putative annotation: N/A; putative formula: C12H19NO-1P2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.169,"smiles":null,"spectrum_id":"CCMSLIB00017229177","spectrum_index":11753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 53.8714 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.103,"smiles":null,"spectrum_id":"CCMSLIB00017229179","spectrum_index":11754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 165.0121 Da; putative annotation: N/A; putative formula: C3H8N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.093,"smiles":null,"spectrum_id":"CCMSLIB00017229180","spectrum_index":11755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 573.3349 Da; putative annotation: N/A; putative formula: C30H47N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.395,"smiles":null,"spectrum_id":"CCMSLIB00017229183","spectrum_index":11756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid (delta mass: 120.0574 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.096,"smiles":null,"spectrum_id":"CCMSLIB00017229185","spectrum_index":11757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 199.0848 Da; putative annotation: N/A; putative formula: C9H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.374,"smiles":null,"spectrum_id":"CCMSLIB00017229186","spectrum_index":11758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 355.09 Da; putative annotation: N/A; putative formula: C15H17NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.156,"smiles":null,"spectrum_id":"CCMSLIB00017229190","spectrum_index":11759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 132.1025 Da; putative annotation: N/A; putative formula: C4H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.35,"smiles":null,"spectrum_id":"CCMSLIB00017229191","spectrum_index":11760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 201.5608 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.632,"smiles":null,"spectrum_id":"CCMSLIB00017229192","spectrum_index":11761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 259.0946 Da; putative annotation: N/A; putative formula: C15H18NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.186,"smiles":null,"spectrum_id":"CCMSLIB00017229196","spectrum_index":11762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 46.0053 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.043,"smiles":null,"spectrum_id":"CCMSLIB00017229197","spectrum_index":11763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 293.2037 Da; putative annotation: N/A; putative formula: C15H27N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.415,"smiles":null,"spectrum_id":"CCMSLIB00017229199","spectrum_index":11764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2 ethanolamide (delta mass: 104.064 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.338,"smiles":null,"spectrum_id":"CCMSLIB00017229202","spectrum_index":11765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methylphenyl)-1H-indole (delta mass: 56.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.17,"smiles":null,"spectrum_id":"CCMSLIB00017229203","spectrum_index":11766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 17.9658 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.052,"smiles":null,"spectrum_id":"CCMSLIB00017229207","spectrum_index":11767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 14.0789 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.213,"smiles":null,"spectrum_id":"CCMSLIB00017229208","spectrum_index":11768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 78.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.097,"smiles":null,"spectrum_id":"CCMSLIB00017229210","spectrum_index":11769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.123,"smiles":null,"spectrum_id":"CCMSLIB00017229213","spectrum_index":11770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 324.1141 Da; putative annotation: N/A; putative formula: C17H17N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.226,"smiles":null,"spectrum_id":"CCMSLIB00017229214","spectrum_index":11771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 16.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.139,"smiles":null,"spectrum_id":"CCMSLIB00017229216","spectrum_index":11772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Cyclopentylpropyl)methylamine (delta mass: 514.4269 Da; putative annotation: N/A; putative formula: C36H54N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.586,"smiles":null,"spectrum_id":"CCMSLIB00017229220","spectrum_index":11773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 164.0795 Da; putative annotation: N/A; putative formula: C5H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.16,"smiles":null,"spectrum_id":"CCMSLIB00017229221","spectrum_index":11774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholestenoic acid (delta mass: 124.067 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.403,"smiles":null,"spectrum_id":"CCMSLIB00017229223","spectrum_index":11775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 125.0183 Da; putative annotation: N/A; putative formula: H-1N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.115,"smiles":null,"spectrum_id":"CCMSLIB00017229226","spectrum_index":11776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 91.1098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.185,"smiles":null,"spectrum_id":"CCMSLIB00017229227","spectrum_index":11777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 548.4807 Da; putative annotation: N/A; putative formula: C35H64O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.708,"smiles":null,"spectrum_id":"CCMSLIB00017229231","spectrum_index":11778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 376.1271 Da; putative annotation: N/A; putative formula: C18H20N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.229,"smiles":null,"spectrum_id":"CCMSLIB00017229232","spectrum_index":11779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 374.2691 Da; putative annotation: N/A; putative formula: C19H39N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.475,"smiles":null,"spectrum_id":"CCMSLIB00017229233","spectrum_index":11780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 316.1777 Da; putative annotation: N/A; putative formula: C12H25N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.275,"smiles":null,"spectrum_id":"CCMSLIB00017229237","spectrum_index":11781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 82.0786 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.436,"smiles":null,"spectrum_id":"CCMSLIB00017229238","spectrum_index":11782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,15-Labdanediol (delta mass: 134.1109 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.405,"smiles":null,"spectrum_id":"CCMSLIB00017229240","spectrum_index":11783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylimbricatolic acid (delta mass: 114.085 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.354,"smiles":null,"spectrum_id":"CCMSLIB00017229243","spectrum_index":11784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 114.0876 Da; putative annotation: N/A; putative formula: C7H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.33,"smiles":null,"spectrum_id":"CCMSLIB00017229244","spectrum_index":11785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 68.0026 Da; putative annotation: N/A; putative formula: C2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.172,"smiles":null,"spectrum_id":"CCMSLIB00017229248","spectrum_index":11786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 151.0387 Da; putative annotation: N/A; putative formula: C6H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.104,"smiles":null,"spectrum_id":"CCMSLIB00017229249","spectrum_index":11787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 242.0159 Da; putative annotation: N/A; putative formula: C20H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":861.545,"smiles":null,"spectrum_id":"CCMSLIB00017229251","spectrum_index":11788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 103.0102 Da; putative annotation: N/A; putative formula: C3H7NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.185,"smiles":null,"spectrum_id":"CCMSLIB00017229254","spectrum_index":11789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 45.0543 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.114,"smiles":null,"spectrum_id":"CCMSLIB00017229255","spectrum_index":11790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 45.1052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.077,"smiles":null,"spectrum_id":"CCMSLIB00017229257","spectrum_index":11791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 176.0474 Da; putative annotation: N/A; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.108,"smiles":null,"spectrum_id":"CCMSLIB00017229260","spectrum_index":11792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [(3-Benzoyl-1-benzofuran-5-yl)oxy]acetic acid (delta mass: 80.047 Da; putative annotation: N/A; putative formula: C3H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.123,"smiles":null,"spectrum_id":"CCMSLIB00017229262","spectrum_index":11793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anisodamine (delta mass: 94.0482 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.218,"smiles":null,"spectrum_id":"CCMSLIB00017229263","spectrum_index":11794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 153.0536 Da; putative annotation: N/A; putative formula: C6H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.118,"smiles":null,"spectrum_id":"CCMSLIB00017229267","spectrum_index":11795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 200.1176 Da; putative annotation: N/A; putative formula: C10H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.183,"smiles":null,"spectrum_id":"CCMSLIB00017229268","spectrum_index":11796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 221.1428 Da; putative annotation: N/A; putative formula: C13H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.224,"smiles":null,"spectrum_id":"CCMSLIB00017229269","spectrum_index":11797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 50.0558 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.22,"smiles":null,"spectrum_id":"CCMSLIB00017229273","spectrum_index":11798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 216.1514 Da; putative annotation: N/A; putative formula: C15H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.222,"smiles":null,"spectrum_id":"CCMSLIB00017229274","spectrum_index":11799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 197.0899 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.171,"smiles":null,"spectrum_id":"CCMSLIB00017229276","spectrum_index":11800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lavandulol (delta mass: 36.0366 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.18,"smiles":null,"spectrum_id":"CCMSLIB00017229279","spectrum_index":11801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 13.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.117,"smiles":null,"spectrum_id":"CCMSLIB00017229280","spectrum_index":11802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 160.0638 Da; putative annotation: N/A; putative formula: C9H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.124,"smiles":null,"spectrum_id":"CCMSLIB00017229282","spectrum_index":11803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Phe (delta mass: 97.0534 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.192,"smiles":null,"spectrum_id":"CCMSLIB00017229285","spectrum_index":11804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 102.0679 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.175,"smiles":null,"spectrum_id":"CCMSLIB00017229286","spectrum_index":11805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.091,"smiles":null,"spectrum_id":"CCMSLIB00017229288","spectrum_index":11806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 177.1002 Da; putative annotation: N/A; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.348,"smiles":null,"spectrum_id":"CCMSLIB00017229291","spectrum_index":11807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 57.0215 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017229292","spectrum_index":11808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 148.0885 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.315,"smiles":null,"spectrum_id":"CCMSLIB00017229295","spectrum_index":11809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 122.0727 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.305,"smiles":null,"spectrum_id":"CCMSLIB00017229297","spectrum_index":11810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucose-6-phosphate (delta mass: 280.2758 Da; putative annotation: N/A; putative formula: C19H36O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.313,"smiles":null,"spectrum_id":"CCMSLIB00017229299","spectrum_index":11811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-norleucine (delta mass: 88.0165 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017229301","spectrum_index":11812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 45.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.186,"smiles":null,"spectrum_id":"CCMSLIB00017229304","spectrum_index":11813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tibolone (delta mass: 86.0137 Da; putative annotation: N/A; putative formula: CH3N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.23,"smiles":null,"spectrum_id":"CCMSLIB00017229306","spectrum_index":11814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 70.0781 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017229308","spectrum_index":11815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 35.0463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.148,"smiles":null,"spectrum_id":"CCMSLIB00017229311","spectrum_index":11816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 111.0373 Da; putative annotation: N/A; putative formula: C4H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.102,"smiles":null,"spectrum_id":"CCMSLIB00017229313","spectrum_index":11817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 72.0945 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.159,"smiles":null,"spectrum_id":"CCMSLIB00017229314","spectrum_index":11818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 113.048 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.113,"smiles":null,"spectrum_id":"CCMSLIB00017229318","spectrum_index":11819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 107.0388 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.141,"smiles":null,"spectrum_id":"CCMSLIB00017229319","spectrum_index":11820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 81.062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017229322","spectrum_index":11821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 44.9971 Da; putative annotation: N/A; putative formula: C4H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.084,"smiles":null,"spectrum_id":"CCMSLIB00017229324","spectrum_index":11822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 143.084 Da; putative annotation: N/A; putative formula: C9H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.183,"smiles":null,"spectrum_id":"CCMSLIB00017229325","spectrum_index":11823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 54.9581 Da; putative annotation: N/A; putative formula: C24H37N7O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017229328","spectrum_index":11824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-(1H-Indol-2-yl)-2-propenoic acid (delta mass: 41.0637 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.134,"smiles":null,"spectrum_id":"CCMSLIB00017229330","spectrum_index":11825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Pregnene-20.beta.-ol-3-one (delta mass: 100.0634 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.311,"smiles":null,"spectrum_id":"CCMSLIB00017229331","spectrum_index":11826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 309.1212 Da; putative annotation: N/A; putative formula: C15H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.181,"smiles":null,"spectrum_id":"CCMSLIB00017229335","spectrum_index":11827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 67.9898 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.039,"smiles":null,"spectrum_id":"CCMSLIB00017229336","spectrum_index":11828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 183.0767 Da; putative annotation: N/A; putative formula: C6H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.189,"smiles":null,"spectrum_id":"CCMSLIB00017229337","spectrum_index":11829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Acetaminobenzoic acid (delta mass: 46.0043 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.07,"smiles":null,"spectrum_id":"CCMSLIB00017229341","spectrum_index":11830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 148.0895 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.321,"smiles":null,"spectrum_id":"CCMSLIB00017229342","spectrum_index":11831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 42.8994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.986,"smiles":null,"spectrum_id":"CCMSLIB00017229343","spectrum_index":11832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 189.0997 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.384,"smiles":null,"spectrum_id":"CCMSLIB00017229347","spectrum_index":11833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 30.0 eV (delta mass: 503.1852 Da; putative annotation: N/A; putative formula: C24H25N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.309,"smiles":null,"spectrum_id":"CCMSLIB00017229348","spectrum_index":11834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 16.9416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.028,"smiles":null,"spectrum_id":"CCMSLIB00017229350","spectrum_index":11835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331603 Linoleic acid|(9Z,12Z)-octadeca-9,12-dienoic acid (delta mass: 13.9793 Da; putative annotation: N/A; putative formula: H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017229353","spectrum_index":11836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methylquinolin-2(1H)-one (delta mass: 119.1178 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.194,"smiles":null,"spectrum_id":"CCMSLIB00017229355","spectrum_index":11837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.139,"smiles":null,"spectrum_id":"CCMSLIB00017229356","spectrum_index":11838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 80.0248 Da; putative annotation: N/A; putative formula: CN6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.164,"smiles":null,"spectrum_id":"CCMSLIB00017229360","spectrum_index":11839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Progesterone 3-biotin (delta mass: 86.0603 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.491,"smiles":null,"spectrum_id":"CCMSLIB00017229361","spectrum_index":11840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 197.1042 Da; putative annotation: N/A; putative formula: C10H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.383,"smiles":null,"spectrum_id":"CCMSLIB00017229363","spectrum_index":11841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 33.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.102,"smiles":null,"spectrum_id":"CCMSLIB00017229365","spectrum_index":11842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxostearic acid (delta mass: 242.226 Da; putative annotation: N/A; putative formula: C15H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.484,"smiles":null,"spectrum_id":"CCMSLIB00017229366","spectrum_index":11843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 381.0907 Da; putative annotation: N/A; putative formula: C13H19NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.161,"smiles":null,"spectrum_id":"CCMSLIB00017229369","spectrum_index":11844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 112.0772 Da; putative annotation: N/A; putative formula: C4H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.201,"smiles":null,"spectrum_id":"CCMSLIB00017229371","spectrum_index":11845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZOIC ACID CollisionEnergy:205060 (delta mass: 86.0367 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.076,"smiles":null,"spectrum_id":"CCMSLIB00017229372","spectrum_index":11846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid (delta mass: 70.053 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.092,"smiles":null,"spectrum_id":"CCMSLIB00017229375","spectrum_index":11847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 355.2355 Da; putative annotation: N/A; putative formula: C19H33NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.306,"smiles":null,"spectrum_id":"CCMSLIB00017229377","spectrum_index":11848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-4-phenyl-3-butyn-2-ol (delta mass: 195.1257 Da; putative annotation: N/A; putative formula: C11H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.222,"smiles":null,"spectrum_id":"CCMSLIB00017229378","spectrum_index":11849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 127.0867 Da; putative annotation: N/A; putative formula: C4H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.167,"smiles":null,"spectrum_id":"CCMSLIB00017229382","spectrum_index":11850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 192.1145 Da; putative annotation: N/A; putative formula: C6H17N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.195,"smiles":null,"spectrum_id":"CCMSLIB00017229383","spectrum_index":11851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 315.2761 Da; putative annotation: N/A; putative formula: C18H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.539,"smiles":null,"spectrum_id":"CCMSLIB00017229385","spectrum_index":11852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 64.068 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.279,"smiles":null,"spectrum_id":"CCMSLIB00017229388","spectrum_index":11853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 248.1053 Da; putative annotation: N/A; putative formula: C7H16N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.202,"smiles":null,"spectrum_id":"CCMSLIB00017229390","spectrum_index":11854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 80.0625 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.295,"smiles":null,"spectrum_id":"CCMSLIB00017229392","spectrum_index":11855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 61.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.123,"smiles":null,"spectrum_id":"CCMSLIB00017229395","spectrum_index":11856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 127.0783 Da; putative annotation: N/A; putative formula: C10H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.16,"smiles":null,"spectrum_id":"CCMSLIB00017229396","spectrum_index":11857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-2-Decenoic acid (delta mass: 111.0328 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.171,"smiles":null,"spectrum_id":"CCMSLIB00017229398","spectrum_index":11858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 603.4145 Da; putative annotation: N/A; putative formula: C36H53N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.517,"smiles":null,"spectrum_id":"CCMSLIB00017229400","spectrum_index":11859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 82.0266 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017229401","spectrum_index":11860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 211.0692 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.207,"smiles":null,"spectrum_id":"CCMSLIB00017229404","spectrum_index":11861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxydihydrocinnamic acid (delta mass: 236.156 Da; putative annotation: N/A; putative formula: C18H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.263,"smiles":null,"spectrum_id":"CCMSLIB00017229406","spectrum_index":11862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 356.2784 Da; putative annotation: N/A; putative formula: C18H36N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.37,"smiles":null,"spectrum_id":"CCMSLIB00017229407","spectrum_index":11863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 270.1372 Da; putative annotation: N/A; putative formula: C16H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.224,"smiles":null,"spectrum_id":"CCMSLIB00017229411","spectrum_index":11864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 345.1267 Da; putative annotation: N/A; putative formula: C24H15N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.479,"smiles":null,"spectrum_id":"CCMSLIB00017229412","spectrum_index":11865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 621.2143 Da; putative annotation: N/A; putative formula: C32H35N3O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.255,"smiles":null,"spectrum_id":"CCMSLIB00017229414","spectrum_index":11866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 619.5432 Da; putative annotation: N/A; putative formula: C41H69N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.77,"smiles":null,"spectrum_id":"CCMSLIB00017229417","spectrum_index":11867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-(1,2,4a,5-Tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoic acid (delta mass: 130.0784 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.305,"smiles":null,"spectrum_id":"CCMSLIB00017229418","spectrum_index":11868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 148.0886 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.311,"smiles":null,"spectrum_id":"CCMSLIB00017229420","spectrum_index":11869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 112.0673 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.279,"smiles":null,"spectrum_id":"CCMSLIB00017229423","spectrum_index":11870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 413.2049 Da; putative annotation: N/A; putative formula: C20H31NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.437,"smiles":null,"spectrum_id":"CCMSLIB00017229424","spectrum_index":11871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maslinic acid (delta mass: 128.0623 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.425,"smiles":null,"spectrum_id":"CCMSLIB00017229428","spectrum_index":11872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 16.0066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":130.098,"smiles":null,"spectrum_id":"CCMSLIB00017229429","spectrum_index":11873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol oxide A (delta mass: 35.9605 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.161,"smiles":null,"spectrum_id":"CCMSLIB00017229430","spectrum_index":11874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 56.063 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.3,"smiles":null,"spectrum_id":"CCMSLIB00017229434","spectrum_index":11875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU069502 2-Acetamidophenol|N-(2-hydroxyphenyl)acetamide (delta mass: 217.0594 Da; putative annotation: N/A; putative formula: C9H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.13,"smiles":null,"spectrum_id":"CCMSLIB00017229435","spectrum_index":11876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-[(5Z)-pentadec-5-en-1-yl]piperidine (delta mass: 172.0188 Da; putative annotation: N/A; putative formula: C9H5N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.35,"smiles":null,"spectrum_id":"CCMSLIB00017229436","spectrum_index":11877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,17,20,23,26,29-Dotriacontahexaenoic acid, (14Z,17Z,20Z,23Z,26Z,29Z)- (delta mass: 84.0566 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.461,"smiles":null,"spectrum_id":"CCMSLIB00017229440","spectrum_index":11878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Amyrenonol (delta mass: 128.1047 Da; putative annotation: N/A; putative formula: C5H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.477,"smiles":null,"spectrum_id":"CCMSLIB00017229441","spectrum_index":11879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,16-Dimethylprostaglandin D2 (delta mass: 45.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.322,"smiles":null,"spectrum_id":"CCMSLIB00017229443","spectrum_index":11880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 31.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.143,"smiles":null,"spectrum_id":"CCMSLIB00017229446","spectrum_index":11881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Colubrinic acid (delta mass: 80.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.425,"smiles":null,"spectrum_id":"CCMSLIB00017229447","spectrum_index":11882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 175.0627 Da; putative annotation: N/A; putative formula: C4H10N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.144,"smiles":null,"spectrum_id":"CCMSLIB00017229449","spectrum_index":11883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 408.2284 Da; putative annotation: N/A; putative formula: C20H41O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.299,"smiles":null,"spectrum_id":"CCMSLIB00017229452","spectrum_index":11884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.192,"smiles":null,"spectrum_id":"CCMSLIB00017229453","spectrum_index":11885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 149.0479 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.16,"smiles":null,"spectrum_id":"CCMSLIB00017229457","spectrum_index":11886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 78.0458 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.319,"smiles":null,"spectrum_id":"CCMSLIB00017229458","spectrum_index":11887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-carboxypropanoylamino)-3-methylpentanoic acid CollisionEnergy:205060 (delta mass: 72.0214 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.139,"smiles":null,"spectrum_id":"CCMSLIB00017229459","spectrum_index":11888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 249.1213 Da; putative annotation: N/A; putative formula: C10H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.181,"smiles":null,"spectrum_id":"CCMSLIB00017229461","spectrum_index":11889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Urospermal (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017229463","spectrum_index":11890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-acetyl-4-hydroxy-1-(2-imidazol-4-ylethyl)-2-(3-methoxyphenyl)-5-oxo-3-pyrrol ine CollisionEnergy:102040 (delta mass: 59.0143 Da; putative annotation: N/A; putative formula: C5HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.159,"smiles":null,"spectrum_id":"CCMSLIB00017229464","spectrum_index":11891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 270.2164 Da; putative annotation: N/A; putative formula: C12H26N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.495,"smiles":null,"spectrum_id":"CCMSLIB00017229466","spectrum_index":11892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 242.2289 Da; putative annotation: N/A; putative formula: C14H31N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.368,"smiles":null,"spectrum_id":"CCMSLIB00017229468","spectrum_index":11893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Populin (delta mass: 561.1839 Da; putative annotation: N/A; putative formula: C19H35N3O14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":952.323,"smiles":null,"spectrum_id":"CCMSLIB00017229470","spectrum_index":11894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 164.0633 Da; putative annotation: N/A; putative formula: C5H14N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.135,"smiles":null,"spectrum_id":"CCMSLIB00017229472","spectrum_index":11895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-3-(2-methoxyphenyl)coumarin (delta mass: 18.0089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.09,"smiles":null,"spectrum_id":"CCMSLIB00017229474","spectrum_index":11896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 699.3834 Da; putative annotation: N/A; putative formula: C36H61NO8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1002.62,"smiles":null,"spectrum_id":"CCMSLIB00017229476","spectrum_index":11897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 82.078 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017229478","spectrum_index":11898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-ethenyl-1,4a,7-trimethyl-6-oxo-2,3,4,8,8a,9,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 50.0511 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.262,"smiles":null,"spectrum_id":"CCMSLIB00017229480","spectrum_index":11899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 147.0417 Da; putative annotation: N/A; putative formula: C3HN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.13,"smiles":null,"spectrum_id":"CCMSLIB00017229482","spectrum_index":11900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amino adipic acid dimethyl ester (delta mass: 84.057 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.164,"smiles":null,"spectrum_id":"CCMSLIB00017229484","spectrum_index":11901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methoxycarbonyl)but-3-enoic acid (delta mass: 157.1569 Da; putative annotation: N/A; putative formula: C8H19N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.206,"smiles":null,"spectrum_id":"CCMSLIB00017229486","spectrum_index":11902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 137.1064 Da; putative annotation: N/A; putative formula: C6H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.203,"smiles":null,"spectrum_id":"CCMSLIB00017229488","spectrum_index":11903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 122.0315 Da; putative annotation: N/A; putative formula: C2H6N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.169,"smiles":null,"spectrum_id":"CCMSLIB00017229490","spectrum_index":11904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-3-(4-Fluorobenzyl)piperidine (delta mass: 46.9684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.102,"smiles":null,"spectrum_id":"CCMSLIB00017229492","spectrum_index":11905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stigmaydene Y (delta mass: 91.0997 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.321,"smiles":null,"spectrum_id":"CCMSLIB00017229494","spectrum_index":11906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-phenyl-2-pyrrolylpropanoic acid CollisionEnergy:102040 (delta mass: 58.0056 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.108,"smiles":null,"spectrum_id":"CCMSLIB00017229496","spectrum_index":11907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 337.1007 Da; putative annotation: N/A; putative formula: C12H19NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.171,"smiles":null,"spectrum_id":"CCMSLIB00017229498","spectrum_index":11908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 295.3314 Da; putative annotation: N/A; putative formula: C19H41N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.429,"smiles":null,"spectrum_id":"CCMSLIB00017229500","spectrum_index":11909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 188.105 Da; putative annotation: N/A; putative formula: C9H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.228,"smiles":null,"spectrum_id":"CCMSLIB00017229502","spectrum_index":11910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 244.0894 Da; putative annotation: N/A; putative formula: C10H18N2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.192,"smiles":null,"spectrum_id":"CCMSLIB00017229504","spectrum_index":11911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 131.1423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.281,"smiles":null,"spectrum_id":"CCMSLIB00017229506","spectrum_index":11912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethanolamide (delta mass: 104.0985 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.389,"smiles":null,"spectrum_id":"CCMSLIB00017229507","spectrum_index":11913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 241.2777 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":744.584,"smiles":null,"spectrum_id":"CCMSLIB00017229510","spectrum_index":11914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 251.2392 Da; putative annotation: N/A; putative formula: C15H29N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.32,"smiles":null,"spectrum_id":"CCMSLIB00017229511","spectrum_index":11915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 358.251 Da; putative annotation: N/A; putative formula: C23H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.498,"smiles":null,"spectrum_id":"CCMSLIB00017229514","spectrum_index":11916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HAPLAMINE CollisionEnergy:102040 (delta mass: 182.069 Da; putative annotation: N/A; putative formula: C8H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.181,"smiles":null,"spectrum_id":"CCMSLIB00017229515","spectrum_index":11917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 719.3924 Da; putative annotation: N/A; putative formula: C28H53N11O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.453,"smiles":null,"spectrum_id":"CCMSLIB00017229517","spectrum_index":11918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-methyl-4-methylidene-7-(propan-2-yl)-1,2,3,3a,4,5,6,8a-octahydroazulen-1-ol (delta mass: 31.9727 Da; putative annotation: N/A; putative formula: S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.163,"smiles":null,"spectrum_id":"CCMSLIB00017229519","spectrum_index":11919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 92.0628 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.368,"smiles":null,"spectrum_id":"CCMSLIB00017229520","spectrum_index":11920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Arg from NIST14 (delta mass: 43.0065 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.21,"smiles":null,"spectrum_id":"CCMSLIB00017229521","spectrum_index":11921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ptaeroxylin (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.159,"smiles":null,"spectrum_id":"CCMSLIB00017229524","spectrum_index":11922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 122.0499 Da; putative annotation: N/A; putative formula: C6H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.136,"smiles":null,"spectrum_id":"CCMSLIB00017229525","spectrum_index":11923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.245,"smiles":null,"spectrum_id":"CCMSLIB00017229528","spectrum_index":11924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 956.5959 Da; putative annotation: N/A; putative formula: C50H76N12O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.69,"smiles":null,"spectrum_id":"CCMSLIB00017229529","spectrum_index":11925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 38.0155 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.263,"smiles":null,"spectrum_id":"CCMSLIB00017229530","spectrum_index":11926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 41.0225 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.27,"smiles":null,"spectrum_id":"CCMSLIB00017229532","spectrum_index":11927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 55.0589 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.27,"smiles":null,"spectrum_id":"CCMSLIB00017229534","spectrum_index":11928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labdanolic acid (delta mass: 38.0525 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.326,"smiles":null,"spectrum_id":"CCMSLIB00017229535","spectrum_index":11929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 119.058 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.139,"smiles":null,"spectrum_id":"CCMSLIB00017229538","spectrum_index":11930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 341.1801 Da; putative annotation: N/A; putative formula: C12H27N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.251,"smiles":null,"spectrum_id":"CCMSLIB00017229539","spectrum_index":11931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 67.0425 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017229541","spectrum_index":11932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 672.6939 Da; putative annotation: N/A; putative formula: C50H88O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.791,"smiles":null,"spectrum_id":"CCMSLIB00017229543","spectrum_index":11933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 104.048 Da; putative annotation: N/A; putative formula: C5H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.092,"smiles":null,"spectrum_id":"CCMSLIB00017229545","spectrum_index":11934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 62.0435 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.182,"smiles":null,"spectrum_id":"CCMSLIB00017229547","spectrum_index":11935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Deoxylactucin (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017229548","spectrum_index":11936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 590.4189 Da; putative annotation: N/A; putative formula: C28H58N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.49,"smiles":null,"spectrum_id":"CCMSLIB00017229551","spectrum_index":11937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,3-Dimethylbicyclo[2.2.1]hept-2-yl)-1-propanol (delta mass: 62.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.211,"smiles":null,"spectrum_id":"CCMSLIB00017229552","spectrum_index":11938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 104.0631 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.342,"smiles":null,"spectrum_id":"CCMSLIB00017229554","spectrum_index":11939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 135.0375 Da; putative annotation: N/A; putative formula: C4H11NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.15,"smiles":null,"spectrum_id":"CCMSLIB00017229556","spectrum_index":11940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swietenocoumarin H (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.107,"smiles":null,"spectrum_id":"CCMSLIB00017229558","spectrum_index":11941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 375.2512 Da; putative annotation: N/A; putative formula: C21H33N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":871.591,"smiles":null,"spectrum_id":"CCMSLIB00017229560","spectrum_index":11942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 136.0892 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.321,"smiles":null,"spectrum_id":"CCMSLIB00017229562","spectrum_index":11943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 116.0615 Da; putative annotation: N/A; putative formula: C3H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.273,"smiles":null,"spectrum_id":"CCMSLIB00017229564","spectrum_index":11944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 27.0111 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.092,"smiles":null,"spectrum_id":"CCMSLIB00017229566","spectrum_index":11945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 23.0802 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.102,"smiles":null,"spectrum_id":"CCMSLIB00017229568","spectrum_index":11946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 343.2709 Da; putative annotation: N/A; putative formula: CH25N23O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.493,"smiles":null,"spectrum_id":"CCMSLIB00017229570","spectrum_index":11947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 193.0811 Da; putative annotation: N/A; putative formula: C6H16N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.141,"smiles":null,"spectrum_id":"CCMSLIB00017229572","spectrum_index":11948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300091 11,12-Methylenedioxykopsinaline (delta mass: 316.2836 Da; putative annotation: N/A; putative formula: C16H36N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.475,"smiles":null,"spectrum_id":"CCMSLIB00017229574","spectrum_index":11949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatrienoic acid (delta mass: 54.0315 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.326,"smiles":null,"spectrum_id":"CCMSLIB00017229576","spectrum_index":11950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(1Z-Octadecenyl)-sn-glycero-3-phosphocholine (delta mass: 507.3677 Da; putative annotation: N/A; putative formula: C28H49N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1015.74,"smiles":null,"spectrum_id":"CCMSLIB00017229578","spectrum_index":11951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 444.1751 Da; putative annotation: N/A; putative formula: C20H32N2O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.256,"smiles":null,"spectrum_id":"CCMSLIB00017229579","spectrum_index":11952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 193.0588 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.145,"smiles":null,"spectrum_id":"CCMSLIB00017229581","spectrum_index":11953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 170.0944 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.186,"smiles":null,"spectrum_id":"CCMSLIB00017229583","spectrum_index":11954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 331.1782 Da; putative annotation: N/A; putative formula: C19H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.322,"smiles":null,"spectrum_id":"CCMSLIB00017229584","spectrum_index":11955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 106.0832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.31,"smiles":null,"spectrum_id":"CCMSLIB00017229587","spectrum_index":11956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 396.1299 Da; putative annotation: N/A; putative formula: C14H25N2O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.19,"smiles":null,"spectrum_id":"CCMSLIB00017229588","spectrum_index":11957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gabapentin (delta mass: 24.9948 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.128,"smiles":null,"spectrum_id":"CCMSLIB00017229590","spectrum_index":11958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 58.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.088,"smiles":null,"spectrum_id":"CCMSLIB00017229592","spectrum_index":11959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 10.0053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.092,"smiles":null,"spectrum_id":"CCMSLIB00017229594","spectrum_index":11960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-(2,3-Dihydroxypropoxy)-9-oxononanoic acid (delta mass: 187.1569 Da; putative annotation: N/A; putative formula: C10H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.306,"smiles":null,"spectrum_id":"CCMSLIB00017229596","spectrum_index":11961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.269,"smiles":null,"spectrum_id":"CCMSLIB00017229598","spectrum_index":11962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 250.1928 Da; putative annotation: N/A; putative formula: C16H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.259,"smiles":null,"spectrum_id":"CCMSLIB00017229600","spectrum_index":11963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 361.329 Da; putative annotation: N/A; putative formula: C20H39N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.426,"smiles":null,"spectrum_id":"CCMSLIB00017229602","spectrum_index":11964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Obeticholic_Acid_NCE45 (delta mass: 102.0888 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.42,"smiles":null,"spectrum_id":"CCMSLIB00017229604","spectrum_index":11965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 184.1132 Da; putative annotation: N/A; putative formula: C9H17N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.173,"smiles":null,"spectrum_id":"CCMSLIB00017229606","spectrum_index":11966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 86.0726 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.336,"smiles":null,"spectrum_id":"CCMSLIB00017229608","spectrum_index":11967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 156.0416 Da; putative annotation: N/A; putative formula: C7H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.159,"smiles":null,"spectrum_id":"CCMSLIB00017229610","spectrum_index":11968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 166.0998 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.311,"smiles":null,"spectrum_id":"CCMSLIB00017229611","spectrum_index":11969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 27.0443 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.115,"smiles":null,"spectrum_id":"CCMSLIB00017229613","spectrum_index":11970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP007402 Glycohyocholic acid|AM022340|2-[4-(3,6,7-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid (delta mass: 127.0653 Da; putative annotation: N/A; putative formula: C5H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.382,"smiles":null,"spectrum_id":"CCMSLIB00017229615","spectrum_index":11971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[(2,5,5,8a-Tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol (delta mass: 78.0469 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017229616","spectrum_index":11972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 136.0887 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.169,"smiles":null,"spectrum_id":"CCMSLIB00017229619","spectrum_index":11973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 622.1877 Da; putative annotation: N/A; putative formula: C26H34N6O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.269,"smiles":null,"spectrum_id":"CCMSLIB00017229620","spectrum_index":11974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 237.1842 Da; putative annotation: N/A; putative formula: C13H23N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.46,"smiles":null,"spectrum_id":"CCMSLIB00017229621","spectrum_index":11975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 152.0987 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.435,"smiles":null,"spectrum_id":"CCMSLIB00017229624","spectrum_index":11976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 89.0842 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.181,"smiles":null,"spectrum_id":"CCMSLIB00017229625","spectrum_index":11977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,9a,9b-octahydrobenzo[g][1]benzofuran-2-one (delta mass: 193.0558 Da; putative annotation: N/A; putative formula: C10H11NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.22,"smiles":null,"spectrum_id":"CCMSLIB00017229626","spectrum_index":11978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 100.0678 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017229628","spectrum_index":11979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Nitrosopiperazine (NPAZ) (delta mass: 54.0707 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.152,"smiles":null,"spectrum_id":"CCMSLIB00017229631","spectrum_index":11980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15S-Hydroperoxy-11Z,13E-eicosadienoic acid (delta mass: 63.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.337,"smiles":null,"spectrum_id":"CCMSLIB00017229632","spectrum_index":11981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Hyodeoxycholic acid (delta mass: 52.0677 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017229633","spectrum_index":11982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 156.0232 Da; putative annotation: N/A; putative formula: C9H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.083,"smiles":null,"spectrum_id":"CCMSLIB00017229636","spectrum_index":11983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 76.0162 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.071,"smiles":null,"spectrum_id":"CCMSLIB00017229637","spectrum_index":11984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-7-methoxycoumarin (delta mass: 78.0151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.065,"smiles":null,"spectrum_id":"CCMSLIB00017229640","spectrum_index":11985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 96.0935 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.325,"smiles":null,"spectrum_id":"CCMSLIB00017229641","spectrum_index":11986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S-Hydroxy-9E,11Z,14Z-eicosatrienoic acid (delta mass: 34.0207 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.279,"smiles":null,"spectrum_id":"CCMSLIB00017229642","spectrum_index":11987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 162.9498 Da; putative annotation: N/A; putative formula: C3H2NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.998,"smiles":null,"spectrum_id":"CCMSLIB00017229645","spectrum_index":11988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 39.8959 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.983,"smiles":null,"spectrum_id":"CCMSLIB00017229646","spectrum_index":11989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 78.083 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.32,"smiles":null,"spectrum_id":"CCMSLIB00017229647","spectrum_index":11990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoacetophenone (delta mass: 10.0243 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.1,"smiles":null,"spectrum_id":"CCMSLIB00017229650","spectrum_index":11991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Abscisic acid (delta mass: 14.0151 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017229651","spectrum_index":11992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 84.0345 Da; putative annotation: N/A; putative formula: C8H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.141,"smiles":null,"spectrum_id":"CCMSLIB00017229653","spectrum_index":11993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 331.2745 Da; putative annotation: N/A; putative formula: C19H33N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.501,"smiles":null,"spectrum_id":"CCMSLIB00017229655","spectrum_index":11994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,3-DIAMINOPROPANE\"\" (delta mass: 27.0359 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":102.128,"smiles":null,"spectrum_id":"CCMSLIB00017229656","spectrum_index":11995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 311.2819 Da; putative annotation: N/A; putative formula: C19H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.373,"smiles":null,"spectrum_id":"CCMSLIB00017229658","spectrum_index":11996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 937.7116 Da; putative annotation: N/A; putative formula: C68H91NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1159.81,"smiles":null,"spectrum_id":"CCMSLIB00017229660","spectrum_index":11997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 158.0573 Da; putative annotation: N/A; putative formula: C7H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.098,"smiles":null,"spectrum_id":"CCMSLIB00017229663","spectrum_index":11998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 86.0003 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.232,"smiles":null,"spectrum_id":"CCMSLIB00017229664","spectrum_index":11999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 135.0882 Da; putative annotation: N/A; putative formula: C6H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.191,"smiles":null,"spectrum_id":"CCMSLIB00017229666","spectrum_index":12000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 291.1322 Da; putative annotation: N/A; putative formula: C12H21NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.192,"smiles":null,"spectrum_id":"CCMSLIB00017229668","spectrum_index":12001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(.beta.-D-Glucopyranosyloxy)-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid (delta mass: 162.0687 Da; putative annotation: 6-Ethyl-2,4-dihydroxy-3-methylbenzaldehyde; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.218,"smiles":null,"spectrum_id":"CCMSLIB00017229669","spectrum_index":12002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Pro from NIST14 (delta mass: 114.0784 Da; putative annotation: ORNITHINE; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.181,"smiles":null,"spectrum_id":"CCMSLIB00017229672","spectrum_index":12003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 106.0419 Da; putative annotation: Methylhydroquinone; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.123,"smiles":null,"spectrum_id":"CCMSLIB00017229673","spectrum_index":12004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 164.1576 Da; putative annotation: 1-(3,3-Dimethylbicyclo[2.2.1]hept-2-yl)-1-propanol; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.4,"smiles":null,"spectrum_id":"CCMSLIB00017229675","spectrum_index":12005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 147.0297 Da; putative annotation: 2-Hydroxy-3,4-dihydro-2H-1,4-benzoxazin-3-one; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.1,"smiles":null,"spectrum_id":"CCMSLIB00017229677","spectrum_index":12006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Val (delta mass: 184.1188 Da; putative annotation: Leu-Ala; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.3,"smiles":null,"spectrum_id":"CCMSLIB00017229679","spectrum_index":12007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 132.0933 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.315,"smiles":null,"spectrum_id":"CCMSLIB00017229681","spectrum_index":12008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ326305 Glycyrrhetinic Acid|18-beta-Glycyrrhetin acid|(2S,4aS,6aR,6aS,6bR,8aR,10S,12aS,14bR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic (delta mass: 108.0574 Da; putative annotation: 6-Heptynoic acid; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.404,"smiles":null,"spectrum_id":"CCMSLIB00017229682","spectrum_index":12009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 150.1047 Da; putative annotation: (+)-trans-Chrysanthemic acid; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.394,"smiles":null,"spectrum_id":"CCMSLIB00017229684","spectrum_index":12010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 174.0317 Da; putative annotation: 4-Methyl-6,7-dihydroxycoumarin; putative formula: C10H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.097,"smiles":null,"spectrum_id":"CCMSLIB00017229686","spectrum_index":12011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 262.155 Da; putative annotation: Brefeldin A; putative formula: C16H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.279,"smiles":null,"spectrum_id":"CCMSLIB00017229689","spectrum_index":12012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid (delta mass: 140.0839 Da; putative annotation: 2-((2R)-2-Hydroxycyclohexyl)acetic acid; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.175,"smiles":null,"spectrum_id":"CCMSLIB00017229690","spectrum_index":12013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(prolyltyrosyl) (delta mass: 196.1221 Da; putative annotation: Pro-Val; putative formula: C10H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.246,"smiles":null,"spectrum_id":"CCMSLIB00017229693","spectrum_index":12014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-6-Octadecenoic acid (delta mass: 281.2746 Da; putative annotation: Palmitoyl Ethanolamide; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.538,"smiles":null,"spectrum_id":"CCMSLIB00017229694","spectrum_index":12015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitoleoyl ethanolamide (delta mass: 418.2481 Da; putative annotation: 1-Oleoyl-L-.alpha.-lysophosphatidic acid; putative formula: C21H39O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.522,"smiles":null,"spectrum_id":"CCMSLIB00017229696","spectrum_index":12016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.165,"smiles":null,"spectrum_id":"CCMSLIB00017229698","spectrum_index":12017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 78.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.149,"smiles":null,"spectrum_id":"CCMSLIB00017229699","spectrum_index":12018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE (delta mass: 148.0734 Da; putative annotation: N/A; putative formula: C6H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.117,"smiles":null,"spectrum_id":"CCMSLIB00017229702","spectrum_index":12019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 118.0781 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.128,"smiles":null,"spectrum_id":"CCMSLIB00017229703","spectrum_index":12020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 318.2538 Da; putative annotation: N/A; putative formula: C17H30N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":823.43,"smiles":null,"spectrum_id":"CCMSLIB00017229705","spectrum_index":12021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 225.1211 Da; putative annotation: N/A; putative formula: C12H21NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.171,"smiles":null,"spectrum_id":"CCMSLIB00017229707","spectrum_index":12022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.-Hydroxyandrostenedione (delta mass: 160.1077 Da; putative annotation: N/A; putative formula: C4H12N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.303,"smiles":null,"spectrum_id":"CCMSLIB00017229708","spectrum_index":12023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 172.1304 Da; putative annotation: N/A; putative formula: C3H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.477,"smiles":null,"spectrum_id":"CCMSLIB00017229711","spectrum_index":12024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 158.0208 Da; putative annotation: N/A; putative formula: C3H-2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.112,"smiles":null,"spectrum_id":"CCMSLIB00017229712","spectrum_index":12025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .DELTA.2-Androstene-1.alpha.,17.beta.-diol acetate (delta mass: 78.0839 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017229714","spectrum_index":12026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 378.1438 Da; putative annotation: N/A; putative formula: C19H26N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.235,"smiles":null,"spectrum_id":"CCMSLIB00017229716","spectrum_index":12027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 316.2591 Da; putative annotation: N/A; putative formula: C22H36O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.491,"smiles":null,"spectrum_id":"CCMSLIB00017229717","spectrum_index":12028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 415.0383 Da; putative annotation: N/A; putative formula: C21H13N5O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.098,"smiles":null,"spectrum_id":"CCMSLIB00017229720","spectrum_index":12029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 27.9944 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.07,"smiles":null,"spectrum_id":"CCMSLIB00017229721","spectrum_index":12030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 389.2318 Da; putative annotation: N/A; putative formula: C21H31N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.297,"smiles":null,"spectrum_id":"CCMSLIB00017229723","spectrum_index":12031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 419.1865 Da; putative annotation: N/A; putative formula: C22H30NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.294,"smiles":null,"spectrum_id":"CCMSLIB00017229725","spectrum_index":12032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 306.0644 Da; putative annotation: N/A; putative formula: C10H18N4OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.286,"smiles":null,"spectrum_id":"CCMSLIB00017229727","spectrum_index":12033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 116.0299 Da; putative annotation: N/A; putative formula: C5H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.101,"smiles":null,"spectrum_id":"CCMSLIB00017229729","spectrum_index":12034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 88.0603 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.187,"smiles":null,"spectrum_id":"CCMSLIB00017229730","spectrum_index":12035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 537.3153 Da; putative annotation: N/A; putative formula: C28H48N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.386,"smiles":null,"spectrum_id":"CCMSLIB00017229733","spectrum_index":12036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of azelaic acid CollisionEnergy:102040 (delta mass: 320.2721 Da; putative annotation: N/A; putative formula: C21H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.384,"smiles":null,"spectrum_id":"CCMSLIB00017229734","spectrum_index":12037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 289.189 Da; putative annotation: N/A; putative formula: C14H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.26,"smiles":null,"spectrum_id":"CCMSLIB00017229736","spectrum_index":12038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 74.0366 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017229738","spectrum_index":12039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 76.0672 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017229739","spectrum_index":12040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 199.088 Da; putative annotation: N/A; putative formula: C8H14N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.304,"smiles":null,"spectrum_id":"CCMSLIB00017229742","spectrum_index":12041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2,5-Dioxohexahydroimidazo[4,5-d]imidazol-1(2H)-yl)-4-(methylsulfanyl)butanoic acid (delta mass: 18.0291 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.11,"smiles":null,"spectrum_id":"CCMSLIB00017229743","spectrum_index":12042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 198.061 Da; putative annotation: N/A; putative formula: C4H6N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.138,"smiles":null,"spectrum_id":"CCMSLIB00017229745","spectrum_index":12043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DIETHANOLAMINE (delta mass: 23.0152 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.102,"smiles":null,"spectrum_id":"CCMSLIB00017229747","spectrum_index":12044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 294.0943 Da; putative annotation: N/A; putative formula: C16H14N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.142,"smiles":null,"spectrum_id":"CCMSLIB00017229749","spectrum_index":12045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311023 Feruloyl O-methyldopamine (delta mass: 158.0418 Da; putative annotation: N/A; putative formula: C7H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.191,"smiles":null,"spectrum_id":"CCMSLIB00017229751","spectrum_index":12046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 241.0777 Da; putative annotation: N/A; putative formula: C11H15NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.201,"smiles":null,"spectrum_id":"CCMSLIB00017229752","spectrum_index":12047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 576.358 Da; putative annotation: N/A; putative formula: C33H53O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":903.487,"smiles":null,"spectrum_id":"CCMSLIB00017229755","spectrum_index":12048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380550-01_C24H40O5_4-{[5-(6-Hydroxy-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl)-3-methylpentyl]oxy}-4-oxobutanoic acid (delta mass: 408.2852 Da; putative annotation: N/A; putative formula: C28H40S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":817.58,"smiles":null,"spectrum_id":"CCMSLIB00017229756","spectrum_index":12049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 105.0416 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.289,"smiles":null,"spectrum_id":"CCMSLIB00017229758","spectrum_index":12050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Pyrrol-1-yl)piperidine (delta mass: 86.0371 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.16,"smiles":null,"spectrum_id":"CCMSLIB00017229760","spectrum_index":12051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 179.0878 Da; putative annotation: N/A; putative formula: C9H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.158,"smiles":null,"spectrum_id":"CCMSLIB00017229762","spectrum_index":12052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 204.2092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.306,"smiles":null,"spectrum_id":"CCMSLIB00017229764","spectrum_index":12053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.268,"smiles":null,"spectrum_id":"CCMSLIB00017229767","spectrum_index":12054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 71.0729 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.164,"smiles":null,"spectrum_id":"CCMSLIB00017229768","spectrum_index":12055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 317.2936 Da; putative annotation: N/A; putative formula: C19H35N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.541,"smiles":null,"spectrum_id":"CCMSLIB00017229771","spectrum_index":12056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017229772","spectrum_index":12057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-6-ethanamine, .alpha.-methyl- (delta mass: 43.0014 Da; putative annotation: N/A; putative formula: CH2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.124,"smiles":null,"spectrum_id":"CCMSLIB00017229774","spectrum_index":12058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 36.0366 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.196,"smiles":null,"spectrum_id":"CCMSLIB00017229776","spectrum_index":12059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 639.3112 Da; putative annotation: N/A; putative formula: C42H37N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.371,"smiles":null,"spectrum_id":"CCMSLIB00017229777","spectrum_index":12060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.alpha.)-2'H-Androst-2-eno[3,2-c]pyrazol-17-one (delta mass: 74.046 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.273,"smiles":null,"spectrum_id":"CCMSLIB00017229780","spectrum_index":12061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 222.0426 Da; putative annotation: N/A; putative formula: C5H10N4O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.145,"smiles":null,"spectrum_id":"CCMSLIB00017229781","spectrum_index":12062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 86.0002 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.164,"smiles":null,"spectrum_id":"CCMSLIB00017229784","spectrum_index":12063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Deoxy-12-hydroxyandrographolide (delta mass: 104.0617 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.278,"smiles":null,"spectrum_id":"CCMSLIB00017229785","spectrum_index":12064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 97.9853 Da; putative annotation: N/A; putative formula: CH-2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.089,"smiles":null,"spectrum_id":"CCMSLIB00017229787","spectrum_index":12065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Linoleoylglycerol from NIST14 (delta mass: 35.0339 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.318,"smiles":null,"spectrum_id":"CCMSLIB00017229789","spectrum_index":12066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 365.2883 Da; putative annotation: N/A; putative formula: C21H39N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.339,"smiles":null,"spectrum_id":"CCMSLIB00017229790","spectrum_index":12067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 750.2908 Da; putative annotation: N/A; putative formula: C34H42N10O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1009.41,"smiles":null,"spectrum_id":"CCMSLIB00017229793","spectrum_index":12068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 77.0267 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.102,"smiles":null,"spectrum_id":"CCMSLIB00017229794","spectrum_index":12069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 101.8369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.902,"smiles":null,"spectrum_id":"CCMSLIB00017229796","spectrum_index":12070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 45.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.107,"smiles":null,"spectrum_id":"CCMSLIB00017229798","spectrum_index":12071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ser-Lys (delta mass: 71.0732 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.271,"smiles":null,"spectrum_id":"CCMSLIB00017229799","spectrum_index":12072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 96.0557 Da; putative annotation: N/A; putative formula: C2H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.127,"smiles":null,"spectrum_id":"CCMSLIB00017229802","spectrum_index":12073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 68.0262 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.123,"smiles":null,"spectrum_id":"CCMSLIB00017229803","spectrum_index":12074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Hyodeoxycholic acid (delta mass: 64.0301 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.33,"smiles":null,"spectrum_id":"CCMSLIB00017229805","spectrum_index":12075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid (delta mass: 100.068 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.42,"smiles":null,"spectrum_id":"CCMSLIB00017229807","spectrum_index":12076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 54.0433 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.38,"smiles":null,"spectrum_id":"CCMSLIB00017229810","spectrum_index":12077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Hyodeoxycholic acid (delta mass: 82.0401 Da; putative annotation: N/A; putative formula: CH2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.34,"smiles":null,"spectrum_id":"CCMSLIB00017229811","spectrum_index":12078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycocholic acid (delta mass: 128.0937 Da; putative annotation: N/A; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.41,"smiles":null,"spectrum_id":"CCMSLIB00017229812","spectrum_index":12079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,24-Dihydroxyvitamin D3 (delta mass: 62.0535 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.39,"smiles":null,"spectrum_id":"CCMSLIB00017229815","spectrum_index":12080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 299.2829 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.494,"smiles":null,"spectrum_id":"CCMSLIB00017229816","spectrum_index":12081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Arachidonoylglycerol (delta mass: 110.0368 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.321,"smiles":null,"spectrum_id":"CCMSLIB00017229818","spectrum_index":12082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 267.1544 Da; putative annotation: N/A; putative formula: C18H22NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.36,"smiles":null,"spectrum_id":"CCMSLIB00017229820","spectrum_index":12083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Aminobenzoic acid (delta mass: 21.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.112,"smiles":null,"spectrum_id":"CCMSLIB00017229823","spectrum_index":12084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 271.1012 Da; putative annotation: N/A; putative formula: C7H17N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.198,"smiles":null,"spectrum_id":"CCMSLIB00017229824","spectrum_index":12085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 152.0686 Da; putative annotation: N/A; putative formula: C6H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.149,"smiles":null,"spectrum_id":"CCMSLIB00017229827","spectrum_index":12086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 127.0665 Da; putative annotation: N/A; putative formula: C5H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.121,"smiles":null,"spectrum_id":"CCMSLIB00017229828","spectrum_index":12087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid (delta mass: 276.0838 Da; putative annotation: N/A; putative formula: C16H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.451,"smiles":null,"spectrum_id":"CCMSLIB00017229829","spectrum_index":12088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 254.1368 Da; putative annotation: N/A; putative formula: C13H23N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.233,"smiles":null,"spectrum_id":"CCMSLIB00017229832","spectrum_index":12089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 43.0097 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.122,"smiles":null,"spectrum_id":"CCMSLIB00017229833","spectrum_index":12090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 144.0411 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.132,"smiles":null,"spectrum_id":"CCMSLIB00017229835","spectrum_index":12091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 111.0682 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.128,"smiles":null,"spectrum_id":"CCMSLIB00017229837","spectrum_index":12092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 85.0521 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.211,"smiles":null,"spectrum_id":"CCMSLIB00017229838","spectrum_index":12093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 179.0971 Da; putative annotation: N/A; putative formula: C9H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.172,"smiles":null,"spectrum_id":"CCMSLIB00017229841","spectrum_index":12094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 309.2667 Da; putative annotation: N/A; putative formula: C19H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.629,"smiles":null,"spectrum_id":"CCMSLIB00017229842","spectrum_index":12095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brassicasterol (delta mass: 297.2662 Da; putative annotation: N/A; putative formula: C18H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.628,"smiles":null,"spectrum_id":"CCMSLIB00017229844","spectrum_index":12096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.108,"smiles":null,"spectrum_id":"CCMSLIB00017229846","spectrum_index":12097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 70.0521 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.134,"smiles":null,"spectrum_id":"CCMSLIB00017229848","spectrum_index":12098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 455.2011 Da; putative annotation: N/A; putative formula: C29H30NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.238,"smiles":null,"spectrum_id":"CCMSLIB00017229850","spectrum_index":12099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxy-5-(hydroxymethyl)cyclohex-2-ene-1,4-diyl dibenzoate (delta mass: 402.248 Da; putative annotation: N/A; putative formula: C18H34N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":787.376,"smiles":null,"spectrum_id":"CCMSLIB00017229852","spectrum_index":12100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl syringate (delta mass: 74.0376 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.129,"smiles":null,"spectrum_id":"CCMSLIB00017229854","spectrum_index":12101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-11Z,13E-eicosadienoic acid (delta mass: 281.1838 Da; putative annotation: N/A; putative formula: C16H29NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.458,"smiles":null,"spectrum_id":"CCMSLIB00017229856","spectrum_index":12102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 168.0425 Da; putative annotation: N/A; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.166,"smiles":null,"spectrum_id":"CCMSLIB00017229858","spectrum_index":12103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Chlro-1-tetrahydronorharmanone CollisionEnergy:102040 (delta mass: 398.1308 Da; putative annotation: N/A; putative formula: C14H22N8O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.178,"smiles":null,"spectrum_id":"CCMSLIB00017229860","spectrum_index":12104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380192-01! (delta mass: 78.0099 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.248,"smiles":null,"spectrum_id":"CCMSLIB00017229861","spectrum_index":12105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 637.2851 Da; putative annotation: N/A; putative formula: C30H43N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.397,"smiles":null,"spectrum_id":"CCMSLIB00017229864","spectrum_index":12106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 59.0375 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.243,"smiles":null,"spectrum_id":"CCMSLIB00017229865","spectrum_index":12107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 93.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.124,"smiles":null,"spectrum_id":"CCMSLIB00017229867","spectrum_index":12108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 83.0731 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.154,"smiles":null,"spectrum_id":"CCMSLIB00017229869","spectrum_index":12109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 292.1453 Da; putative annotation: N/A; putative formula: C14H21N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.221,"smiles":null,"spectrum_id":"CCMSLIB00017229870","spectrum_index":12110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 260.0374 Da; putative annotation: N/A; putative formula: C19H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.092,"smiles":null,"spectrum_id":"CCMSLIB00017229873","spectrum_index":12111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.039,"smiles":null,"spectrum_id":"CCMSLIB00017229874","spectrum_index":12112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 173.3533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.409,"smiles":null,"spectrum_id":"CCMSLIB00017229876","spectrum_index":12113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300401 Cyclo-prolylglycine (delta mass: 144.0786 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.16,"smiles":null,"spectrum_id":"CCMSLIB00017229878","spectrum_index":12114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Ile (delta mass: 99.0673 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.253,"smiles":null,"spectrum_id":"CCMSLIB00017229879","spectrum_index":12115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 110.1091 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017229882","spectrum_index":12116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 126.1046 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.331,"smiles":null,"spectrum_id":"CCMSLIB00017229883","spectrum_index":12117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 118.1148 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.373,"smiles":null,"spectrum_id":"CCMSLIB00017229885","spectrum_index":12118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 104.0988 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.367,"smiles":null,"spectrum_id":"CCMSLIB00017229887","spectrum_index":12119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxykaurenolide (delta mass: 134.1099 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017229889","spectrum_index":12120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130140 (delta mass: 177.0428 Da; putative annotation: N/A; putative formula: C9H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.14,"smiles":null,"spectrum_id":"CCMSLIB00017229891","spectrum_index":12121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 261.1038 Da; putative annotation: N/A; putative formula: C11H19NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.174,"smiles":null,"spectrum_id":"CCMSLIB00017229893","spectrum_index":12122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-tridecylpiperidine (delta mass: 16.9424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.258,"smiles":null,"spectrum_id":"CCMSLIB00017229895","spectrum_index":12123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 69.0428 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.379,"smiles":null,"spectrum_id":"CCMSLIB00017229897","spectrum_index":12124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 96.0607 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.22,"smiles":null,"spectrum_id":"CCMSLIB00017229899","spectrum_index":12125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dehydrodocosahexaenoic acid (delta mass: 12.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.253,"smiles":null,"spectrum_id":"CCMSLIB00017229901","spectrum_index":12126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 87.0702 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.172,"smiles":null,"spectrum_id":"CCMSLIB00017229902","spectrum_index":12127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 65.0258 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017229905","spectrum_index":12128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Zymosterol from NIST14 (delta mass: 23.0158 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.362,"smiles":null,"spectrum_id":"CCMSLIB00017229906","spectrum_index":12129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 259.0459 Da; putative annotation: N/A; putative formula: C2H5N13OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.362,"smiles":null,"spectrum_id":"CCMSLIB00017229909","spectrum_index":12130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3,4-dimethoxyphenethyl)-1H-indole-3-carboxamide (delta mass: 162.0605 Da; putative annotation: N/A; putative formula: C10H11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.215,"smiles":null,"spectrum_id":"CCMSLIB00017229910","spectrum_index":12131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 300.4788 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.56,"smiles":null,"spectrum_id":"CCMSLIB00017229911","spectrum_index":12132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1178) (delta mass: 177.0074 Da; putative annotation: N/A; putative formula: C9H7NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.162,"smiles":null,"spectrum_id":"CCMSLIB00017229914","spectrum_index":12133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 9.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.171,"smiles":null,"spectrum_id":"CCMSLIB00017229915","spectrum_index":12134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.091,"smiles":null,"spectrum_id":"CCMSLIB00017229918","spectrum_index":12135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 115.0114 Da; putative annotation: N/A; putative formula: C4H7NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.092,"smiles":null,"spectrum_id":"CCMSLIB00017229919","spectrum_index":12136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 154.0809 Da; putative annotation: N/A; putative formula: C9H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.141,"smiles":null,"spectrum_id":"CCMSLIB00017229921","spectrum_index":12137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 129.0433 Da; putative annotation: N/A; putative formula: C6H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.093,"smiles":null,"spectrum_id":"CCMSLIB00017229923","spectrum_index":12138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 142.1144 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.185,"smiles":null,"spectrum_id":"CCMSLIB00017229924","spectrum_index":12139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 288.2082 Da; putative annotation: N/A; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.332,"smiles":null,"spectrum_id":"CCMSLIB00017229927","spectrum_index":12140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 260.0889 Da; putative annotation: N/A; putative formula: C15H18P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.264,"smiles":null,"spectrum_id":"CCMSLIB00017229928","spectrum_index":12141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 148.1258 Da; putative annotation: N/A; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.337,"smiles":null,"spectrum_id":"CCMSLIB00017229929","spectrum_index":12142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.092,"smiles":null,"spectrum_id":"CCMSLIB00017229932","spectrum_index":12143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 144.1327 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.37,"smiles":null,"spectrum_id":"CCMSLIB00017229933","spectrum_index":12144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 469.3268 Da; putative annotation: N/A; putative formula: C23H43N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.366,"smiles":null,"spectrum_id":"CCMSLIB00017229935","spectrum_index":12145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 132.9979 Da; putative annotation: N/A; putative formula: C7H3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.084,"smiles":null,"spectrum_id":"CCMSLIB00017229937","spectrum_index":12146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 713.3844 Da; putative annotation: N/A; putative formula: C43H56NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.455,"smiles":null,"spectrum_id":"CCMSLIB00017229938","spectrum_index":12147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 111.0322 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.118,"smiles":null,"spectrum_id":"CCMSLIB00017229941","spectrum_index":12148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Oxyclozapine (delta mass: 56.1134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.245,"smiles":null,"spectrum_id":"CCMSLIB00017229942","spectrum_index":12149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 309.1689 Da; putative annotation: N/A; putative formula: C15H23N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.25,"smiles":null,"spectrum_id":"CCMSLIB00017229944","spectrum_index":12150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 60.0402 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.089,"smiles":null,"spectrum_id":"CCMSLIB00017229946","spectrum_index":12151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Protopanaxadiol (delta mass: 239.0983 Da; putative annotation: N/A; putative formula: C12H17NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.497,"smiles":null,"spectrum_id":"CCMSLIB00017229948","spectrum_index":12152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-4-nitronbenzoyl homoveratrylamine (delta mass: 56.066 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.195,"smiles":null,"spectrum_id":"CCMSLIB00017229950","spectrum_index":12153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-5Z,8Z,11Z,13E,17Z-eicosapentaenoic acid (delta mass: 34.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.28,"smiles":null,"spectrum_id":"CCMSLIB00017229951","spectrum_index":12154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lupeol (delta mass: 58.0419 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.435,"smiles":null,"spectrum_id":"CCMSLIB00017229954","spectrum_index":12155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 35.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.279,"smiles":null,"spectrum_id":"CCMSLIB00017229955","spectrum_index":12156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 85.0048 Da; putative annotation: N/A; putative formula: C5H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017229956","spectrum_index":12157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 583.4745 Da; putative annotation: N/A; putative formula: C41H61NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.55,"smiles":null,"spectrum_id":"CCMSLIB00017229959","spectrum_index":12158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 35.9769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.209,"smiles":null,"spectrum_id":"CCMSLIB00017229960","spectrum_index":12159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 43.0416 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.211,"smiles":null,"spectrum_id":"CCMSLIB00017229963","spectrum_index":12160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 63.0675 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.315,"smiles":null,"spectrum_id":"CCMSLIB00017229964","spectrum_index":12161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 241.2041 Da; putative annotation: N/A; putative formula: C14H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.307,"smiles":null,"spectrum_id":"CCMSLIB00017229965","spectrum_index":12162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 197.0689 Da; putative annotation: N/A; putative formula: C9H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.129,"smiles":null,"spectrum_id":"CCMSLIB00017229968","spectrum_index":12163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 215.1887 Da; putative annotation: N/A; putative formula: C12H25NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.249,"smiles":null,"spectrum_id":"CCMSLIB00017229969","spectrum_index":12164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 34.9385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.02,"smiles":null,"spectrum_id":"CCMSLIB00017229972","spectrum_index":12165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 39.994 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.226,"smiles":null,"spectrum_id":"CCMSLIB00017229973","spectrum_index":12166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decahydronaphthalene-2-carboxylic acid (delta mass: 62.0188 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.157,"smiles":null,"spectrum_id":"CCMSLIB00017229976","spectrum_index":12167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydro-3-furanylmethanol (delta mass: 24.0001 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.076,"smiles":null,"spectrum_id":"CCMSLIB00017229977","spectrum_index":12168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 25(S)-26-Hydroxycholesterol (delta mass: 140.1021 Da; putative annotation: N/A; putative formula: C9H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.459,"smiles":null,"spectrum_id":"CCMSLIB00017229980","spectrum_index":12169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 237.1207 Da; putative annotation: N/A; putative formula: C9H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.306,"smiles":null,"spectrum_id":"CCMSLIB00017229981","spectrum_index":12170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 661.4918 Da; putative annotation: N/A; putative formula: C39H67NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":956.719,"smiles":null,"spectrum_id":"CCMSLIB00017229982","spectrum_index":12171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 108.9898 Da; putative annotation: N/A; putative formula: C3H-1N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.504,"smiles":null,"spectrum_id":"CCMSLIB00017229985","spectrum_index":12172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 103.0249 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.194,"smiles":null,"spectrum_id":"CCMSLIB00017229986","spectrum_index":12173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dioxa-4,10-diazacyclododecane (delta mass: 19.0159 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.16,"smiles":null,"spectrum_id":"CCMSLIB00017229988","spectrum_index":12174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-pentyl- (delta mass: 11.9999 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017229990","spectrum_index":12175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 233.0897 Da; putative annotation: N/A; putative formula: C9H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.129,"smiles":null,"spectrum_id":"CCMSLIB00017229991","spectrum_index":12176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-N-(2-pyridinylmethyl)-1H-indole-3-carboxamide (delta mass: 117.0422 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.171,"smiles":null,"spectrum_id":"CCMSLIB00017229994","spectrum_index":12177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 25.0315 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.123,"smiles":null,"spectrum_id":"CCMSLIB00017229995","spectrum_index":12178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-C20:5 (delta mass: 110.0574 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.326,"smiles":null,"spectrum_id":"CCMSLIB00017229998","spectrum_index":12179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 27.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.145,"smiles":null,"spectrum_id":"CCMSLIB00017229999","spectrum_index":12180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indolepropionic acid (delta mass: 18.0125 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.099,"smiles":null,"spectrum_id":"CCMSLIB00017230001","spectrum_index":12181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 56.0514 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.118,"smiles":null,"spectrum_id":"CCMSLIB00017230003","spectrum_index":12182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 10.9721 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.048,"smiles":null,"spectrum_id":"CCMSLIB00017230004","spectrum_index":12183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nicotinamide N-oxide (delta mass: 78.0563 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017230007","spectrum_index":12184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 104.0107 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017230008","spectrum_index":12185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 1247.0812 Da; putative annotation: N/A; putative formula: C84H142O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1385.17,"smiles":null,"spectrum_id":"CCMSLIB00017230011","spectrum_index":12186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 45.5151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.596,"smiles":null,"spectrum_id":"CCMSLIB00017230012","spectrum_index":12187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 250.1796 Da; putative annotation: N/A; putative formula: C13H22N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.255,"smiles":null,"spectrum_id":"CCMSLIB00017230013","spectrum_index":12188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 379.2222 Da; putative annotation: N/A; putative formula: C18H29N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.298,"smiles":null,"spectrum_id":"CCMSLIB00017230016","spectrum_index":12189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 45.0662 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.144,"smiles":null,"spectrum_id":"CCMSLIB00017230017","spectrum_index":12190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 131.1003 Da; putative annotation: N/A; putative formula: C5H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.277,"smiles":null,"spectrum_id":"CCMSLIB00017230019","spectrum_index":12191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cannabidiolic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.217,"smiles":null,"spectrum_id":"CCMSLIB00017230021","spectrum_index":12192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU249104 2-Hydroxyquinoline|1H-quinolin-2-one (delta mass: 44.0612 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.121,"smiles":null,"spectrum_id":"CCMSLIB00017230023","spectrum_index":12193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 52.0348 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.241,"smiles":null,"spectrum_id":"CCMSLIB00017230025","spectrum_index":12194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 628.2837 Da; putative annotation: N/A; putative formula: C42H36N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.349,"smiles":null,"spectrum_id":"CCMSLIB00017230026","spectrum_index":12195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 230.1268 Da; putative annotation: N/A; putative formula: C10H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.213,"smiles":null,"spectrum_id":"CCMSLIB00017230029","spectrum_index":12196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxymorphinan (delta mass: 109.0563 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.226,"smiles":null,"spectrum_id":"CCMSLIB00017230030","spectrum_index":12197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 169.0606 Da; putative annotation: N/A; putative formula: C5H7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.165,"smiles":null,"spectrum_id":"CCMSLIB00017230033","spectrum_index":12198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 187.1159 Da; putative annotation: N/A; putative formula: C8H17N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.218,"smiles":null,"spectrum_id":"CCMSLIB00017230034","spectrum_index":12199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 28.0311 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.227,"smiles":null,"spectrum_id":"CCMSLIB00017230035","spectrum_index":12200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 176.9577 Da; putative annotation: N/A; putative formula: C4H7NO-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.044,"smiles":null,"spectrum_id":"CCMSLIB00017230038","spectrum_index":12201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 170.037 Da; putative annotation: N/A; putative formula: C11H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.405,"smiles":null,"spectrum_id":"CCMSLIB00017230039","spectrum_index":12202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 49.0536 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.134,"smiles":null,"spectrum_id":"CCMSLIB00017230042","spectrum_index":12203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.05,"smiles":null,"spectrum_id":"CCMSLIB00017230043","spectrum_index":12204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Wikstromol (delta mass: 179.0768 Da; putative annotation: N/A; putative formula: C10H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.221,"smiles":null,"spectrum_id":"CCMSLIB00017230045","spectrum_index":12205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 293.2731 Da; putative annotation: N/A; putative formula: C19H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.516,"smiles":null,"spectrum_id":"CCMSLIB00017230047","spectrum_index":12206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 43.99 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.038,"smiles":null,"spectrum_id":"CCMSLIB00017230049","spectrum_index":12207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 31.1218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017230051","spectrum_index":12208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 128.0473 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017230053","spectrum_index":12209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 43.0427 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017230055","spectrum_index":12210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 102.068 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.227,"smiles":null,"spectrum_id":"CCMSLIB00017230057","spectrum_index":12211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 47.0589 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.16,"smiles":null,"spectrum_id":"CCMSLIB00017230059","spectrum_index":12212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP012803 Benzoic acid (delta mass: 72.0564 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.1,"smiles":null,"spectrum_id":"CCMSLIB00017230060","spectrum_index":12213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 453.2113 Da; putative annotation: N/A; putative formula: C24H40NO-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.334,"smiles":null,"spectrum_id":"CCMSLIB00017230063","spectrum_index":12214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kawainol (delta mass: 84.0171 Da; putative annotation: N/A; putative formula: N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.114,"smiles":null,"spectrum_id":"CCMSLIB00017230064","spectrum_index":12215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,4-Difluorophenyl)-6,7-dimethyl-3,4-dihydro-2(1H)-quinolinone (delta mass: 18.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.134,"smiles":null,"spectrum_id":"CCMSLIB00017230066","spectrum_index":12216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 105.0141 Da; putative annotation: N/A; putative formula: C6H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.053,"smiles":null,"spectrum_id":"CCMSLIB00017230068","spectrum_index":12217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 50.0 eV (delta mass: 114.0681 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.17,"smiles":null,"spectrum_id":"CCMSLIB00017230070","spectrum_index":12218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chaulmoogric Acid (delta mass: 63.0335 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.281,"smiles":null,"spectrum_id":"CCMSLIB00017230072","spectrum_index":12219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 294.2181 Da; putative annotation: N/A; putative formula: C14H26N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.357,"smiles":null,"spectrum_id":"CCMSLIB00017230074","spectrum_index":12220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 290.2245 Da; putative annotation: N/A; putative formula: C19H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.295,"smiles":null,"spectrum_id":"CCMSLIB00017230076","spectrum_index":12221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 264.2468 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.3,"smiles":null,"spectrum_id":"CCMSLIB00017230078","spectrum_index":12222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 48.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.092,"smiles":null,"spectrum_id":"CCMSLIB00017230080","spectrum_index":12223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 160.1101 Da; putative annotation: N/A; putative formula: C8H16O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.17,"smiles":null,"spectrum_id":"CCMSLIB00017230082","spectrum_index":12224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 181.0479 Da; putative annotation: N/A; putative formula: C9H12NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.124,"smiles":null,"spectrum_id":"CCMSLIB00017230084","spectrum_index":12225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 207.0212 Da; putative annotation: N/A; putative formula: C7H13NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.081,"smiles":null,"spectrum_id":"CCMSLIB00017230086","spectrum_index":12226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 57.0171 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.044,"smiles":null,"spectrum_id":"CCMSLIB00017230087","spectrum_index":12227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 47.0091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017230090","spectrum_index":12228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8(9)-Epoxy-5Z,11Z,14Z,17Z-eicosatetraenoic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017230091","spectrum_index":12229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.05,"smiles":null,"spectrum_id":"CCMSLIB00017230093","spectrum_index":12230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 169.0734 Da; putative annotation: N/A; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.165,"smiles":null,"spectrum_id":"CCMSLIB00017230095","spectrum_index":12231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 347.122 Da; putative annotation: N/A; putative formula: C17H22N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.193,"smiles":null,"spectrum_id":"CCMSLIB00017230096","spectrum_index":12232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 177.1079 Da; putative annotation: N/A; putative formula: C11H16NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.215,"smiles":null,"spectrum_id":"CCMSLIB00017230099","spectrum_index":12233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 77.0293 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.164,"smiles":null,"spectrum_id":"CCMSLIB00017230100","spectrum_index":12234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3,5-dihydroxybenzoate (delta mass: 28.0306 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017230101","spectrum_index":12235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 15.0437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.146,"smiles":null,"spectrum_id":"CCMSLIB00017230104","spectrum_index":12236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 76.0675 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017230105","spectrum_index":12237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 171.1624 Da; putative annotation: N/A; putative formula: C10H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.269,"smiles":null,"spectrum_id":"CCMSLIB00017230108","spectrum_index":12238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311155 Vanillic acid (not validated) (delta mass: 164.1169 Da; putative annotation: N/A; putative formula: C11H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.182,"smiles":null,"spectrum_id":"CCMSLIB00017230109","spectrum_index":12239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Threonine (delta mass: 224.1782 Da; putative annotation: N/A; putative formula: C14H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.244,"smiles":null,"spectrum_id":"CCMSLIB00017230112","spectrum_index":12240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.201,"smiles":null,"spectrum_id":"CCMSLIB00017230113","spectrum_index":12241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301587 Harmol (delta mass: 247.0941 Da; putative annotation: N/A; putative formula: C14H18NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.181,"smiles":null,"spectrum_id":"CCMSLIB00017230115","spectrum_index":12242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017230117","spectrum_index":12243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 118.0266 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017230119","spectrum_index":12244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 25.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.144,"smiles":null,"spectrum_id":"CCMSLIB00017230121","spectrum_index":12245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholesterol (delta mass: 88.0679 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.43,"smiles":null,"spectrum_id":"CCMSLIB00017230122","spectrum_index":12246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 78.0471 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.295,"smiles":null,"spectrum_id":"CCMSLIB00017230124","spectrum_index":12247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 100.0677 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.295,"smiles":null,"spectrum_id":"CCMSLIB00017230126","spectrum_index":12248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rostafuroxin (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.316,"smiles":null,"spectrum_id":"CCMSLIB00017230127","spectrum_index":12249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rhinocerotinoic acid (delta mass: 66.0466 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.273,"smiles":null,"spectrum_id":"CCMSLIB00017230130","spectrum_index":12250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-15-ketoprostaglandin D1 (delta mass: 168.0938 Da; putative annotation: N/A; putative formula: C13H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.342,"smiles":null,"spectrum_id":"CCMSLIB00017230131","spectrum_index":12251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyloxy-8-(3-oxo-2-pent-2-enylcyclopenten-1-yl)octanoic acid (delta mass: 116.0656 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.282,"smiles":null,"spectrum_id":"CCMSLIB00017230133","spectrum_index":12252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 633.1602 Da; putative annotation: N/A; putative formula: C32H31N3O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.201,"smiles":null,"spectrum_id":"CCMSLIB00017230135","spectrum_index":12253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 910.6868 Da; putative annotation: N/A; putative formula: C52H90N6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1048.78,"smiles":null,"spectrum_id":"CCMSLIB00017230136","spectrum_index":12254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 118.0778 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.3,"smiles":null,"spectrum_id":"CCMSLIB00017230139","spectrum_index":12255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 520.3606 Da; putative annotation: N/A; putative formula: C27H52O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.598,"smiles":null,"spectrum_id":"CCMSLIB00017230140","spectrum_index":12256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 506.3813 Da; putative annotation: N/A; putative formula: C32H50N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":819.619,"smiles":null,"spectrum_id":"CCMSLIB00017230141","spectrum_index":12257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 73.0165 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.092,"smiles":null,"spectrum_id":"CCMSLIB00017230144","spectrum_index":12258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 97.9668 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.23,"smiles":null,"spectrum_id":"CCMSLIB00017230145","spectrum_index":12259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 63.998 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.246,"smiles":null,"spectrum_id":"CCMSLIB00017230147","spectrum_index":12260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 14.016 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.248,"smiles":null,"spectrum_id":"CCMSLIB00017230149","spectrum_index":12261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 50.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.279,"smiles":null,"spectrum_id":"CCMSLIB00017230150","spectrum_index":12262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(6-methyl-6-azabicyclo[4.4.0]dec-2-yl)methyl 3-aminopropanoate, iodide CollisionEnergy:205060\"\" (delta mass: 112.0754 Da; putative annotation: N/A; putative formula: C4H8N4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.282,"smiles":null,"spectrum_id":"CCMSLIB00017230153","spectrum_index":12263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 30.0341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":102.115,"smiles":null,"spectrum_id":"CCMSLIB00017230154","spectrum_index":12264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 85.0015 Da; putative annotation: N/A; putative formula: H-1N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.098,"smiles":null,"spectrum_id":"CCMSLIB00017230156","spectrum_index":12265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 538.7057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.787,"smiles":null,"spectrum_id":"CCMSLIB00017230158","spectrum_index":12266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl hydrogen malonate (delta mass: 331.1984 Da; putative annotation: N/A; putative formula: C20H31NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.248,"smiles":null,"spectrum_id":"CCMSLIB00017230160","spectrum_index":12267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Methyl-3-oxo-2,5,6,7,8,8a-hexahydro-1H-naphthalen-1-yl)propanoic acid (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.17,"smiles":null,"spectrum_id":"CCMSLIB00017230162","spectrum_index":12268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.253,"smiles":null,"spectrum_id":"CCMSLIB00017230164","spectrum_index":12269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 289.1728 Da; putative annotation: N/A; putative formula: C15H23N5O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.243,"smiles":null,"spectrum_id":"CCMSLIB00017230166","spectrum_index":12270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylpentadecanoic acid (delta mass: 84.1032 Da; putative annotation: N/A; putative formula: C5H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.351,"smiles":null,"spectrum_id":"CCMSLIB00017230168","spectrum_index":12271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 440.1831 Da; putative annotation: N/A; putative formula: C20H33N4OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.243,"smiles":null,"spectrum_id":"CCMSLIB00017230169","spectrum_index":12272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 547.3353 Da; putative annotation: N/A; putative formula: C40H41N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.552,"smiles":null,"spectrum_id":"CCMSLIB00017230170","spectrum_index":12273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3r,5r,7r)-Adamantan-1-yl)piperidine (delta mass: 30.9942 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.2,"smiles":null,"spectrum_id":"CCMSLIB00017230173","spectrum_index":12274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 83.1091 Da; putative annotation: N/A; putative formula: C6H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.289,"smiles":null,"spectrum_id":"CCMSLIB00017230174","spectrum_index":12275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 79.9888 Da; putative annotation: N/A; putative formula: C4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.127,"smiles":null,"spectrum_id":"CCMSLIB00017230177","spectrum_index":12276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Acetyl-16alpha-hydroxytrametenolic acid (delta mass: 184.1238 Da; putative annotation: N/A; putative formula: C8H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.497,"smiles":null,"spectrum_id":"CCMSLIB00017230178","spectrum_index":12277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 97.0528 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.176,"smiles":null,"spectrum_id":"CCMSLIB00017230181","spectrum_index":12278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 68.0615 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.293,"smiles":null,"spectrum_id":"CCMSLIB00017230182","spectrum_index":12279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Di(2-naphthyl)amine (delta mass: 136.1202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.248,"smiles":null,"spectrum_id":"CCMSLIB00017230183","spectrum_index":12280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 63.0725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.217,"smiles":null,"spectrum_id":"CCMSLIB00017230186","spectrum_index":12281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 104.0474 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.108,"smiles":null,"spectrum_id":"CCMSLIB00017230187","spectrum_index":12282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 50.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017230190","spectrum_index":12283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 108.0945 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.358,"smiles":null,"spectrum_id":"CCMSLIB00017230191","spectrum_index":12284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 200.1119 Da; putative annotation: N/A; putative formula: C14H17O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.37,"smiles":null,"spectrum_id":"CCMSLIB00017230192","spectrum_index":12285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Pregnen-17.alpha., 20.alpha.-diol-3-one (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.3,"smiles":null,"spectrum_id":"CCMSLIB00017230195","spectrum_index":12286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 196.9922 Da; putative annotation: N/A; putative formula: C3H7N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.064,"smiles":null,"spectrum_id":"CCMSLIB00017230196","spectrum_index":12287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 628.1032 Da; putative annotation: N/A; putative formula: C31H28N6O-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":794.226,"smiles":null,"spectrum_id":"CCMSLIB00017230198","spectrum_index":12288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyacetophenone (delta mass: 43.0185 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.078,"smiles":null,"spectrum_id":"CCMSLIB00017230200","spectrum_index":12289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 490.1226 Da; putative annotation: N/A; putative formula: C15H30N4O8S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.246,"smiles":null,"spectrum_id":"CCMSLIB00017230201","spectrum_index":12290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 342.0978 Da; putative annotation: N/A; putative formula: C17H10N8O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.215,"smiles":null,"spectrum_id":"CCMSLIB00017230204","spectrum_index":12291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 15.9945 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.336,"smiles":null,"spectrum_id":"CCMSLIB00017230205","spectrum_index":12292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 115.9874 Da; putative annotation: N/A; putative formula: C3H4N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.136,"smiles":null,"spectrum_id":"CCMSLIB00017230208","spectrum_index":12293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 260.2717 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.347,"smiles":null,"spectrum_id":"CCMSLIB00017230209","spectrum_index":12294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 435.1313 Da; putative annotation: N/A; putative formula: C16H25N3O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":940.308,"smiles":null,"spectrum_id":"CCMSLIB00017230211","spectrum_index":12295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 14.9996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.066,"smiles":null,"spectrum_id":"CCMSLIB00017230213","spectrum_index":12296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 172.1245 Da; putative annotation: N/A; putative formula: C7H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017230215","spectrum_index":12297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 56.0254 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.294,"smiles":null,"spectrum_id":"CCMSLIB00017230217","spectrum_index":12298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 27.0051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.104,"smiles":null,"spectrum_id":"CCMSLIB00017230219","spectrum_index":12299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 9.0003 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.107,"smiles":null,"spectrum_id":"CCMSLIB00017230220","spectrum_index":12300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 74.8609 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.072,"smiles":null,"spectrum_id":"CCMSLIB00017230223","spectrum_index":12301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ergocalciferol CollisionEnergy:102040 (delta mass: 29.9733 Da; putative annotation: N/A; putative formula: H-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017230224","spectrum_index":12302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 40.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017230226","spectrum_index":12303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 94.0779 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.289,"smiles":null,"spectrum_id":"CCMSLIB00017230228","spectrum_index":12304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 246.1864 Da; putative annotation: N/A; putative formula: C12H27N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.466,"smiles":null,"spectrum_id":"CCMSLIB00017230229","spectrum_index":12305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 68.9265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.013,"smiles":null,"spectrum_id":"CCMSLIB00017230232","spectrum_index":12306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 46.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.18,"smiles":null,"spectrum_id":"CCMSLIB00017230233","spectrum_index":12307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 139.0601 Da; putative annotation: N/A; putative formula: C3H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.146,"smiles":null,"spectrum_id":"CCMSLIB00017230234","spectrum_index":12308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 265.0587 Da; putative annotation: N/A; putative formula: C12H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.15,"smiles":null,"spectrum_id":"CCMSLIB00017230237","spectrum_index":12309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.242,"smiles":null,"spectrum_id":"CCMSLIB00017230238","spectrum_index":12310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 228.1362 Da; putative annotation: N/A; putative formula: C12H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.175,"smiles":null,"spectrum_id":"CCMSLIB00017230241","spectrum_index":12311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 413.3498 Da; putative annotation: N/A; putative formula: C24H47NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.41,"smiles":null,"spectrum_id":"CCMSLIB00017230242","spectrum_index":12312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 757.976 Da; putative annotation: N/A; putative formula: C29H18N4O13S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":980.073,"smiles":null,"spectrum_id":"CCMSLIB00017230244","spectrum_index":12313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 662.6247 Da; putative annotation: N/A; putative formula: C41H82N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":884.722,"smiles":null,"spectrum_id":"CCMSLIB00017230246","spectrum_index":12314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-5-Phenylpent-2-enoic acid (delta mass: 79.9662 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.057,"smiles":null,"spectrum_id":"CCMSLIB00017230248","spectrum_index":12315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 44.0261 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.107,"smiles":null,"spectrum_id":"CCMSLIB00017230250","spectrum_index":12316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 37.0314 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.123,"smiles":null,"spectrum_id":"CCMSLIB00017230252","spectrum_index":12317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 8.0048 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.08,"smiles":null,"spectrum_id":"CCMSLIB00017230253","spectrum_index":12318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Azepan-1-ylaniline (delta mass: 163.889 Da; putative annotation: N/A; putative formula: C3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.043,"smiles":null,"spectrum_id":"CCMSLIB00017230255","spectrum_index":12319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 80.0624 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.16,"smiles":null,"spectrum_id":"CCMSLIB00017230257","spectrum_index":12320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 146.0931 Da; putative annotation: N/A; putative formula: C7H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.309,"smiles":null,"spectrum_id":"CCMSLIB00017230258","spectrum_index":12321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 88.0532 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.28,"smiles":null,"spectrum_id":"CCMSLIB00017230261","spectrum_index":12322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12,13-Dihydroxy-9Z-octadecenoic acid (delta mass: 350.2679 Da; putative annotation: N/A; putative formula: C19H34N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.521,"smiles":null,"spectrum_id":"CCMSLIB00017230262","spectrum_index":12323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310786 Glutamyl-S-(C4H7O2)-cysteinylglycine (delta mass: 342.1183 Da; putative annotation: N/A; putative formula: C13H28O4P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.246,"smiles":null,"spectrum_id":"CCMSLIB00017230265","spectrum_index":12324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 584.3023 Da; putative annotation: N/A; putative formula: C24H51N4O6P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.373,"smiles":null,"spectrum_id":"CCMSLIB00017230266","spectrum_index":12325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomopsidin (delta mass: 86.051 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.278,"smiles":null,"spectrum_id":"CCMSLIB00017230268","spectrum_index":12326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 194.058 Da; putative annotation: N/A; putative formula: C10H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.191,"smiles":null,"spectrum_id":"CCMSLIB00017230270","spectrum_index":12327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-methoxy-3-phenyl-1H-indole-2-carboxylate (delta mass: 64.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.181,"smiles":null,"spectrum_id":"CCMSLIB00017230271","spectrum_index":12328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 236.0897 Da; putative annotation: N/A; putative formula: C9H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.322,"smiles":null,"spectrum_id":"CCMSLIB00017230274","spectrum_index":12329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 28.9765 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.078,"smiles":null,"spectrum_id":"CCMSLIB00017230275","spectrum_index":12330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 357.1421 Da; putative annotation: N/A; putative formula: C16H23NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.307,"smiles":null,"spectrum_id":"CCMSLIB00017230277","spectrum_index":12331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olodaterol (delta mass: 350.1638 Da; putative annotation: N/A; putative formula: C14H22N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.355,"smiles":null,"spectrum_id":"CCMSLIB00017230279","spectrum_index":12332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 439.1965 Da; putative annotation: N/A; putative formula: C21H33N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.323,"smiles":null,"spectrum_id":"CCMSLIB00017230281","spectrum_index":12333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 85.9998 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.216,"smiles":null,"spectrum_id":"CCMSLIB00017230283","spectrum_index":12334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 646.671 Da; putative annotation: N/A; putative formula: C39H82N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.762,"smiles":null,"spectrum_id":"CCMSLIB00017230285","spectrum_index":12335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 391.1222 Da; putative annotation: N/A; putative formula: C27H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.229,"smiles":null,"spectrum_id":"CCMSLIB00017230286","spectrum_index":12336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 333.287 Da; putative annotation: N/A; putative formula: C22H39NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.514,"smiles":null,"spectrum_id":"CCMSLIB00017230289","spectrum_index":12337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 298.2098 Da; putative annotation: N/A; putative formula: C16H32N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.311,"smiles":null,"spectrum_id":"CCMSLIB00017230290","spectrum_index":12338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 397.2296 Da; putative annotation: N/A; putative formula: C14H27N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.295,"smiles":null,"spectrum_id":"CCMSLIB00017230292","spectrum_index":12339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 98.0734 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017230294","spectrum_index":12340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 73.0889 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.143,"smiles":null,"spectrum_id":"CCMSLIB00017230295","spectrum_index":12341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 68.0629 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017230298","spectrum_index":12342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 119.0958 Da; putative annotation: N/A; putative formula: CH9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.343,"smiles":null,"spectrum_id":"CCMSLIB00017230299","spectrum_index":12343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Usnic acid (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.108,"smiles":null,"spectrum_id":"CCMSLIB00017230300","spectrum_index":12344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 101.0724 Da; putative annotation: N/A; putative formula: C2H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.258,"smiles":null,"spectrum_id":"CCMSLIB00017230303","spectrum_index":12345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 39.1111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.207,"smiles":null,"spectrum_id":"CCMSLIB00017230304","spectrum_index":12346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 48.0361 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017230307","spectrum_index":12347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-4,10-Dimethylidene-7-propan-2-ylcyclodec-5-en-1-ol (delta mass: 469.1048 Da; putative annotation: N/A; putative formula: C23H24N3O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.295,"smiles":null,"spectrum_id":"CCMSLIB00017230308","spectrum_index":12348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 106.0173 Da; putative annotation: N/A; putative formula: C5H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.129,"smiles":null,"spectrum_id":"CCMSLIB00017230309","spectrum_index":12349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 86.0365 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017230312","spectrum_index":12350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 10.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.096,"smiles":null,"spectrum_id":"CCMSLIB00017230313","spectrum_index":12351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzoic acid (delta mass: 71.035 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.069,"smiles":null,"spectrum_id":"CCMSLIB00017230315","spectrum_index":12352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Deoxy-.DELTA.12,14-prostaglandin D2 (delta mass: 91.0583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.28,"smiles":null,"spectrum_id":"CCMSLIB00017230317","spectrum_index":12353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 82.0822 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.158,"smiles":null,"spectrum_id":"CCMSLIB00017230318","spectrum_index":12354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 409.1631 Da; putative annotation: N/A; putative formula: C14H27N5O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.27,"smiles":null,"spectrum_id":"CCMSLIB00017230321","spectrum_index":12355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methylquinolin-2(1H)-one (delta mass: 149.1801 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.256,"smiles":null,"spectrum_id":"CCMSLIB00017230322","spectrum_index":12356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 405.2883 Da; putative annotation: N/A; putative formula: C19H36N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.496,"smiles":null,"spectrum_id":"CCMSLIB00017230323","spectrum_index":12357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mononervonin (15c) (delta mass: 120.0936 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.487,"smiles":null,"spectrum_id":"CCMSLIB00017230326","spectrum_index":12358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroxyxanthopterin B2 (delta mass: 222.0746 Da; putative annotation: N/A; putative formula: C9H18O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.157,"smiles":null,"spectrum_id":"CCMSLIB00017230327","spectrum_index":12359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 14.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.101,"smiles":null,"spectrum_id":"CCMSLIB00017230330","spectrum_index":12360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 94.0778 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.425,"smiles":null,"spectrum_id":"CCMSLIB00017230331","spectrum_index":12361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycoursodeoxycholic acid (delta mass: 176.1086 Da; putative annotation: N/A; putative formula: C7H17N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.43,"smiles":null,"spectrum_id":"CCMSLIB00017230332","spectrum_index":12362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 310.2884 Da; putative annotation: N/A; putative formula: C20H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":903.564,"smiles":null,"spectrum_id":"CCMSLIB00017230335","spectrum_index":12363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 490.315 Da; putative annotation: N/A; putative formula: C26H50O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.521,"smiles":null,"spectrum_id":"CCMSLIB00017230336","spectrum_index":12364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 493.3611 Da; putative annotation: N/A; putative formula: C25H51NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.624,"smiles":null,"spectrum_id":"CCMSLIB00017230339","spectrum_index":12365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 182.108 Da; putative annotation: N/A; putative formula: C8H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.46,"smiles":null,"spectrum_id":"CCMSLIB00017230340","spectrum_index":12366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 49.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.143,"smiles":null,"spectrum_id":"CCMSLIB00017230342","spectrum_index":12367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 146.0732 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.165,"smiles":null,"spectrum_id":"CCMSLIB00017230344","spectrum_index":12368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 104.0266 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017230345","spectrum_index":12369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 271.1443 Da; putative annotation: N/A; putative formula: C12H22N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.22,"smiles":null,"spectrum_id":"CCMSLIB00017230348","spectrum_index":12370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 41.0499 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.152,"smiles":null,"spectrum_id":"CCMSLIB00017230349","spectrum_index":12371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.175,"smiles":null,"spectrum_id":"CCMSLIB00017230350","spectrum_index":12372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.,16.alpha.-diol-17-one (delta mass: 124.0683 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.279,"smiles":null,"spectrum_id":"CCMSLIB00017230353","spectrum_index":12373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 14.0149 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.184,"smiles":null,"spectrum_id":"CCMSLIB00017230354","spectrum_index":12374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-2-hydroxybenzoic acid (delta mass: 94.1141 Da; putative annotation: N/A; putative formula: C8H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.148,"smiles":null,"spectrum_id":"CCMSLIB00017230356","spectrum_index":12375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-(Difluoromethylthio)phenyl)-N-methylmethanamine (delta mass: 297.1141 Da; putative annotation: N/A; putative formula: C15H24NO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.179,"smiles":null,"spectrum_id":"CCMSLIB00017230358","spectrum_index":12376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 409.184 Da; putative annotation: N/A; putative formula: C21H32NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.291,"smiles":null,"spectrum_id":"CCMSLIB00017230359","spectrum_index":12377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 126.0679 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017230362","spectrum_index":12378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin; AIF; CE10; MS2Dec (delta mass: 284.1246 Da; putative annotation: N/A; putative formula: C11H12N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.22,"smiles":null,"spectrum_id":"CCMSLIB00017230363","spectrum_index":12379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP007502 Lithocholenic Acid|AC1N11MC|4-(3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid (delta mass: 151.1436 Da; putative annotation: N/A; putative formula: C9H17N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.433,"smiles":null,"spectrum_id":"CCMSLIB00017230364","spectrum_index":12380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 442.2366 Da; putative annotation: N/A; putative formula: C27H38OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.297,"smiles":null,"spectrum_id":"CCMSLIB00017230367","spectrum_index":12381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 202.0554 Da; putative annotation: N/A; putative formula: C7H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.157,"smiles":null,"spectrum_id":"CCMSLIB00017230368","spectrum_index":12382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 303.2424 Da; putative annotation: N/A; putative formula: C17H29N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.355,"smiles":null,"spectrum_id":"CCMSLIB00017230371","spectrum_index":12383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 46.0024 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.113,"smiles":null,"spectrum_id":"CCMSLIB00017230372","spectrum_index":12384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 27.9796 Da; putative annotation: N/A; putative formula: CO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.119,"smiles":null,"spectrum_id":"CCMSLIB00017230374","spectrum_index":12385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.232,"smiles":null,"spectrum_id":"CCMSLIB00017230376","spectrum_index":12386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Thienyl)-1H-imidazole (delta mass: 208.101 Da; putative annotation: N/A; putative formula: C6H18N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.133,"smiles":null,"spectrum_id":"CCMSLIB00017230377","spectrum_index":12387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 156.0573 Da; putative annotation: N/A; putative formula: C11H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.117,"smiles":null,"spectrum_id":"CCMSLIB00017230380","spectrum_index":12388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 396.1118 Da; putative annotation: N/A; putative formula: C17H16N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.203,"smiles":null,"spectrum_id":"CCMSLIB00017230381","spectrum_index":12389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,9-Dihydroxy-6-methyl-3,10-dimethylidene-4,7,8,9,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one (delta mass: 73.0527 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.196,"smiles":null,"spectrum_id":"CCMSLIB00017230383","spectrum_index":12390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 393.2164 Da; putative annotation: N/A; putative formula: C22H27N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.287,"smiles":null,"spectrum_id":"CCMSLIB00017230385","spectrum_index":12391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexamethyleneimine (delta mass: 82.0413 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.153,"smiles":null,"spectrum_id":"CCMSLIB00017230388","spectrum_index":12392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 74.0823 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.185,"smiles":null,"spectrum_id":"CCMSLIB00017230389","spectrum_index":12393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004403 1-hydroxypyrene|pyren-1-ol (delta mass: 62.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017230392","spectrum_index":12394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 226.1693 Da; putative annotation: Leu-Leu; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.319,"smiles":null,"spectrum_id":"CCMSLIB00017230393","spectrum_index":12395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 115.0641 Da; putative annotation: DL-Threonine methyl ester; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.139,"smiles":null,"spectrum_id":"CCMSLIB00017230396","spectrum_index":12396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-MANNOSAMINE (delta mass: 184.1214 Da; putative annotation: Alanyl-Leucine; AIF; CE30; MS2Dec; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.219,"smiles":null,"spectrum_id":"CCMSLIB00017230397","spectrum_index":12397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 175.0632 Da; putative annotation: (N-Phenylcarbamoyl)methyl acetate; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.144,"smiles":null,"spectrum_id":"CCMSLIB00017230400","spectrum_index":12398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 308.2354 Da; putative annotation: Avocadyne Acetate; putative formula: C19H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.452,"smiles":null,"spectrum_id":"CCMSLIB00017230401","spectrum_index":12399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10-Hydroxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl) (Z)-2-methylbut-2-enoate (delta mass: 326.116 Da; putative annotation: (9-Hydroxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl) (Z)-2-methylbut-2-enoate; putative formula: C19H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.249,"smiles":null,"spectrum_id":"CCMSLIB00017230404","spectrum_index":12400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 120.057 Da; putative annotation: 4,5-Dimethyl-1,3-benzenediol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017230405","spectrum_index":12401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01043 Hexahydrocurcumin (delta mass: 118.0415 Da; putative annotation: Phenylacetic acid; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.222,"smiles":null,"spectrum_id":"CCMSLIB00017230407","spectrum_index":12402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (((3a,7a)-3,7-trihydroxy-24-oxocholan-22-en-24-yl)amino)ethanesulfonic acid (delta mass: 148.1279 Da; putative annotation: (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.416,"smiles":null,"spectrum_id":"CCMSLIB00017230409","spectrum_index":12403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 300.2087 Da; putative annotation: Steviol; putative formula: C20H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.425,"smiles":null,"spectrum_id":"CCMSLIB00017230410","spectrum_index":12404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 333.2655 Da; putative annotation: Gly-C19:2; putative formula: C21H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.513,"smiles":null,"spectrum_id":"CCMSLIB00017230413","spectrum_index":12405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 220.1828 Da; putative annotation: Bisabolol oxide A; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.274,"smiles":null,"spectrum_id":"CCMSLIB00017230414","spectrum_index":12406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Di-.gamma.-linolenin (6c,9c,12c) from NIST14 (delta mass: 303.2555 Da; putative annotation: .gamma.-Linolenoyl ethanolamide; putative formula: C20H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.738,"smiles":null,"spectrum_id":"CCMSLIB00017230416","spectrum_index":12407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 160.0996 Da; putative annotation: 4-Phenylbutanehydrazide; putative formula: C10H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.191,"smiles":null,"spectrum_id":"CCMSLIB00017230418","spectrum_index":12408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 252.1723 Da; putative annotation: (E)-2-Decylpent-2-enedioic acid; putative formula: C15H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.404,"smiles":null,"spectrum_id":"CCMSLIB00017230420","spectrum_index":12409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 138.1044 Da; putative annotation: (2-Hydroxymethylbicyclo[2.2.1]hept-2-yl)methanol; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017230422","spectrum_index":12410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 302.1876 Da; putative annotation: 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE; putative formula: C19H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.399,"smiles":null,"spectrum_id":"CCMSLIB00017230424","spectrum_index":12411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 132.094 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.378,"smiles":null,"spectrum_id":"CCMSLIB00017230426","spectrum_index":12412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 264.2448 Da; putative annotation: oleic acid CollisionEnergy:205060; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.31,"smiles":null,"spectrum_id":"CCMSLIB00017230428","spectrum_index":12413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 280.2763 Da; putative annotation: Pristanic acid; putative formula: C19H36O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.357,"smiles":null,"spectrum_id":"CCMSLIB00017230430","spectrum_index":12414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 141.078 Da; putative annotation: Gly-C5:0; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.18,"smiles":null,"spectrum_id":"CCMSLIB00017230432","spectrum_index":12415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 222.1625 Da; putative annotation: Dicyclohexyl(hydroxy)acetic acid; putative formula: C14H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017230435","spectrum_index":12416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 245.2363 Da; putative annotation: N/A; putative formula: C10H27N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.604,"smiles":null,"spectrum_id":"CCMSLIB00017230436","spectrum_index":12417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homogentisic acid (delta mass: 102.0318 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017230439","spectrum_index":12418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311112 Caffeoyl putrescin (isomer of 1059) (delta mass: 160.0964 Da; putative annotation: N/A; putative formula: C5H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.235,"smiles":null,"spectrum_id":"CCMSLIB00017230440","spectrum_index":12419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 406.1839 Da; putative annotation: N/A; putative formula: C18H30O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.275,"smiles":null,"spectrum_id":"CCMSLIB00017230441","spectrum_index":12420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 88.068 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.31,"smiles":null,"spectrum_id":"CCMSLIB00017230444","spectrum_index":12421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 220.1267 Da; putative annotation: N/A; putative formula: C8H21N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.208,"smiles":null,"spectrum_id":"CCMSLIB00017230445","spectrum_index":12422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 339.1324 Da; putative annotation: N/A; putative formula: C9H21N7O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.234,"smiles":null,"spectrum_id":"CCMSLIB00017230448","spectrum_index":12423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 248.2872 Da; putative annotation: N/A; putative formula: C19H36O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.399,"smiles":null,"spectrum_id":"CCMSLIB00017230449","spectrum_index":12424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 98.1308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.185,"smiles":null,"spectrum_id":"CCMSLIB00017230451","spectrum_index":12425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA065201 Sulfanilic acid| 4-aminobenzenesulfonic acid (delta mass: 80.9916 Da; putative annotation: N/A; putative formula: C2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.014,"smiles":null,"spectrum_id":"CCMSLIB00017230453","spectrum_index":12426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Leu (delta mass: 297.1693 Da; putative annotation: N/A; putative formula: C15H27N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.324,"smiles":null,"spectrum_id":"CCMSLIB00017230455","spectrum_index":12427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Strobilactone A (delta mass: 98.056 Da; putative annotation: N/A; putative formula: C6H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.215,"smiles":null,"spectrum_id":"CCMSLIB00017230457","spectrum_index":12428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 655.5743 Da; putative annotation: N/A; putative formula: C43H79NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":932.791,"smiles":null,"spectrum_id":"CCMSLIB00017230459","spectrum_index":12429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 267.095 Da; putative annotation: N/A; putative formula: C9H17NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.343,"smiles":null,"spectrum_id":"CCMSLIB00017230461","spectrum_index":12430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilauroyl-sn-glycerol (delta mass: 62.0521 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.441,"smiles":null,"spectrum_id":"CCMSLIB00017230463","spectrum_index":12431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00865 alpha-Codeimethine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.186,"smiles":null,"spectrum_id":"CCMSLIB00017230465","spectrum_index":12432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.274,"smiles":null,"spectrum_id":"CCMSLIB00017230467","spectrum_index":12433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 39.0251 Da; putative annotation: N/A; putative formula: CHN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.21,"smiles":null,"spectrum_id":"CCMSLIB00017230470","spectrum_index":12434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 62.0515 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.289,"smiles":null,"spectrum_id":"CCMSLIB00017230471","spectrum_index":12435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 448.4296 Da; putative annotation: N/A; putative formula: C29H57N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.511,"smiles":null,"spectrum_id":"CCMSLIB00017230473","spectrum_index":12436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(1H-Benzimidazol-2-yl)-4-fluorobenzamide (delta mass: 117.0516 Da; putative annotation: N/A; putative formula: C3H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.14,"smiles":null,"spectrum_id":"CCMSLIB00017230475","spectrum_index":12437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 147.0644 Da; putative annotation: N/A; putative formula: C4H9N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.244,"smiles":null,"spectrum_id":"CCMSLIB00017230476","spectrum_index":12438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 60.0216 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.081,"smiles":null,"spectrum_id":"CCMSLIB00017230479","spectrum_index":12439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.alpha.,17.alpha.-triol (delta mass: 144.0943 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017230480","spectrum_index":12440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 320.1151 Da; putative annotation: N/A; putative formula: C13H17N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.217,"smiles":null,"spectrum_id":"CCMSLIB00017230482","spectrum_index":12441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384710-01_C45H70O16_beta-D-Galactopyranoside, (1beta,3beta,8xi,9xi,14xi)-3-[(6-deoxy-alpha-L-mannopyranosyl)oxy]spirosta-5,25(27)-dien-1-yl 6-deoxy-2-O-(6-deoxy-alpha-L-mannopyranosyl)- (delta mass: 78.0081 Da; putative annotation: N/A; putative formula: CH-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.482,"smiles":null,"spectrum_id":"CCMSLIB00017230484","spectrum_index":12442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 575.2692 Da; putative annotation: N/A; putative formula: C31H33N11O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.398,"smiles":null,"spectrum_id":"CCMSLIB00017230485","spectrum_index":12443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 62.0523 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.331,"smiles":null,"spectrum_id":"CCMSLIB00017230488","spectrum_index":12444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 128.1021 Da; putative annotation: N/A; putative formula: C8H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.365,"smiles":null,"spectrum_id":"CCMSLIB00017230489","spectrum_index":12445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 307.156 Da; putative annotation: N/A; putative formula: C14H22N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.311,"smiles":null,"spectrum_id":"CCMSLIB00017230491","spectrum_index":12446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 86.047 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.3,"smiles":null,"spectrum_id":"CCMSLIB00017230493","spectrum_index":12447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 121.0888 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.175,"smiles":null,"spectrum_id":"CCMSLIB00017230494","spectrum_index":12448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gabapentin (delta mass: 152.0838 Da; putative annotation: N/A; putative formula: C9H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.217,"smiles":null,"spectrum_id":"CCMSLIB00017230497","spectrum_index":12449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 154.003 Da; putative annotation: N/A; putative formula: C3H7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.089,"smiles":null,"spectrum_id":"CCMSLIB00017230498","spectrum_index":12450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 64.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.092,"smiles":null,"spectrum_id":"CCMSLIB00017230501","spectrum_index":12451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 301.1162 Da; putative annotation: N/A; putative formula: C13H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.24,"smiles":null,"spectrum_id":"CCMSLIB00017230502","spectrum_index":12452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 441.257 Da; putative annotation: N/A; putative formula: C32H31N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.323,"smiles":null,"spectrum_id":"CCMSLIB00017230505","spectrum_index":12453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentisic acid (delta mass: 172.0377 Da; putative annotation: N/A; putative formula: C8H12S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.072,"smiles":null,"spectrum_id":"CCMSLIB00017230506","spectrum_index":12454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084604 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 104.0379 Da; putative annotation: N/A; putative formula: C6H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.092,"smiles":null,"spectrum_id":"CCMSLIB00017230509","spectrum_index":12455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)propane-1,2-diol (delta mass: 193.0584 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.16,"smiles":null,"spectrum_id":"CCMSLIB00017230510","spectrum_index":12456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-di-O-galloylquinic acid (delta mass: 134.0002 Da; putative annotation: N/A; putative formula: C7H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.093,"smiles":null,"spectrum_id":"CCMSLIB00017230511","spectrum_index":12457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 32.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.113,"smiles":null,"spectrum_id":"CCMSLIB00017230514","spectrum_index":12458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(+)-4-Amino-3-hydroxybutyric acid (delta mass: 252.2092 Da; putative annotation: N/A; putative formula: C16H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017230515","spectrum_index":12459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxy-2,3-dihydropyran-6-one (delta mass: 193.0605 Da; putative annotation: N/A; putative formula: C7H7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.11,"smiles":null,"spectrum_id":"CCMSLIB00017230517","spectrum_index":12460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 86.0514 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017230519","spectrum_index":12461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 164.0132 Da; putative annotation: N/A; putative formula: C7H5N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.11,"smiles":null,"spectrum_id":"CCMSLIB00017230521","spectrum_index":12462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 82.0083 Da; putative annotation: N/A; putative formula: C3H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.063,"smiles":null,"spectrum_id":"CCMSLIB00017230523","spectrum_index":12463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 184.0692 Da; putative annotation: N/A; putative formula: C8H14N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.151,"smiles":null,"spectrum_id":"CCMSLIB00017230525","spectrum_index":12464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 454.3475 Da; putative annotation: N/A; putative formula: C30H46O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.388,"smiles":null,"spectrum_id":"CCMSLIB00017230527","spectrum_index":12465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 103.9143 Da; putative annotation: N/A; putative formula: CH-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.979,"smiles":null,"spectrum_id":"CCMSLIB00017230529","spectrum_index":12466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 105.5946 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.659,"smiles":null,"spectrum_id":"CCMSLIB00017230531","spectrum_index":12467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 68.0396 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.1,"smiles":null,"spectrum_id":"CCMSLIB00017230533","spectrum_index":12468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 410.8809 Da; putative annotation: N/A; putative formula: C11H11NO2P2S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.972,"smiles":null,"spectrum_id":"CCMSLIB00017230535","spectrum_index":12469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 195.037 Da; putative annotation: N/A; putative formula: C9H11NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.139,"smiles":null,"spectrum_id":"CCMSLIB00017230537","spectrum_index":12470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 104.0549 Da; putative annotation: N/A; putative formula: C2H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.546,"smiles":null,"spectrum_id":"CCMSLIB00017230539","spectrum_index":12471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 60.0 eV (delta mass: 202.0537 Da; putative annotation: N/A; putative formula: C6H12N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.14,"smiles":null,"spectrum_id":"CCMSLIB00017230541","spectrum_index":12472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol oxide A (delta mass: 159.8781 Da; putative annotation: N/A; putative formula: O2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.079,"smiles":null,"spectrum_id":"CCMSLIB00017230544","spectrum_index":12473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 124.0733 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.3,"smiles":null,"spectrum_id":"CCMSLIB00017230545","spectrum_index":12474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 105.0825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017230548","spectrum_index":12475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 180.057 Da; putative annotation: N/A; putative formula: C5H12N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.206,"smiles":null,"spectrum_id":"CCMSLIB00017230549","spectrum_index":12476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Teucroxide (delta mass: 200.0316 Da; putative annotation: N/A; putative formula: C2H9N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.207,"smiles":null,"spectrum_id":"CCMSLIB00017230552","spectrum_index":12477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Castanospermine (delta mass: 39.0147 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.122,"smiles":null,"spectrum_id":"CCMSLIB00017230553","spectrum_index":12478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 193.1098 Da; putative annotation: N/A; putative formula: C11H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.279,"smiles":null,"spectrum_id":"CCMSLIB00017230556","spectrum_index":12479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.alpha.,9.Xi.)-3-Hydroxyolean-12-en-24-oic acid (delta mass: 90.0924 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.46,"smiles":null,"spectrum_id":"CCMSLIB00017230557","spectrum_index":12480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-[(6-Hydroxy-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methoxy]chromen-2-one (delta mass: 435.2711 Da; putative annotation: N/A; putative formula: C27H37N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":818.493,"smiles":null,"spectrum_id":"CCMSLIB00017230560","spectrum_index":12481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 255.222 Da; putative annotation: N/A; putative formula: C14H30N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.309,"smiles":null,"spectrum_id":"CCMSLIB00017230561","spectrum_index":12482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 61.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.108,"smiles":null,"spectrum_id":"CCMSLIB00017230562","spectrum_index":12483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxypestalotin (delta mass: 78.012 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.135,"smiles":null,"spectrum_id":"CCMSLIB00017230565","spectrum_index":12484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 224.0729 Da; putative annotation: N/A; putative formula: C8H18O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.153,"smiles":null,"spectrum_id":"CCMSLIB00017230566","spectrum_index":12485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MMV688345 (delta mass: 159.0831 Da; putative annotation: N/A; putative formula: C6H13N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.211,"smiles":null,"spectrum_id":"CCMSLIB00017230568","spectrum_index":12486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 115.0269 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.071,"smiles":null,"spectrum_id":"CCMSLIB00017230570","spectrum_index":12487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 116.0473 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.107,"smiles":null,"spectrum_id":"CCMSLIB00017230573","spectrum_index":12488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 184.132 Da; putative annotation: N/A; putative formula: C8H16N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.5,"smiles":null,"spectrum_id":"CCMSLIB00017230574","spectrum_index":12489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 61.0175 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.141,"smiles":null,"spectrum_id":"CCMSLIB00017230576","spectrum_index":12490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 21.9919 Da; putative annotation: N/A; putative formula: CH-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.027,"smiles":null,"spectrum_id":"CCMSLIB00017230578","spectrum_index":12491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 52.0294 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.167,"smiles":null,"spectrum_id":"CCMSLIB00017230579","spectrum_index":12492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 384.1604 Da; putative annotation: N/A; putative formula: C21H25N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.232,"smiles":null,"spectrum_id":"CCMSLIB00017230582","spectrum_index":12493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 288.1166 Da; putative annotation: N/A; putative formula: C6H8N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.197,"smiles":null,"spectrum_id":"CCMSLIB00017230583","spectrum_index":12494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 57.0112 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.118,"smiles":null,"spectrum_id":"CCMSLIB00017230585","spectrum_index":12495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.065,"smiles":null,"spectrum_id":"CCMSLIB00017230587","spectrum_index":12496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU252006 2-(Piperazin-1-yl)ethanamine|1-Piperazineethanamine|2-piperazin-1-ylethanamine (delta mass: 75.9147 Da; putative annotation: N/A; putative formula: H-1O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.049,"smiles":null,"spectrum_id":"CCMSLIB00017230588","spectrum_index":12497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin A (delta mass: 80.0628 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.237,"smiles":null,"spectrum_id":"CCMSLIB00017230591","spectrum_index":12498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-4-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 136.0732 Da; putative annotation: N/A; putative formula: C6H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.242,"smiles":null,"spectrum_id":"CCMSLIB00017230592","spectrum_index":12499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 56.063 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.259,"smiles":null,"spectrum_id":"CCMSLIB00017230593","spectrum_index":12500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(8Z,11Z,14Z-Eicosatrienoyl)ethanolamine (delta mass: 68.063 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.368,"smiles":null,"spectrum_id":"CCMSLIB00017230596","spectrum_index":12501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 827.4652 Da; putative annotation: N/A; putative formula: C39H61N11O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1154.59,"smiles":null,"spectrum_id":"CCMSLIB00017230597","spectrum_index":12502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 515.4542 Da; putative annotation: N/A; putative formula: C27H53N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.514,"smiles":null,"spectrum_id":"CCMSLIB00017230599","spectrum_index":12503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 312.106 Da; putative annotation: N/A; putative formula: C14H21N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.234,"smiles":null,"spectrum_id":"CCMSLIB00017230601","spectrum_index":12504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 899.5995 Da; putative annotation: N/A; putative formula: C58H81N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1252.87,"smiles":null,"spectrum_id":"CCMSLIB00017230604","spectrum_index":12505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 134.0287 Da; putative annotation: N/A; putative formula: C8H7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.1,"smiles":null,"spectrum_id":"CCMSLIB00017230605","spectrum_index":12506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisucaberin (delta mass: 199.012 Da; putative annotation: N/A; putative formula: C2H2N9OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.252,"smiles":null,"spectrum_id":"CCMSLIB00017230606","spectrum_index":12507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Docosenoic acid (delta mass: 177.0658 Da; putative annotation: N/A; putative formula: C7H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.392,"smiles":null,"spectrum_id":"CCMSLIB00017230609","spectrum_index":12508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1026.3289 Da; putative annotation: N/A; putative formula: C50H59O21P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1189.39,"smiles":null,"spectrum_id":"CCMSLIB00017230610","spectrum_index":12509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 106.0819 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.34,"smiles":null,"spectrum_id":"CCMSLIB00017230613","spectrum_index":12510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonoylglycerol (delta mass: 371.2593 Da; putative annotation: N/A; putative formula: C20H38NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.544,"smiles":null,"spectrum_id":"CCMSLIB00017230614","spectrum_index":12511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 60.0673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.159,"smiles":null,"spectrum_id":"CCMSLIB00017230617","spectrum_index":12512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 142.0446 Da; putative annotation: N/A; putative formula: C7H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.131,"smiles":null,"spectrum_id":"CCMSLIB00017230619","spectrum_index":12513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 39.0112 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.114,"smiles":null,"spectrum_id":"CCMSLIB00017230621","spectrum_index":12514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-17-ol-3,20-dione (delta mass: 114.085 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.327,"smiles":null,"spectrum_id":"CCMSLIB00017230622","spectrum_index":12515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 100.0681 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.295,"smiles":null,"spectrum_id":"CCMSLIB00017230625","spectrum_index":12516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dimethyloct-6-ene-1,2,3-triol (delta mass: 298.251 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.4,"smiles":null,"spectrum_id":"CCMSLIB00017230626","spectrum_index":12517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 1253.5919 Da; putative annotation: N/A; putative formula: C70H75N15O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1434.66,"smiles":null,"spectrum_id":"CCMSLIB00017230628","spectrum_index":12518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 114.0317 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.399,"smiles":null,"spectrum_id":"CCMSLIB00017230630","spectrum_index":12519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 474.0794 Da; putative annotation: N/A; putative formula: C20H14N10OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":817.203,"smiles":null,"spectrum_id":"CCMSLIB00017230632","spectrum_index":12520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-Butylidene-6,7-dihydroxy-4,5,6,7-tetrahydro-2-benzofuran-1-one (delta mass: 35.977 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.089,"smiles":null,"spectrum_id":"CCMSLIB00017230634","spectrum_index":12521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitelaidic acid (delta mass: 570.4636 Da; putative annotation: N/A; putative formula: C37H62O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.695,"smiles":null,"spectrum_id":"CCMSLIB00017230636","spectrum_index":12522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 390.2328 Da; putative annotation: N/A; putative formula: C23H35O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.33,"smiles":null,"spectrum_id":"CCMSLIB00017230638","spectrum_index":12523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 620.4102 Da; putative annotation: N/A; putative formula: C33H52N10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1075.76,"smiles":null,"spectrum_id":"CCMSLIB00017230640","spectrum_index":12524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 627.3634 Da; putative annotation: N/A; putative formula: C33H49N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":980.632,"smiles":null,"spectrum_id":"CCMSLIB00017230642","spectrum_index":12525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 584.2104 Da; putative annotation: N/A; putative formula: C27H36O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.292,"smiles":null,"spectrum_id":"CCMSLIB00017230644","spectrum_index":12526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 590.2237 Da; putative annotation: N/A; putative formula: C29H50S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.29,"smiles":null,"spectrum_id":"CCMSLIB00017230646","spectrum_index":12527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 88.0727 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.31,"smiles":null,"spectrum_id":"CCMSLIB00017230648","spectrum_index":12528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 171.0848 Da; putative annotation: N/A; putative formula: C7H13N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.15,"smiles":null,"spectrum_id":"CCMSLIB00017230650","spectrum_index":12529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 83.081 Da; putative annotation: N/A; putative formula: C4H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.161,"smiles":null,"spectrum_id":"CCMSLIB00017230652","spectrum_index":12530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 809.3145 Da; putative annotation: N/A; putative formula: C41H39N13O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1152.44,"smiles":null,"spectrum_id":"CCMSLIB00017230654","spectrum_index":12531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 88.0353 Da; putative annotation: N/A; putative formula: C4H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.153,"smiles":null,"spectrum_id":"CCMSLIB00017230656","spectrum_index":12532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eicosapentaenoyl ethanolamide (delta mass: 96.0582 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.332,"smiles":null,"spectrum_id":"CCMSLIB00017230658","spectrum_index":12533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 32.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.226,"smiles":null,"spectrum_id":"CCMSLIB00017230660","spectrum_index":12534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 353.2212 Da; putative annotation: N/A; putative formula: C20H35NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.292,"smiles":null,"spectrum_id":"CCMSLIB00017230662","spectrum_index":12535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 169.0959 Da; putative annotation: N/A; putative formula: C6H11N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.307,"smiles":null,"spectrum_id":"CCMSLIB00017230663","spectrum_index":12536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300892 Cinchonine (delta mass: 220.1531 Da; putative annotation: N/A; putative formula: C8H20N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.334,"smiles":null,"spectrum_id":"CCMSLIB00017230666","spectrum_index":12537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 119.054 Da; putative annotation: N/A; putative formula: C3H9N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.156,"smiles":null,"spectrum_id":"CCMSLIB00017230667","spectrum_index":12538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 483.3411 Da; putative annotation: N/A; putative formula: C26H50N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.38,"smiles":null,"spectrum_id":"CCMSLIB00017230670","spectrum_index":12539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-15-Tetracosenoic acid (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.409,"smiles":null,"spectrum_id":"CCMSLIB00017230671","spectrum_index":12540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 72.0211 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.3,"smiles":null,"spectrum_id":"CCMSLIB00017230673","spectrum_index":12541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-(Methoxycarbonyl)dec-9-enoic acid (delta mass: 32.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.169,"smiles":null,"spectrum_id":"CCMSLIB00017230675","spectrum_index":12542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 126.1145 Da; putative annotation: N/A; putative formula: C7H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.18,"smiles":null,"spectrum_id":"CCMSLIB00017230677","spectrum_index":12543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-hydroxybenzoate (delta mass: 60.0173 Da; putative annotation: N/A; putative formula: CH4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.088,"smiles":null,"spectrum_id":"CCMSLIB00017230679","spectrum_index":12544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.2,"smiles":null,"spectrum_id":"CCMSLIB00017230681","spectrum_index":12545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 49.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.113,"smiles":null,"spectrum_id":"CCMSLIB00017230683","spectrum_index":12546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleanolic acid methyl ester (delta mass: 122.1101 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.493,"smiles":null,"spectrum_id":"CCMSLIB00017230685","spectrum_index":12547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)acetamide (delta mass: 118.0416 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.159,"smiles":null,"spectrum_id":"CCMSLIB00017230687","spectrum_index":12548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 44.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.122,"smiles":null,"spectrum_id":"CCMSLIB00017230689","spectrum_index":12549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl {[(5-chloro-1H-indol-2-yl)carbonyl]amino}acetate (delta mass: 154.9931 Da; putative annotation: N/A; putative formula: CH8N3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.046,"smiles":null,"spectrum_id":"CCMSLIB00017230691","spectrum_index":12550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 30.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.108,"smiles":null,"spectrum_id":"CCMSLIB00017230693","spectrum_index":12551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.097,"smiles":null,"spectrum_id":"CCMSLIB00017230695","spectrum_index":12552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 45.94 Da; putative annotation: N/A; putative formula: C14H19N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017230697","spectrum_index":12553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 130.0776 Da; putative annotation: N/A; putative formula: C4H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.304,"smiles":null,"spectrum_id":"CCMSLIB00017230699","spectrum_index":12554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.076,"smiles":null,"spectrum_id":"CCMSLIB00017230701","spectrum_index":12555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[7-Hydroxy-8-(2-hydroxypropan-2-yl)-11-methoxy-4,5a,9-trimethyl-1-oxo-3,6,7,8,9a,10-hexahydro-[2]benzofuro[5,6-b]chromen-9-yl]propanoic acid (delta mass: 61.9492 Da; putative annotation: N/A; putative formula: P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.182,"smiles":null,"spectrum_id":"CCMSLIB00017230703","spectrum_index":12556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Heptynoic acid (delta mass: 31.9898 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.065,"smiles":null,"spectrum_id":"CCMSLIB00017230705","spectrum_index":12557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyethoxy)phenol (delta mass: 14.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.122,"smiles":null,"spectrum_id":"CCMSLIB00017230706","spectrum_index":12558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 174.0996 Da; putative annotation: N/A; putative formula: C9H19O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.207,"smiles":null,"spectrum_id":"CCMSLIB00017230709","spectrum_index":12559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 174.0779 Da; putative annotation: N/A; putative formula: C6H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.148,"smiles":null,"spectrum_id":"CCMSLIB00017230710","spectrum_index":12560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D2 (delta mass: 137.0754 Da; putative annotation: N/A; putative formula: C8H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.417,"smiles":null,"spectrum_id":"CCMSLIB00017230712","spectrum_index":12561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 162.0529 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.139,"smiles":null,"spectrum_id":"CCMSLIB00017230714","spectrum_index":12562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017230715","spectrum_index":12563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 31.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.06,"smiles":null,"spectrum_id":"CCMSLIB00017230718","spectrum_index":12564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 247.2149 Da; putative annotation: N/A; putative formula: C14H25N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.415,"smiles":null,"spectrum_id":"CCMSLIB00017230719","spectrum_index":12565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 62.0508 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.111,"smiles":null,"spectrum_id":"CCMSLIB00017230720","spectrum_index":12566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 8.9997 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.122,"smiles":null,"spectrum_id":"CCMSLIB00017230723","spectrum_index":12567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 44.0405 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.138,"smiles":null,"spectrum_id":"CCMSLIB00017230724","spectrum_index":12568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 32.9884 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.048,"smiles":null,"spectrum_id":"CCMSLIB00017230727","spectrum_index":12569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 74.0369 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.097,"smiles":null,"spectrum_id":"CCMSLIB00017230728","spectrum_index":12570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 116.0657 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.287,"smiles":null,"spectrum_id":"CCMSLIB00017230730","spectrum_index":12571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 86.0552 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.277,"smiles":null,"spectrum_id":"CCMSLIB00017230732","spectrum_index":12572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 413.2772 Da; putative annotation: N/A; putative formula: C22H39NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.41,"smiles":null,"spectrum_id":"CCMSLIB00017230733","spectrum_index":12573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-ylmethylene)malononitrile (delta mass: 17.0966 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.168,"smiles":null,"spectrum_id":"CCMSLIB00017230736","spectrum_index":12574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 88.0505 Da; putative annotation: N/A; putative formula: H4N6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.121,"smiles":null,"spectrum_id":"CCMSLIB00017230737","spectrum_index":12575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1015.8421 Da; putative annotation: N/A; putative formula: C62H113NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.9,"smiles":null,"spectrum_id":"CCMSLIB00017230739","spectrum_index":12576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 59.0573 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.122,"smiles":null,"spectrum_id":"CCMSLIB00017230741","spectrum_index":12577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 717.3289 Da; putative annotation: N/A; putative formula: C49H43N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.37,"smiles":null,"spectrum_id":"CCMSLIB00017230742","spectrum_index":12578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-hydroxybenzoic acid CollisionEnergy:102040 (delta mass: 24.0001 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.05,"smiles":null,"spectrum_id":"CCMSLIB00017230745","spectrum_index":12579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid (delta mass: 57.021 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.06,"smiles":null,"spectrum_id":"CCMSLIB00017230746","spectrum_index":12580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(1H-Indol-3-yl)vinyl]isoquinoline (delta mass: 17.0289 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.152,"smiles":null,"spectrum_id":"CCMSLIB00017230748","spectrum_index":12581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 275.1158 Da; putative annotation: N/A; putative formula: C15H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.244,"smiles":null,"spectrum_id":"CCMSLIB00017230750","spectrum_index":12582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 104.0946 Da; putative annotation: N/A; putative formula: H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.342,"smiles":null,"spectrum_id":"CCMSLIB00017230753","spectrum_index":12583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 54.0486 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.099,"smiles":null,"spectrum_id":"CCMSLIB00017230754","spectrum_index":12584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 45.0828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.174,"smiles":null,"spectrum_id":"CCMSLIB00017230757","spectrum_index":12585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 69.0581 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.171,"smiles":null,"spectrum_id":"CCMSLIB00017230758","spectrum_index":12586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 174.1255 Da; putative annotation: N/A; putative formula: C9H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.18,"smiles":null,"spectrum_id":"CCMSLIB00017230761","spectrum_index":12587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 1037.6498 Da; putative annotation: N/A; putative formula: C52H95NO19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1218.72,"smiles":null,"spectrum_id":"CCMSLIB00017230762","spectrum_index":12588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 32.0313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.101,"smiles":null,"spectrum_id":"CCMSLIB00017230764","spectrum_index":12589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 390.2161 Da; putative annotation: N/A; putative formula: C22H34N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.485,"smiles":null,"spectrum_id":"CCMSLIB00017230766","spectrum_index":12590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 407.243 Da; putative annotation: N/A; putative formula: C22H37N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.512,"smiles":null,"spectrum_id":"CCMSLIB00017230768","spectrum_index":12591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 459.2986 Da; putative annotation: N/A; putative formula: C27H41NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.369,"smiles":null,"spectrum_id":"CCMSLIB00017230770","spectrum_index":12592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 239.1726 Da; putative annotation: N/A; putative formula: C7H17N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.264,"smiles":null,"spectrum_id":"CCMSLIB00017230772","spectrum_index":12593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017230773","spectrum_index":12594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 430.135 Da; putative annotation: N/A; putative formula: C17H18N8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.176,"smiles":null,"spectrum_id":"CCMSLIB00017230776","spectrum_index":12595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 19.0141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.246,"smiles":null,"spectrum_id":"CCMSLIB00017230777","spectrum_index":12596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369606 Salicylic acid|2-hydroxybenzoic acid (delta mass: 38.061 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017230780","spectrum_index":12597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 38.0145 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.21,"smiles":null,"spectrum_id":"CCMSLIB00017230781","spectrum_index":12598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 74.0442 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.131,"smiles":null,"spectrum_id":"CCMSLIB00017230784","spectrum_index":12599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 506.2523 Da; putative annotation: N/A; putative formula: C20H38N6O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.526,"smiles":null,"spectrum_id":"CCMSLIB00017230785","spectrum_index":12600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 55.9522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.01,"smiles":null,"spectrum_id":"CCMSLIB00017230788","spectrum_index":12601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-(5-ethyl(1,3,4-thiadiazol-2-yl))-2-(2-1,2,3,4-tetrahydroisoquinolyl)acetamid e CollisionEnergy:205060\"\" (delta mass: 156.0508 Da; putative annotation: N/A; putative formula: C2H4N8O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.178,"smiles":null,"spectrum_id":"CCMSLIB00017230789","spectrum_index":12602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 45.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.274,"smiles":null,"spectrum_id":"CCMSLIB00017230790","spectrum_index":12603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 104.1005 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.359,"smiles":null,"spectrum_id":"CCMSLIB00017230793","spectrum_index":12604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.113,"smiles":null,"spectrum_id":"CCMSLIB00017230794","spectrum_index":12605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Obeticholic_Acid_NCE45 (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.394,"smiles":null,"spectrum_id":"CCMSLIB00017230797","spectrum_index":12606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(8aS)-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 96.0944 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.337,"smiles":null,"spectrum_id":"CCMSLIB00017230798","spectrum_index":12607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 197.0914 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.229,"smiles":null,"spectrum_id":"CCMSLIB00017230800","spectrum_index":12608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 245.1432 Da; putative annotation: N/A; putative formula: C8H19N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.203,"smiles":null,"spectrum_id":"CCMSLIB00017230802","spectrum_index":12609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 126.9795 Da; putative annotation: N/A; putative formula: C4H2NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017230804","spectrum_index":12610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 88.0076 Da; putative annotation: N/A; putative formula: C3H5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.119,"smiles":null,"spectrum_id":"CCMSLIB00017230806","spectrum_index":12611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 387.1533 Da; putative annotation: N/A; putative formula: C20H26N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.192,"smiles":null,"spectrum_id":"CCMSLIB00017230807","spectrum_index":12612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 54.047 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.096,"smiles":null,"spectrum_id":"CCMSLIB00017230810","spectrum_index":12613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cyclohexyl-4-piperidinamine (delta mass: 21.9943 Da; putative annotation: N/A; putative formula: CH-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.18,"smiles":null,"spectrum_id":"CCMSLIB00017230811","spectrum_index":12614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 76.0673 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.294,"smiles":null,"spectrum_id":"CCMSLIB00017230813","spectrum_index":12615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Eicosanoyl)sphingosine (delta mass: 38.0516 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.634,"smiles":null,"spectrum_id":"CCMSLIB00017230815","spectrum_index":12616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 25.9793 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.086,"smiles":null,"spectrum_id":"CCMSLIB00017230817","spectrum_index":12617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzoic acid (delta mass: 25.0137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.048,"smiles":null,"spectrum_id":"CCMSLIB00017230819","spectrum_index":12618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 82.0419 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.279,"smiles":null,"spectrum_id":"CCMSLIB00017230821","spectrum_index":12619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 220.106 Da; putative annotation: N/A; putative formula: C8H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.187,"smiles":null,"spectrum_id":"CCMSLIB00017230823","spectrum_index":12620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.-Hydroxyetiocholanolone (delta mass: 36.0332 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.26,"smiles":null,"spectrum_id":"CCMSLIB00017230825","spectrum_index":12621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxo-5Z,8Z,10E,14Z-eicosatetraenoic acid (delta mass: 35.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.264,"smiles":null,"spectrum_id":"CCMSLIB00017230827","spectrum_index":12622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 78.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.364,"smiles":null,"spectrum_id":"CCMSLIB00017230829","spectrum_index":12623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 590.1779 Da; putative annotation: N/A; putative formula: C30H34N6O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":751.238,"smiles":null,"spectrum_id":"CCMSLIB00017230831","spectrum_index":12624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-methylglutaric acid (delta mass: 797.4898 Da; putative annotation: N/A; putative formula: C38H67N7O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.55,"smiles":null,"spectrum_id":"CCMSLIB00017230833","spectrum_index":12625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 84.0362 Da; putative annotation: N/A; putative formula: C8H4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.101,"smiles":null,"spectrum_id":"CCMSLIB00017230835","spectrum_index":12626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 16.0452 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.112,"smiles":null,"spectrum_id":"CCMSLIB00017230837","spectrum_index":12627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 59.0494 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.05,"smiles":null,"spectrum_id":"CCMSLIB00017230839","spectrum_index":12628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 59.0872 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.087,"smiles":null,"spectrum_id":"CCMSLIB00017230842","spectrum_index":12629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isotretinoin CollisionEnergy:102040 (delta mass: 64.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.269,"smiles":null,"spectrum_id":"CCMSLIB00017230843","spectrum_index":12630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 211.0685 Da; putative annotation: N/A; putative formula: C10H15NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.311,"smiles":null,"spectrum_id":"CCMSLIB00017230846","spectrum_index":12631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 583.5164 Da; putative annotation: N/A; putative formula: C35H69NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":878.743,"smiles":null,"spectrum_id":"CCMSLIB00017230847","spectrum_index":12632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 155.0976 Da; putative annotation: N/A; putative formula: C7H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.184,"smiles":null,"spectrum_id":"CCMSLIB00017230849","spectrum_index":12633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-acetaldehyde CollisionEnergy:102040 (delta mass: 48.005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.081,"smiles":null,"spectrum_id":"CCMSLIB00017230851","spectrum_index":12634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 242.1705 Da; putative annotation: N/A; putative formula: C14H26OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.277,"smiles":null,"spectrum_id":"CCMSLIB00017230854","spectrum_index":12635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 113.0481 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017230855","spectrum_index":12636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 332.2561 Da; putative annotation: N/A; putative formula: C18H36O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.478,"smiles":null,"spectrum_id":"CCMSLIB00017230858","spectrum_index":12637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [(3-Benzoyl-1-benzofuran-5-yl)oxy]acetic acid (delta mass: 9.9841 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.06,"smiles":null,"spectrum_id":"CCMSLIB00017230859","spectrum_index":12638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 42.0474 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.295,"smiles":null,"spectrum_id":"CCMSLIB00017230860","spectrum_index":12639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 80.0104 Da; putative annotation: N/A; putative formula: C2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.101,"smiles":null,"spectrum_id":"CCMSLIB00017230863","spectrum_index":12640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 232.1706 Da; putative annotation: N/A; putative formula: C11H25N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.31,"smiles":null,"spectrum_id":"CCMSLIB00017230864","spectrum_index":12641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 193.0588 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.124,"smiles":null,"spectrum_id":"CCMSLIB00017230867","spectrum_index":12642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 566.7351 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.816,"smiles":null,"spectrum_id":"CCMSLIB00017230868","spectrum_index":12643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoethyl-(1,8-dimethylimidazo[1,2-a]quinoxalin-4-yl)amine (delta mass: 17.9762 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.132,"smiles":null,"spectrum_id":"CCMSLIB00017230871","spectrum_index":12644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 102.0795 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.311,"smiles":null,"spectrum_id":"CCMSLIB00017230872","spectrum_index":12645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Lys (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.281,"smiles":null,"spectrum_id":"CCMSLIB00017230875","spectrum_index":12646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homogentisic acid (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.101,"smiles":null,"spectrum_id":"CCMSLIB00017230876","spectrum_index":12647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 77.0293 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.167,"smiles":null,"spectrum_id":"CCMSLIB00017230879","spectrum_index":12648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.274,"smiles":null,"spectrum_id":"CCMSLIB00017230880","spectrum_index":12649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 97.0352 Da; putative annotation: N/A; putative formula: C5H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.09,"smiles":null,"spectrum_id":"CCMSLIB00017230883","spectrum_index":12650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Syringaldehyde from NIST14 (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017230884","spectrum_index":12651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 235.0885 Da; putative annotation: N/A; putative formula: C10H21NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.19,"smiles":null,"spectrum_id":"CCMSLIB00017230887","spectrum_index":12652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 356.1705 Da; putative annotation: N/A; putative formula: C16H28N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.246,"smiles":null,"spectrum_id":"CCMSLIB00017230889","spectrum_index":12653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 108.0422 Da; putative annotation: N/A; putative formula: C4H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.107,"smiles":null,"spectrum_id":"CCMSLIB00017230891","spectrum_index":12654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Fluorophenyl)azepane (delta mass: 97.0622 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.196,"smiles":null,"spectrum_id":"CCMSLIB00017230892","spectrum_index":12655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-3-piperidinamine (delta mass: 8.9385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.056,"smiles":null,"spectrum_id":"CCMSLIB00017230895","spectrum_index":12656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 26.0157 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.07,"smiles":null,"spectrum_id":"CCMSLIB00017230897","spectrum_index":12657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE - 20.0 eV (delta mass: 40.8964 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.941,"smiles":null,"spectrum_id":"CCMSLIB00017230899","spectrum_index":12658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 27.0466 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.148,"smiles":null,"spectrum_id":"CCMSLIB00017230901","spectrum_index":12659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ellipticine CollisionEnergy:205060 (delta mass: 72.0537 Da; putative annotation: N/A; putative formula: H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.177,"smiles":null,"spectrum_id":"CCMSLIB00017230904","spectrum_index":12660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 40.9713 Da; putative annotation: N/A; putative formula: C16H23N7O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.03,"smiles":null,"spectrum_id":"CCMSLIB00017230905","spectrum_index":12661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 11.0162 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.06,"smiles":null,"spectrum_id":"CCMSLIB00017230908","spectrum_index":12662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Palmitoyl-2-oleoyl-sn-glycerol from NIST14 (delta mass: 395.4141 Da; putative annotation: N/A; putative formula: C26H53NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.944,"smiles":null,"spectrum_id":"CCMSLIB00017230909","spectrum_index":12663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 181.041 Da; putative annotation: N/A; putative formula: C5H11NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.137,"smiles":null,"spectrum_id":"CCMSLIB00017230912","spectrum_index":12664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 30.0111 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.123,"smiles":null,"spectrum_id":"CCMSLIB00017230914","spectrum_index":12665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Isopropyl-1H-benzimidazole-2-thiol (delta mass: 152.0544 Da; putative annotation: N/A; putative formula: C2H8N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.134,"smiles":null,"spectrum_id":"CCMSLIB00017230916","spectrum_index":12666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stigmaydene Y (delta mass: 62.0516 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.273,"smiles":null,"spectrum_id":"CCMSLIB00017230918","spectrum_index":12667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 175.11 Da; putative annotation: N/A; putative formula: C10H13N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.238,"smiles":null,"spectrum_id":"CCMSLIB00017230920","spectrum_index":12668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 92.0627 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.341,"smiles":null,"spectrum_id":"CCMSLIB00017230921","spectrum_index":12669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 18.0773 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.155,"smiles":null,"spectrum_id":"CCMSLIB00017230924","spectrum_index":12670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 30.0804 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.151,"smiles":null,"spectrum_id":"CCMSLIB00017230926","spectrum_index":12671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 86.0521 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017230928","spectrum_index":12672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 51.9945 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.055,"smiles":null,"spectrum_id":"CCMSLIB00017230930","spectrum_index":12673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 15.0159 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.102,"smiles":null,"spectrum_id":"CCMSLIB00017230931","spectrum_index":12674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Nitrophenethyl alcohol (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017230934","spectrum_index":12675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017230935","spectrum_index":12676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Teusalvin C (delta mass: 161.0693 Da; putative annotation: N/A; putative formula: C7H15NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.25,"smiles":null,"spectrum_id":"CCMSLIB00017230936","spectrum_index":12677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 351.0952 Da; putative annotation: N/A; putative formula: C16H17NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.155,"smiles":null,"spectrum_id":"CCMSLIB00017230939","spectrum_index":12678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoerucin (delta mass: 246.2329 Da; putative annotation: N/A; putative formula: C18H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.595,"smiles":null,"spectrum_id":"CCMSLIB00017230940","spectrum_index":12679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 309.1514 Da; putative annotation: N/A; putative formula: C15H23N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.192,"smiles":null,"spectrum_id":"CCMSLIB00017230943","spectrum_index":12680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 166.1051 Da; putative annotation: N/A; putative formula: C9H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.327,"smiles":null,"spectrum_id":"CCMSLIB00017230944","spectrum_index":12681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 15.0359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.122,"smiles":null,"spectrum_id":"CCMSLIB00017230946","spectrum_index":12682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 41.883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.99,"smiles":null,"spectrum_id":"CCMSLIB00017230948","spectrum_index":12683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 266.2618 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.343,"smiles":null,"spectrum_id":"CCMSLIB00017230949","spectrum_index":12684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 144.1305 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.326,"smiles":null,"spectrum_id":"CCMSLIB00017230952","spectrum_index":12685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Piperidinyl)-2-pyrrolidinone (delta mass: 287.1478 Da; putative annotation: N/A; putative formula: C12H21N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.281,"smiles":null,"spectrum_id":"CCMSLIB00017230953","spectrum_index":12686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 64.0672 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.279,"smiles":null,"spectrum_id":"CCMSLIB00017230955","spectrum_index":12687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 378.1145 Da; putative annotation: N/A; putative formula: C20H26OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.175,"smiles":null,"spectrum_id":"CCMSLIB00017230957","spectrum_index":12688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 263.0905 Da; putative annotation: N/A; putative formula: C12H13N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.177,"smiles":null,"spectrum_id":"CCMSLIB00017230959","spectrum_index":12689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 50.0184 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.063,"smiles":null,"spectrum_id":"CCMSLIB00017230961","spectrum_index":12690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Dilinolenin (9c,12c,15c) from NIST14 (delta mass: 109.1173 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.6,"smiles":null,"spectrum_id":"CCMSLIB00017230963","spectrum_index":12691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 347.264 Da; putative annotation: N/A; putative formula: C22H37NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.486,"smiles":null,"spectrum_id":"CCMSLIB00017230965","spectrum_index":12692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9S,11R-Epidioxy-15S-hydroxy-13E-prostaenoic acid from NIST14 (delta mass: 48.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.28,"smiles":null,"spectrum_id":"CCMSLIB00017230967","spectrum_index":12693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 408.1651 Da; putative annotation: N/A; putative formula: C19H36OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.26,"smiles":null,"spectrum_id":"CCMSLIB00017230969","spectrum_index":12694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chelidonine (delta mass: 18.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.217,"smiles":null,"spectrum_id":"CCMSLIB00017230971","spectrum_index":12695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 172.1099 Da; putative annotation: N/A; putative formula: C9H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.263,"smiles":null,"spectrum_id":"CCMSLIB00017230974","spectrum_index":12696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 30.0204 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.071,"smiles":null,"spectrum_id":"CCMSLIB00017230975","spectrum_index":12697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Carboxybenzeneboronic acid (delta mass: 56.0355 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.087,"smiles":null,"spectrum_id":"CCMSLIB00017230978","spectrum_index":12698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 314.2454 Da; putative annotation: N/A; putative formula: C18H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.483,"smiles":null,"spectrum_id":"CCMSLIB00017230979","spectrum_index":12699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 323.3184 Da; putative annotation: N/A; putative formula: C21H41NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.43,"smiles":null,"spectrum_id":"CCMSLIB00017230981","spectrum_index":12700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 13.0316 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017230983","spectrum_index":12701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydodecanoic acid (delta mass: 70.0773 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.257,"smiles":null,"spectrum_id":"CCMSLIB00017230985","spectrum_index":12702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trichoclin (delta mass: 133.1127 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.204,"smiles":null,"spectrum_id":"CCMSLIB00017230987","spectrum_index":12703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 15.0107 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.128,"smiles":null,"spectrum_id":"CCMSLIB00017230988","spectrum_index":12704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 197.0837 Da; putative annotation: N/A; putative formula: C13H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.17,"smiles":null,"spectrum_id":"CCMSLIB00017230991","spectrum_index":12705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monopalmitolein (9c) from NIST14 (delta mass: 470.4129 Da; putative annotation: N/A; putative formula: C32H54O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.682,"smiles":null,"spectrum_id":"CCMSLIB00017230992","spectrum_index":12706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 250.0686 Da; putative annotation: N/A; putative formula: C9H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.123,"smiles":null,"spectrum_id":"CCMSLIB00017230994","spectrum_index":12707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 405.1277 Da; putative annotation: N/A; putative formula: C19H24N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.188,"smiles":null,"spectrum_id":"CCMSLIB00017230996","spectrum_index":12708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 69.9937 Da; putative annotation: N/A; putative formula: C5H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.091,"smiles":null,"spectrum_id":"CCMSLIB00017230998","spectrum_index":12709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12,13-Dihydroxy-9Z-octadecenoic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.263,"smiles":null,"spectrum_id":"CCMSLIB00017231000","spectrum_index":12710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isomyristic acid (delta mass: 124.0523 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.268,"smiles":null,"spectrum_id":"CCMSLIB00017231002","spectrum_index":12711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 12.0243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.111,"smiles":null,"spectrum_id":"CCMSLIB00017231003","spectrum_index":12712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 297.1729 Da; putative annotation: N/A; putative formula: C19H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.332,"smiles":null,"spectrum_id":"CCMSLIB00017231006","spectrum_index":12713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 335.1479 Da; putative annotation: N/A; putative formula: C16H21N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.271,"smiles":null,"spectrum_id":"CCMSLIB00017231007","spectrum_index":12714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 84.0944 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017231010","spectrum_index":12715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 43.0425 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017231011","spectrum_index":12716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 148.0981 Da; putative annotation: N/A; putative formula: C9H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.164,"smiles":null,"spectrum_id":"CCMSLIB00017231013","spectrum_index":12717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 618.4616 Da; putative annotation: N/A; putative formula: C37H58N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.693,"smiles":null,"spectrum_id":"CCMSLIB00017231015","spectrum_index":12718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 61.0274 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.28,"smiles":null,"spectrum_id":"CCMSLIB00017231017","spectrum_index":12719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 314.2432 Da; putative annotation: N/A; putative formula: C22H34O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.47,"smiles":null,"spectrum_id":"CCMSLIB00017231019","spectrum_index":12720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 248.0935 Da; putative annotation: N/A; putative formula: C10H13N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.461,"smiles":null,"spectrum_id":"CCMSLIB00017231020","spectrum_index":12721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyoctadecanoic acid (delta mass: 23.0153 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.289,"smiles":null,"spectrum_id":"CCMSLIB00017231023","spectrum_index":12722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 260.02 Da; putative annotation: N/A; putative formula: C6H12O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.403,"smiles":null,"spectrum_id":"CCMSLIB00017231024","spectrum_index":12723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 373.2816 Da; putative annotation: N/A; putative formula: C17H31N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.508,"smiles":null,"spectrum_id":"CCMSLIB00017231026","spectrum_index":12724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1773416 - 40.0 eV (delta mass: 57.0213 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.134,"smiles":null,"spectrum_id":"CCMSLIB00017231028","spectrum_index":12725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butaprost (free acid) (delta mass: 48.0363 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.315,"smiles":null,"spectrum_id":"CCMSLIB00017231029","spectrum_index":12726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 16.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.216,"smiles":null,"spectrum_id":"CCMSLIB00017231031","spectrum_index":12727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 228.1727 Da; putative annotation: N/A; putative formula: C13H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.248,"smiles":null,"spectrum_id":"CCMSLIB00017231033","spectrum_index":12728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 360.1572 Da; putative annotation: N/A; putative formula: C20H24O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":827.365,"smiles":null,"spectrum_id":"CCMSLIB00017231035","spectrum_index":12729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.238,"smiles":null,"spectrum_id":"CCMSLIB00017231037","spectrum_index":12730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 119.0388 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.079,"smiles":null,"spectrum_id":"CCMSLIB00017231039","spectrum_index":12731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 406.0894 Da; putative annotation: N/A; putative formula: C17H14N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.128,"smiles":null,"spectrum_id":"CCMSLIB00017231041","spectrum_index":12732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 183.0644 Da; putative annotation: N/A; putative formula: C7H9N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.213,"smiles":null,"spectrum_id":"CCMSLIB00017231043","spectrum_index":12733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 287.1488 Da; putative annotation: N/A; putative formula: C13H25N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.303,"smiles":null,"spectrum_id":"CCMSLIB00017231044","spectrum_index":12734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 41.9992 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.06,"smiles":null,"spectrum_id":"CCMSLIB00017231047","spectrum_index":12735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 106.0779 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.362,"smiles":null,"spectrum_id":"CCMSLIB00017231048","spectrum_index":12736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 238.2294 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.472,"smiles":null,"spectrum_id":"CCMSLIB00017231050","spectrum_index":12737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,8-Difluoro-3-azabicyclo[3.2.1]octane (delta mass: 60.0403 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017231052","spectrum_index":12738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 129.0788 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.165,"smiles":null,"spectrum_id":"CCMSLIB00017231053","spectrum_index":12739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 21.9849 Da; putative annotation: N/A; putative formula: C2H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.061,"smiles":null,"spectrum_id":"CCMSLIB00017231056","spectrum_index":12740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine-methyl-ester (EME) (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017231058","spectrum_index":12741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 122.1103 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.358,"smiles":null,"spectrum_id":"CCMSLIB00017231059","spectrum_index":12742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 60.0194 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.09,"smiles":null,"spectrum_id":"CCMSLIB00017231062","spectrum_index":12743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 380.1681 Da; putative annotation: N/A; putative formula: C16H28O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.239,"smiles":null,"spectrum_id":"CCMSLIB00017231063","spectrum_index":12744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Dihydrocortisol (delta mass: 36.0374 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.27,"smiles":null,"spectrum_id":"CCMSLIB00017231065","spectrum_index":12745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 678.5049 Da; putative annotation: N/A; putative formula: C44H70O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.596,"smiles":null,"spectrum_id":"CCMSLIB00017231067","spectrum_index":12746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 13.4004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.476,"smiles":null,"spectrum_id":"CCMSLIB00017231068","spectrum_index":12747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:205060 (delta mass: 154.0104 Da; putative annotation: N/A; putative formula: C7H8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.055,"smiles":null,"spectrum_id":"CCMSLIB00017231071","spectrum_index":12748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 40.0309 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017231072","spectrum_index":12749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(hydroxymethyl)-2-methyl-2-(5-oxooxolan-2-yl)-3H-chromen-4-one (delta mass: 18.0219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.124,"smiles":null,"spectrum_id":"CCMSLIB00017231075","spectrum_index":12750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 309.1071 Da; putative annotation: N/A; putative formula: C22H16NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.188,"smiles":null,"spectrum_id":"CCMSLIB00017231076","spectrum_index":12751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 180.0636 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.311,"smiles":null,"spectrum_id":"CCMSLIB00017231079","spectrum_index":12752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 54.0466 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.221,"smiles":null,"spectrum_id":"CCMSLIB00017231080","spectrum_index":12753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 60.0 eV (delta mass: 57.0644 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.156,"smiles":null,"spectrum_id":"CCMSLIB00017231082","spectrum_index":12754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 297.2708 Da; putative annotation: N/A; putative formula: C17H36N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.461,"smiles":null,"spectrum_id":"CCMSLIB00017231084","spectrum_index":12755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 36.9953 Da; putative annotation: N/A; putative formula: C2H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.066,"smiles":null,"spectrum_id":"CCMSLIB00017231086","spectrum_index":12756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HOMOGENTISATE (delta mass: 40.0505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017231088","spectrum_index":12757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-2-methylbutyric acid (delta mass: 9.8806 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.951,"smiles":null,"spectrum_id":"CCMSLIB00017231090","spectrum_index":12758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 156.1072 Da; putative annotation: N/A; putative formula: C9H17P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.219,"smiles":null,"spectrum_id":"CCMSLIB00017231092","spectrum_index":12759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 184.0871 Da; putative annotation: N/A; putative formula: C7H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.163,"smiles":null,"spectrum_id":"CCMSLIB00017231094","spectrum_index":12760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 142.0628 Da; putative annotation: N/A; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.316,"smiles":null,"spectrum_id":"CCMSLIB00017231096","spectrum_index":12761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bis(2-hydroxyethyl) phthalate (delta mass: 359.1943 Da; putative annotation: N/A; putative formula: C17H29NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.281,"smiles":null,"spectrum_id":"CCMSLIB00017231098","spectrum_index":12762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desoxypipradrol (delta mass: 196.1309 Da; putative annotation: N/A; putative formula: C5H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.306,"smiles":null,"spectrum_id":"CCMSLIB00017231100","spectrum_index":12763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-MANNOSAMINE (delta mass: 212.1522 Da; putative annotation: Ile-Val; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.249,"smiles":null,"spectrum_id":"CCMSLIB00017231102","spectrum_index":12764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[17.3.2.0<1,18>.0<4,17>.0<5,14>.0< 8,13>]tetracosan-10-ol CollisionEnergy:102040\"\" (delta mass: 424.3716 Da; putative annotation: Uvaol; putative formula: C30H48O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":867.76,"smiles":null,"spectrum_id":"CCMSLIB00017231104","spectrum_index":12765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monopalmitolein (9c) from NIST14 (delta mass: 278.225 Da; putative annotation: 9(10)-Epoxy-12Z-octadecenoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.494,"smiles":null,"spectrum_id":"CCMSLIB00017231106","spectrum_index":12766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000104 5-hydroxyculmorin|(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol (delta mass: 190.1724 Da; putative annotation: 1-Ethynylcyclododecanol; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017231108","spectrum_index":12767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 850.4752 Da; putative annotation: Dioscin; putative formula: C45H70O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1193.6,"smiles":null,"spectrum_id":"CCMSLIB00017231110","spectrum_index":12768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 128.1196 Da; putative annotation: 1,8-Octanediol; putative formula: C8H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.383,"smiles":null,"spectrum_id":"CCMSLIB00017231112","spectrum_index":12769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 122.0366 Da; putative annotation: 2-Methoxy-1,4-benzenediol; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017231114","spectrum_index":12770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-hydroxy-3-(hydroxymethyl)pentyl]-8a-(hydroxymethyl)-5,6-dimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid (delta mass: 148.1252 Da; putative annotation: (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.373,"smiles":null,"spectrum_id":"CCMSLIB00017231117","spectrum_index":12771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 310.2144 Da; putative annotation: (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.425,"smiles":null,"spectrum_id":"CCMSLIB00017231118","spectrum_index":12772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 220.1829 Da; putative annotation: Jaeskeanadiol; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.368,"smiles":null,"spectrum_id":"CCMSLIB00017231121","spectrum_index":12773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 308.0892 Da; putative annotation: NCGC00385000-01_C15H18O8_beta-D-Glucopyranose, 1-O-[(2E)-3-(2-hydroxyphenyl)-1-oxo-2-propen-1-yl]-; putative formula: C15H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.17,"smiles":null,"spectrum_id":"CCMSLIB00017231122","spectrum_index":12774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 236.2114 Da; putative annotation: (2R)-1-(2-Hydroxyethyl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":855.741,"smiles":null,"spectrum_id":"CCMSLIB00017231123","spectrum_index":12775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 697.5122 Da; putative annotation: 2-Linoleoyl-1-palmitoyl-sn-glycero-3-phosphoethanolamine; putative formula: C39H72NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.723,"smiles":null,"spectrum_id":"CCMSLIB00017231126","spectrum_index":12776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 172.0519 Da; putative annotation: 7-Hydroxy-4,8-dimethyl-2H-chromen-2-one; putative formula: C11H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.181,"smiles":null,"spectrum_id":"CCMSLIB00017231127","spectrum_index":12777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 307.2549 Da; putative annotation: Gly-C17:1; putative formula: C19H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.497,"smiles":null,"spectrum_id":"CCMSLIB00017231130","spectrum_index":12778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 179.0713 Da; putative annotation: 4-Amino-3-(4-fluorophenyl)butanoic acid; putative formula: C10H10FNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.136,"smiles":null,"spectrum_id":"CCMSLIB00017231131","spectrum_index":12779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 254.2267 Da; putative annotation: DL-.beta.-Hydroxypalmitic acid; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.49,"smiles":null,"spectrum_id":"CCMSLIB00017231134","spectrum_index":12780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 226.1075 Da; putative annotation: 3-Benzylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione; putative formula: C14H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.261,"smiles":null,"spectrum_id":"CCMSLIB00017231135","spectrum_index":12781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 306.2204 Da; putative annotation: allo-Protolichesterinic acid; putative formula: C19H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.432,"smiles":null,"spectrum_id":"CCMSLIB00017231138","spectrum_index":12782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 146.0851 Da; putative annotation: 7-Methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol; putative formula: C9H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.15,"smiles":null,"spectrum_id":"CCMSLIB00017231139","spectrum_index":12783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 152.1207 Da; putative annotation: (R)-(+)-Citronellic acid; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.186,"smiles":null,"spectrum_id":"CCMSLIB00017231142","spectrum_index":12784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 279.2564 Da; putative annotation: Palmitoleoyl ethanolamide; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.457,"smiles":null,"spectrum_id":"CCMSLIB00017231144","spectrum_index":12785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 74.0351 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.116,"smiles":null,"spectrum_id":"CCMSLIB00017231146","spectrum_index":12786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aspochalasin T (delta mass: 170.1146 Da; putative annotation: N/A; putative formula: C3H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.373,"smiles":null,"spectrum_id":"CCMSLIB00017231148","spectrum_index":12787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 150.141 Da; putative annotation: N/A; putative formula: C11H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.216,"smiles":null,"spectrum_id":"CCMSLIB00017231150","spectrum_index":12788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dihydroxy-5Z,8Z,11Z,17Z-eicosatetraenoic acid (delta mass: 35.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017231152","spectrum_index":12789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.066,"smiles":null,"spectrum_id":"CCMSLIB00017231154","spectrum_index":12790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 288.1787 Da; putative annotation: N/A; putative formula: C14H29N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.213,"smiles":null,"spectrum_id":"CCMSLIB00017231156","spectrum_index":12791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 236.0664 Da; putative annotation: N/A; putative formula: C16H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.163,"smiles":null,"spectrum_id":"CCMSLIB00017231159","spectrum_index":12792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 74.0363 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.221,"smiles":null,"spectrum_id":"CCMSLIB00017231160","spectrum_index":12793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 410.2426 Da; putative annotation: N/A; putative formula: C22H38N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.522,"smiles":null,"spectrum_id":"CCMSLIB00017231161","spectrum_index":12794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1a,1b-Dihomoprostaglandin E1 (delta mass: 36.0382 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.317,"smiles":null,"spectrum_id":"CCMSLIB00017231164","spectrum_index":12795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 42.0099 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.252,"smiles":null,"spectrum_id":"CCMSLIB00017231165","spectrum_index":12796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 281.0902 Da; putative annotation: N/A; putative formula: C8H12N9OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.214,"smiles":null,"spectrum_id":"CCMSLIB00017231168","spectrum_index":12797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentazocine (delta mass: 176.0324 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.249,"smiles":null,"spectrum_id":"CCMSLIB00017231169","spectrum_index":12798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aspochalasin T (delta mass: 62.0518 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.311,"smiles":null,"spectrum_id":"CCMSLIB00017231172","spectrum_index":12799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 56.0622 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.196,"smiles":null,"spectrum_id":"CCMSLIB00017231173","spectrum_index":12800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 59.9999 Da; putative annotation: N/A; putative formula: C5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.102,"smiles":null,"spectrum_id":"CCMSLIB00017231175","spectrum_index":12801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4a-Dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.237,"smiles":null,"spectrum_id":"CCMSLIB00017231177","spectrum_index":12802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 340.1139 Da; putative annotation: N/A; putative formula: C13H20N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.185,"smiles":null,"spectrum_id":"CCMSLIB00017231178","spectrum_index":12803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 137.1631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.384,"smiles":null,"spectrum_id":"CCMSLIB00017231181","spectrum_index":12804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,10-Bisaboladiene-1,4-diol (delta mass: 48.0357 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.236,"smiles":null,"spectrum_id":"CCMSLIB00017231182","spectrum_index":12805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 72.0364 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017231184","spectrum_index":12806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 122.0559 Da; putative annotation: N/A; putative formula: C8H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.133,"smiles":null,"spectrum_id":"CCMSLIB00017231186","spectrum_index":12807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 55.0515 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.106,"smiles":null,"spectrum_id":"CCMSLIB00017231187","spectrum_index":12808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Amino(cyclohexyl)acetic acid ethyl ester (delta mass: 22.0208 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.17,"smiles":null,"spectrum_id":"CCMSLIB00017231190","spectrum_index":12809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 788.2776 Da; putative annotation: N/A; putative formula: C38H44N8O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":969.318,"smiles":null,"spectrum_id":"CCMSLIB00017231191","spectrum_index":12810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 182.1664 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.279,"smiles":null,"spectrum_id":"CCMSLIB00017231194","spectrum_index":12811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,8,11,14-Pentaoxahexadecan-16-ol (delta mass: 102.0684 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.233,"smiles":null,"spectrum_id":"CCMSLIB00017231195","spectrum_index":12812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aleuretic Acid (delta mass: 94.0783 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.311,"smiles":null,"spectrum_id":"CCMSLIB00017231197","spectrum_index":12813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Fluorobenzene-1,3-dicarboxylic acid (delta mass: 65.0703 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.095,"smiles":null,"spectrum_id":"CCMSLIB00017231199","spectrum_index":12814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 162.0529 Da; putative annotation: N/A; putative formula: C7H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.118,"smiles":null,"spectrum_id":"CCMSLIB00017231201","spectrum_index":12815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinolcarboxylic acid (delta mass: 116.026 Da; putative annotation: N/A; putative formula: C8H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.055,"smiles":null,"spectrum_id":"CCMSLIB00017231204","spectrum_index":12816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 241.0818 Da; putative annotation: N/A; putative formula: C9H15N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.22,"smiles":null,"spectrum_id":"CCMSLIB00017231205","spectrum_index":12817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 387.1376 Da; putative annotation: N/A; putative formula: C13H25NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.218,"smiles":null,"spectrum_id":"CCMSLIB00017231208","spectrum_index":12818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLIC ACID (delta mass: 31.0427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.082,"smiles":null,"spectrum_id":"CCMSLIB00017231209","spectrum_index":12819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 326.2595 Da; putative annotation: N/A; putative formula: C17H35N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.356,"smiles":null,"spectrum_id":"CCMSLIB00017231211","spectrum_index":12820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androstan-3.beta.-ol (delta mass: 64.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.316,"smiles":null,"spectrum_id":"CCMSLIB00017231213","spectrum_index":12821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Pyrrol-1-yl)piperidine (delta mass: 129.079 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.202,"smiles":null,"spectrum_id":"CCMSLIB00017231215","spectrum_index":12822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 61.0265 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.061,"smiles":null,"spectrum_id":"CCMSLIB00017231217","spectrum_index":12823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 884.2511 Da; putative annotation: N/A; putative formula: C43H44N6O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1045.31,"smiles":null,"spectrum_id":"CCMSLIB00017231218","spectrum_index":12824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 103.0088 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.241,"smiles":null,"spectrum_id":"CCMSLIB00017231220","spectrum_index":12825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 456.2655 Da; putative annotation: N/A; putative formula: C25H37N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.306,"smiles":null,"spectrum_id":"CCMSLIB00017231222","spectrum_index":12826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6H-Indolo[2,3-b]quinoline (delta mass: 26.0154 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.107,"smiles":null,"spectrum_id":"CCMSLIB00017231224","spectrum_index":12827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 16.0159 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.149,"smiles":null,"spectrum_id":"CCMSLIB00017231226","spectrum_index":12828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxydecanoic acid (delta mass: 179.0788 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.227,"smiles":null,"spectrum_id":"CCMSLIB00017231228","spectrum_index":12829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 83.0402 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.095,"smiles":null,"spectrum_id":"CCMSLIB00017231229","spectrum_index":12830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 74.0374 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.16,"smiles":null,"spectrum_id":"CCMSLIB00017231232","spectrum_index":12831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 12.1391 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.189,"smiles":null,"spectrum_id":"CCMSLIB00017231233","spectrum_index":12832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 48.0521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.117,"smiles":null,"spectrum_id":"CCMSLIB00017231235","spectrum_index":12833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 185.1053 Da; putative annotation: N/A; putative formula: C9H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.155,"smiles":null,"spectrum_id":"CCMSLIB00017231237","spectrum_index":12834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 375.1619 Da; putative annotation: N/A; putative formula: C19H25N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.203,"smiles":null,"spectrum_id":"CCMSLIB00017231239","spectrum_index":12835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 461.1894 Da; putative annotation: N/A; putative formula: C33H23N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.25,"smiles":null,"spectrum_id":"CCMSLIB00017231241","spectrum_index":12836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HAPLAMINE CollisionEnergy:102040 (delta mass: 45.7715 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.884,"smiles":null,"spectrum_id":"CCMSLIB00017231243","spectrum_index":12837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 105.079 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.342,"smiles":null,"spectrum_id":"CCMSLIB00017231244","spectrum_index":12838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 31.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.264,"smiles":null,"spectrum_id":"CCMSLIB00017231247","spectrum_index":12839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.315,"smiles":null,"spectrum_id":"CCMSLIB00017231248","spectrum_index":12840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxyvalerenic acid (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.174,"smiles":null,"spectrum_id":"CCMSLIB00017231250","spectrum_index":12841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 145.0736 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.176,"smiles":null,"spectrum_id":"CCMSLIB00017231252","spectrum_index":12842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Muricholic acid (delta mass: 132.097 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.392,"smiles":null,"spectrum_id":"CCMSLIB00017231253","spectrum_index":12843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 95.0946 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.306,"smiles":null,"spectrum_id":"CCMSLIB00017231256","spectrum_index":12844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 77.0477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.285,"smiles":null,"spectrum_id":"CCMSLIB00017231257","spectrum_index":12845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 354.2765 Da; putative annotation: N/A; putative formula: C21H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.508,"smiles":null,"spectrum_id":"CCMSLIB00017231260","spectrum_index":12846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 81.0428 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.311,"smiles":null,"spectrum_id":"CCMSLIB00017231261","spectrum_index":12847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16.alpha.-Hydroxypregnenolone (delta mass: 114.9949 Da; putative annotation: N/A; putative formula: CHN5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.237,"smiles":null,"spectrum_id":"CCMSLIB00017231263","spectrum_index":12848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 207.0531 Da; putative annotation: N/A; putative formula: C10H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.134,"smiles":null,"spectrum_id":"CCMSLIB00017231265","spectrum_index":12849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 524.1972 Da; putative annotation: N/A; putative formula: C22H33N6O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.257,"smiles":null,"spectrum_id":"CCMSLIB00017231267","spectrum_index":12850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.beta.,8.alpha.,9.beta.,10.alpha.,13.alpha.,16.beta.)-16-Hydroxy-17-((3-methylbutanoyl)oxy)kauran-18-oic acid (delta mass: 114.0824 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.377,"smiles":null,"spectrum_id":"CCMSLIB00017231270","spectrum_index":12851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 128.0512 Da; putative annotation: N/A; putative formula: C5H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.227,"smiles":null,"spectrum_id":"CCMSLIB00017231271","spectrum_index":12852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 60.0048 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.169,"smiles":null,"spectrum_id":"CCMSLIB00017231274","spectrum_index":12853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380401-01!6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-2-ethyl-3,4-dihydroxy-3,3a-dimethyl-2,4,5,6a-tetrahydrofuro[2,3-b]furan-5-yl]hexa-1,3,5-trienyl]-4-methoxy-5-methylpyran-2-one (delta mass: 418.2051 Da; putative annotation: N/A; putative formula: C14H22N14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":837.411,"smiles":null,"spectrum_id":"CCMSLIB00017231275","spectrum_index":12854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 319.1308 Da; putative annotation: N/A; putative formula: C13H18N7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.232,"smiles":null,"spectrum_id":"CCMSLIB00017231276","spectrum_index":12855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 343.3096 Da; putative annotation: N/A; putative formula: C21H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.552,"smiles":null,"spectrum_id":"CCMSLIB00017231279","spectrum_index":12856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 297.2674 Da; putative annotation: N/A; putative formula: C18H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.52,"smiles":null,"spectrum_id":"CCMSLIB00017231280","spectrum_index":12857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 23.9966 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.083,"smiles":null,"spectrum_id":"CCMSLIB00017231282","spectrum_index":12858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 194.1675 Da; putative annotation: N/A; putative formula: C13H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.301,"smiles":null,"spectrum_id":"CCMSLIB00017231284","spectrum_index":12859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ285303 Benserazide|2-amino-3-hydroxy-N`-(2,3,4-trihydroxybenzyl)propionohydrazide (delta mass: 70.0485 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.157,"smiles":null,"spectrum_id":"CCMSLIB00017231286","spectrum_index":12860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 189.1003 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.171,"smiles":null,"spectrum_id":"CCMSLIB00017231287","spectrum_index":12861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Longicaulenone (delta mass: 149.0839 Da; putative annotation: N/A; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.212,"smiles":null,"spectrum_id":"CCMSLIB00017231290","spectrum_index":12862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid (delta mass: 16.9898 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.232,"smiles":null,"spectrum_id":"CCMSLIB00017231291","spectrum_index":12863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 81.9732 Da; putative annotation: N/A; putative formula: CH-2N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.189,"smiles":null,"spectrum_id":"CCMSLIB00017231293","spectrum_index":12864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Idebenone (delta mass: 102.0368 Da; putative annotation: N/A; putative formula: C2H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.253,"smiles":null,"spectrum_id":"CCMSLIB00017231295","spectrum_index":12865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-(3-Hydroxy-2,2,5a-trimethyl-7-methylidenedecahydro-1-benzoxepin-6-yl)ethyl)-2,2,5a,7-tetramethyldecahydro-1-benzoxepine-3,4,6-triol (delta mass: 100.0657 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.449,"smiles":null,"spectrum_id":"CCMSLIB00017231296","spectrum_index":12866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indolmycin (delta mass: 406.174 Da; putative annotation: N/A; putative formula: C20H26N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.298,"smiles":null,"spectrum_id":"CCMSLIB00017231299","spectrum_index":12867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 372.101 Da; putative annotation: N/A; putative formula: C24H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.203,"smiles":null,"spectrum_id":"CCMSLIB00017231300","spectrum_index":12868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 139.0784 Da; putative annotation: N/A; putative formula: C11H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.185,"smiles":null,"spectrum_id":"CCMSLIB00017231301","spectrum_index":12869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 17.0704 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.136,"smiles":null,"spectrum_id":"CCMSLIB00017231304","spectrum_index":12870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 156.0419 Da; putative annotation: N/A; putative formula: C7H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.258,"smiles":null,"spectrum_id":"CCMSLIB00017231305","spectrum_index":12871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 162.1407 Da; putative annotation: N/A; putative formula: C12H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.383,"smiles":null,"spectrum_id":"CCMSLIB00017231308","spectrum_index":12872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 82.0219 Da; putative annotation: N/A; putative formula: C8H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.119,"smiles":null,"spectrum_id":"CCMSLIB00017231309","spectrum_index":12873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 388.0692 Da; putative annotation: N/A; putative formula: C13H16N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.213,"smiles":null,"spectrum_id":"CCMSLIB00017231310","spectrum_index":12874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 162.0529 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.187,"smiles":null,"spectrum_id":"CCMSLIB00017231313","spectrum_index":12875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 286.1826 Da; putative annotation: N/A; putative formula: C13H26N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.322,"smiles":null,"spectrum_id":"CCMSLIB00017231314","spectrum_index":12876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1055.3311 Da; putative annotation: N/A; putative formula: C63H54N5O5PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1277.43,"smiles":null,"spectrum_id":"CCMSLIB00017231316","spectrum_index":12877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACETIC ACID (delta mass: 136.0614 Da; putative annotation: N/A; putative formula: C3H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.132,"smiles":null,"spectrum_id":"CCMSLIB00017231318","spectrum_index":12878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 130.049 Da; putative annotation: N/A; putative formula: C3H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.136,"smiles":null,"spectrum_id":"CCMSLIB00017231320","spectrum_index":12879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 102.0478 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.155,"smiles":null,"spectrum_id":"CCMSLIB00017231323","spectrum_index":12880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 64.0676 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.154,"smiles":null,"spectrum_id":"CCMSLIB00017231324","spectrum_index":12881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 76.0673 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.315,"smiles":null,"spectrum_id":"CCMSLIB00017231327","spectrum_index":12882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Colubrinic acid (delta mass: 120.0215 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.368,"smiles":null,"spectrum_id":"CCMSLIB00017231328","spectrum_index":12883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 38.0049 Da; putative annotation: N/A; putative formula: H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.112,"smiles":null,"spectrum_id":"CCMSLIB00017231330","spectrum_index":12884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxo-4-cholestenoic acid (delta mass: 26.0193 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.34,"smiles":null,"spectrum_id":"CCMSLIB00017231332","spectrum_index":12885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Dimethyl-2-(.beta.-carboxyethyl)-6-hydroxychroman (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017231334","spectrum_index":12886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOATE - 50.0 eV (delta mass: 153.075 Da; putative annotation: N/A; putative formula: C4H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.13,"smiles":null,"spectrum_id":"CCMSLIB00017231336","spectrum_index":12887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-4-methylcoumarin-3-acetic acid (delta mass: 193.0551 Da; putative annotation: N/A; putative formula: C4H12N5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.11,"smiles":null,"spectrum_id":"CCMSLIB00017231338","spectrum_index":12888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 126.0889 Da; putative annotation: N/A; putative formula: C5H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.352,"smiles":null,"spectrum_id":"CCMSLIB00017231341","spectrum_index":12889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclooctatin (delta mass: 76.0684 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.327,"smiles":null,"spectrum_id":"CCMSLIB00017231342","spectrum_index":12890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 376.3363 Da; putative annotation: N/A; putative formula: C24H45N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.407,"smiles":null,"spectrum_id":"CCMSLIB00017231345","spectrum_index":12891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coumaroyl putrescin (delta mass: 147.0792 Da; putative annotation: N/A; putative formula: C8H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.223,"smiles":null,"spectrum_id":"CCMSLIB00017231346","spectrum_index":12892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 57.3899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.46,"smiles":null,"spectrum_id":"CCMSLIB00017231349","spectrum_index":12893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-11-2-1 (delta mass: 35.0364 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.284,"smiles":null,"spectrum_id":"CCMSLIB00017231350","spectrum_index":12894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 119.0583 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.197,"smiles":null,"spectrum_id":"CCMSLIB00017231353","spectrum_index":12895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 66.0475 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.29,"smiles":null,"spectrum_id":"CCMSLIB00017231354","spectrum_index":12896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 191.0423 Da; putative annotation: N/A; putative formula: C10H11NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.113,"smiles":null,"spectrum_id":"CCMSLIB00017231356","spectrum_index":12897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 172.0852 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.167,"smiles":null,"spectrum_id":"CCMSLIB00017231358","spectrum_index":12898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-1H-indole-3-carbaldehyde (delta mass: 238.0756 Da; putative annotation: N/A; putative formula: C12H15O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.097,"smiles":null,"spectrum_id":"CCMSLIB00017231361","spectrum_index":12899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 239.0792 Da; putative annotation: N/A; putative formula: C11H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.192,"smiles":null,"spectrum_id":"CCMSLIB00017231363","spectrum_index":12900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 176.6551 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.752,"smiles":null,"spectrum_id":"CCMSLIB00017231365","spectrum_index":12901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(1H-Benzimidazol-2-yl)-4-fluorobenzamide (delta mass: 161.0417 Da; putative annotation: N/A; putative formula: C8H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.13,"smiles":null,"spectrum_id":"CCMSLIB00017231367","spectrum_index":12902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)acetamide (delta mass: 31.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.144,"smiles":null,"spectrum_id":"CCMSLIB00017231369","spectrum_index":12903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4'-Bipiperidine (delta mass: 308.1264 Da; putative annotation: N/A; putative formula: C11H17N8OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.296,"smiles":null,"spectrum_id":"CCMSLIB00017231371","spectrum_index":12904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-amino-1-piperidinecarboxylate (delta mass: 18.0051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.134,"smiles":null,"spectrum_id":"CCMSLIB00017231373","spectrum_index":12905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 61.0406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.116,"smiles":null,"spectrum_id":"CCMSLIB00017231375","spectrum_index":12906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 76.0882 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017231377","spectrum_index":12907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 144.1509 Da; putative annotation: N/A; putative formula: C5H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.268,"smiles":null,"spectrum_id":"CCMSLIB00017231379","spectrum_index":12908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 106.0428 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.14,"smiles":null,"spectrum_id":"CCMSLIB00017231380","spectrum_index":12909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 60.0244 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.204,"smiles":null,"spectrum_id":"CCMSLIB00017231383","spectrum_index":12910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381117-01!2-amino-4-hydroxy-5-[[1-(4-methoxy-6-oxopyran-2-yl)-3-methylbutyl]amino]-5-oxopentanoic acid (delta mass: 42.0098 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.175,"smiles":null,"spectrum_id":"CCMSLIB00017231384","spectrum_index":12911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of azelaic acid CollisionEnergy:102040 (delta mass: 240.1361 Da; putative annotation: N/A; putative formula: C13H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.248,"smiles":null,"spectrum_id":"CCMSLIB00017231387","spectrum_index":12912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-pyrazolo[3,4-b]pyridin-3-amine (delta mass: 42.0081 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017231388","spectrum_index":12913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Azaspiro[4.5]decane-1,3-dione (delta mass: 18.9945 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017231391","spectrum_index":12914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.081,"smiles":null,"spectrum_id":"CCMSLIB00017231392","spectrum_index":12915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexadecanedioic acid (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.269,"smiles":null,"spectrum_id":"CCMSLIB00017231394","spectrum_index":12916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Isopropylmalic acid (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.102,"smiles":null,"spectrum_id":"CCMSLIB00017231396","spectrum_index":12917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 28.0309 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.07,"smiles":null,"spectrum_id":"CCMSLIB00017231398","spectrum_index":12918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Citronellol (delta mass: 85.0165 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.175,"smiles":null,"spectrum_id":"CCMSLIB00017231400","spectrum_index":12919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 14.9821 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.073,"smiles":null,"spectrum_id":"CCMSLIB00017231402","spectrum_index":12920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8Z,14Z-Eicosadienoic acid (delta mass: 114.083 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.362,"smiles":null,"spectrum_id":"CCMSLIB00017231405","spectrum_index":12921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 218.0437 Da; putative annotation: N/A; putative formula: C9H14O2S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.104,"smiles":null,"spectrum_id":"CCMSLIB00017231407","spectrum_index":12922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 192.0483 Da; putative annotation: N/A; putative formula: CN14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.099,"smiles":null,"spectrum_id":"CCMSLIB00017231409","spectrum_index":12923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 226.1572 Da; putative annotation: N/A; putative formula: C13H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.194,"smiles":null,"spectrum_id":"CCMSLIB00017231411","spectrum_index":12924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 218.1237 Da; putative annotation: N/A; putative formula: C13H18N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.283,"smiles":null,"spectrum_id":"CCMSLIB00017231413","spectrum_index":12925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 147.1387 Da; putative annotation: N/A; putative formula: C11H17NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.199,"smiles":null,"spectrum_id":"CCMSLIB00017231416","spectrum_index":12926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 150.0305 Da; putative annotation: N/A; putative formula: C2H7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.195,"smiles":null,"spectrum_id":"CCMSLIB00017231418","spectrum_index":12927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Tyr from NIST14 (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.14,"smiles":null,"spectrum_id":"CCMSLIB00017231420","spectrum_index":12928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 369.1902 Da; putative annotation: N/A; putative formula: C17H27N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.256,"smiles":null,"spectrum_id":"CCMSLIB00017231422","spectrum_index":12929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 503.2955 Da; putative annotation: N/A; putative formula: C22H41N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":999.635,"smiles":null,"spectrum_id":"CCMSLIB00017231424","spectrum_index":12930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 9.9749 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.15,"smiles":null,"spectrum_id":"CCMSLIB00017231426","spectrum_index":12931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 112.067 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.33,"smiles":null,"spectrum_id":"CCMSLIB00017231428","spectrum_index":12932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 15.0192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.282,"smiles":null,"spectrum_id":"CCMSLIB00017231430","spectrum_index":12933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.065,"smiles":null,"spectrum_id":"CCMSLIB00017231433","spectrum_index":12934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 69.9721 Da; putative annotation: N/A; putative formula: CH-1N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.033,"smiles":null,"spectrum_id":"CCMSLIB00017231434","spectrum_index":12935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 102.0233 Da; putative annotation: N/A; putative formula: C4H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.182,"smiles":null,"spectrum_id":"CCMSLIB00017231437","spectrum_index":12936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arsubin (delta mass: 248.053 Da; putative annotation: N/A; putative formula: C9H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.202,"smiles":null,"spectrum_id":"CCMSLIB00017231438","spectrum_index":12937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 371.2309 Da; putative annotation: N/A; putative formula: C19H33NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.291,"smiles":null,"spectrum_id":"CCMSLIB00017231441","spectrum_index":12938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tauro-alpha-muricholic acid (delta mass: 300.2247 Da; putative annotation: N/A; putative formula: C16H34N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.524,"smiles":null,"spectrum_id":"CCMSLIB00017231442","spectrum_index":12939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aloesin (delta mass: 138.1052 Da; putative annotation: N/A; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.239,"smiles":null,"spectrum_id":"CCMSLIB00017231445","spectrum_index":12940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 207.163 Da; putative annotation: N/A; putative formula: C13H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.286,"smiles":null,"spectrum_id":"CCMSLIB00017231447","spectrum_index":12941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexamethyleneimine (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.133,"smiles":null,"spectrum_id":"CCMSLIB00017231449","spectrum_index":12942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 565.3455 Da; putative annotation: N/A; putative formula: C40H43N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.416,"smiles":null,"spectrum_id":"CCMSLIB00017231451","spectrum_index":12943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 54.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.179,"smiles":null,"spectrum_id":"CCMSLIB00017231453","spectrum_index":12944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET290107 BEZ-da|41859-57-8|4-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide (delta mass: 86.0361 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.115,"smiles":null,"spectrum_id":"CCMSLIB00017231455","spectrum_index":12945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurenoic acid (delta mass: 56.0259 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017231457","spectrum_index":12946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 25.0316 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017231459","spectrum_index":12947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 676.4191 Da; putative annotation: N/A; putative formula: C33H57N8O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":839.479,"smiles":null,"spectrum_id":"CCMSLIB00017231462","spectrum_index":12948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Methyl-5.beta.-androstan-3.alpha.,17.beta.-diol (delta mass: 193.0586 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.322,"smiles":null,"spectrum_id":"CCMSLIB00017231463","spectrum_index":12949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP029401 DL-4-Hydroxyphenyllactic acid|2-hydroxy-2-(4-hydroxyphenyl)propanoic acid (delta mass: 103.0789 Da; putative annotation: N/A; putative formula: C8H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.144,"smiles":null,"spectrum_id":"CCMSLIB00017231466","spectrum_index":12950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Oxo-5Z,8Z,11Z,13E-eicosatetraenoic acid (delta mass: 35.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.264,"smiles":null,"spectrum_id":"CCMSLIB00017231467","spectrum_index":12951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-4-(3,4-Dihydroxyphenyl)-3-buten-2-one (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017231470","spectrum_index":12952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 56.0254 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.273,"smiles":null,"spectrum_id":"CCMSLIB00017231472","spectrum_index":12953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 791.4462 Da; putative annotation: N/A; putative formula: C42H65NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.517,"smiles":null,"spectrum_id":"CCMSLIB00017231474","spectrum_index":12954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-6,8-dihexopyranosyl-5,7-dihydroxy- (delta mass: 96.0585 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.219,"smiles":null,"spectrum_id":"CCMSLIB00017231476","spectrum_index":12955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 273.9487 Da; putative annotation: N/A; putative formula: C7H6N4S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.014,"smiles":null,"spectrum_id":"CCMSLIB00017231477","spectrum_index":12956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 133.039 Da; putative annotation: N/A; putative formula: C5H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.074,"smiles":null,"spectrum_id":"CCMSLIB00017231480","spectrum_index":12957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of n-Octylpentaoxyethylene (delta mass: 44.0211 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.295,"smiles":null,"spectrum_id":"CCMSLIB00017231481","spectrum_index":12958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzaldehyde (delta mass: 97.9757 Da; putative annotation: N/A; putative formula: C2H-2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.015,"smiles":null,"spectrum_id":"CCMSLIB00017231484","spectrum_index":12959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactose 1-phosphate - 30.0 eV (delta mass: 485.1653 Da; putative annotation: N/A; putative formula: C21H31N3O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.202,"smiles":null,"spectrum_id":"CCMSLIB00017231486","spectrum_index":12960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lenacil (delta mass: 81.0789 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.223,"smiles":null,"spectrum_id":"CCMSLIB00017231488","spectrum_index":12961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 577.3822 Da; putative annotation: N/A; putative formula: C42H47N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.442,"smiles":null,"spectrum_id":"CCMSLIB00017231490","spectrum_index":12962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terminolic acid (delta mass: 177.0637 Da; putative annotation: N/A; putative formula: C6H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.416,"smiles":null,"spectrum_id":"CCMSLIB00017231493","spectrum_index":12963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 19.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017231494","spectrum_index":12964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lagochilin (delta mass: 132.0928 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.356,"smiles":null,"spectrum_id":"CCMSLIB00017231497","spectrum_index":12965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 439.2931 Da; putative annotation: N/A; putative formula: C24H41NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.436,"smiles":null,"spectrum_id":"CCMSLIB00017231498","spectrum_index":12966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E,11Z,13E)-6-Hydroxy-16-methyloxacyclohexadeca-3,11,13-trien-2-one (delta mass: 80.0628 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.243,"smiles":null,"spectrum_id":"CCMSLIB00017231501","spectrum_index":12967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 29.9177 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.087,"smiles":null,"spectrum_id":"CCMSLIB00017231502","spectrum_index":12968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 287.0638 Da; putative annotation: N/A; putative formula: C17H15Cl2NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.145,"smiles":null,"spectrum_id":"CCMSLIB00017231505","spectrum_index":12969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 48.0363 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017231506","spectrum_index":12970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 185.1157 Da; putative annotation: N/A; putative formula: C8H15N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.422,"smiles":null,"spectrum_id":"CCMSLIB00017231508","spectrum_index":12971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 517.1732 Da; putative annotation: N/A; putative formula: C21H31N3O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.27,"smiles":null,"spectrum_id":"CCMSLIB00017231510","spectrum_index":12972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 655.243 Da; putative annotation: N/A; putative formula: C38H33N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.318,"smiles":null,"spectrum_id":"CCMSLIB00017231512","spectrum_index":12973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 241.2784 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.474,"smiles":null,"spectrum_id":"CCMSLIB00017231514","spectrum_index":12974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 89.0475 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.264,"smiles":null,"spectrum_id":"CCMSLIB00017231516","spectrum_index":12975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 56.055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.147,"smiles":null,"spectrum_id":"CCMSLIB00017231519","spectrum_index":12976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5,9-trihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one (delta mass: 66.0454 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.199,"smiles":null,"spectrum_id":"CCMSLIB00017231520","spectrum_index":12977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 104.0441 Da; putative annotation: N/A; putative formula: H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.11,"smiles":null,"spectrum_id":"CCMSLIB00017231523","spectrum_index":12978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Retinol (delta mass: 64.0669 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.304,"smiles":null,"spectrum_id":"CCMSLIB00017231524","spectrum_index":12979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androstan-3.beta.-ol (delta mass: 74.0519 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.305,"smiles":null,"spectrum_id":"CCMSLIB00017231526","spectrum_index":12980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 148.0737 Da; putative annotation: N/A; putative formula: C6H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.16,"smiles":null,"spectrum_id":"CCMSLIB00017231528","spectrum_index":12981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 26.0155 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.118,"smiles":null,"spectrum_id":"CCMSLIB00017231529","spectrum_index":12982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclovirobuxine D (delta mass: 140.0892 Da; putative annotation: N/A; putative formula: C7H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.458,"smiles":null,"spectrum_id":"CCMSLIB00017231532","spectrum_index":12983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(1H-Indol-3-yl)-2-(1-piperidinyl)ethanone (delta mass: 46.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.175,"smiles":null,"spectrum_id":"CCMSLIB00017231533","spectrum_index":12984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetradecanedioic acid (delta mass: 66.0833 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.274,"smiles":null,"spectrum_id":"CCMSLIB00017231536","spectrum_index":12985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 127.0999 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.165,"smiles":null,"spectrum_id":"CCMSLIB00017231537","spectrum_index":12986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 74.0528 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.3,"smiles":null,"spectrum_id":"CCMSLIB00017231538","spectrum_index":12987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 124.1604 Da; putative annotation: N/A; putative formula: C10H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.242,"smiles":null,"spectrum_id":"CCMSLIB00017231541","spectrum_index":12988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017231542","spectrum_index":12989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 394.1831 Da; putative annotation: N/A; putative formula: C30H22N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.274,"smiles":null,"spectrum_id":"CCMSLIB00017231545","spectrum_index":12990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 410.0643 Da; putative annotation: N/A; putative formula: C24H15N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.151,"smiles":null,"spectrum_id":"CCMSLIB00017231546","spectrum_index":12991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 385.2102 Da; putative annotation: N/A; putative formula: C19H31NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.281,"smiles":null,"spectrum_id":"CCMSLIB00017231549","spectrum_index":12992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 698.564 Da; putative annotation: N/A; putative formula: C48H74O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":919.754,"smiles":null,"spectrum_id":"CCMSLIB00017231550","spectrum_index":12993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 286.1421 Da; putative annotation: N/A; putative formula: C15H26OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.244,"smiles":null,"spectrum_id":"CCMSLIB00017231551","spectrum_index":12994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 116.1399 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.217,"smiles":null,"spectrum_id":"CCMSLIB00017231554","spectrum_index":12995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-cysteine (delta mass: 56.0256 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.063,"smiles":null,"spectrum_id":"CCMSLIB00017231555","spectrum_index":12996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331602 Linoleic acid|(9Z,12Z)-octadeca-9,12-dienoic acid (delta mass: 242.2614 Da; putative annotation: N/A; putative formula: C12H30N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.509,"smiles":null,"spectrum_id":"CCMSLIB00017231558","spectrum_index":12997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[4-(4-Nitrophenyl)phenyl]acetamide (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.108,"smiles":null,"spectrum_id":"CCMSLIB00017231559","spectrum_index":12998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 64.0425 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.119,"smiles":null,"spectrum_id":"CCMSLIB00017231562","spectrum_index":12999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017231563","spectrum_index":13000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 298.0691 Da; putative annotation: N/A; putative formula: C13H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.171,"smiles":null,"spectrum_id":"CCMSLIB00017231565","spectrum_index":13001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-4-[(E)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 230.0437 Da; putative annotation: N/A; putative formula: C10H14O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.192,"smiles":null,"spectrum_id":"CCMSLIB00017231567","spectrum_index":13002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 283.1356 Da; putative annotation: N/A; putative formula: C7H24N7O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.176,"smiles":null,"spectrum_id":"CCMSLIB00017231568","spectrum_index":13003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)ethanol (delta mass: 100.0152 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.149,"smiles":null,"spectrum_id":"CCMSLIB00017231571","spectrum_index":13004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .omega.-3 Arachidonic acid from NIST14 (delta mass: 217.2042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.452,"smiles":null,"spectrum_id":"CCMSLIB00017231572","spectrum_index":13005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 53.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.4,"smiles":null,"spectrum_id":"CCMSLIB00017231575","spectrum_index":13006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Hydroxyphenyl)ethanol (delta mass: 139.0993 Da; putative annotation: N/A; putative formula: C8H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.175,"smiles":null,"spectrum_id":"CCMSLIB00017231576","spectrum_index":13007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 131.0942 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.206,"smiles":null,"spectrum_id":"CCMSLIB00017231577","spectrum_index":13008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-hydroxybutyl)-3,5,5-trimethylcyclohex-3-en-1-ol (delta mass: 341.1319 Da; putative annotation: N/A; putative formula: C25H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.317,"smiles":null,"spectrum_id":"CCMSLIB00017231580","spectrum_index":13009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 198.9075 Da; putative annotation: N/A; putative formula: C3H5NO-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.214,"smiles":null,"spectrum_id":"CCMSLIB00017231581","spectrum_index":13010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 100.067 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017231584","spectrum_index":13011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 62.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.3,"smiles":null,"spectrum_id":"CCMSLIB00017231585","spectrum_index":13012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 88.064 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.27,"smiles":null,"spectrum_id":"CCMSLIB00017231588","spectrum_index":13013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 403.2933 Da; putative annotation: N/A; putative formula: C21H41NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.504,"smiles":null,"spectrum_id":"CCMSLIB00017231589","spectrum_index":13014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 102.0473 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017231590","spectrum_index":13015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 131.0943 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.342,"smiles":null,"spectrum_id":"CCMSLIB00017231593","spectrum_index":13016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 152.0776 Da; putative annotation: N/A; putative formula: C8H12N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.169,"smiles":null,"spectrum_id":"CCMSLIB00017231594","spectrum_index":13017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Threonine (delta mass: 72.0204 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.086,"smiles":null,"spectrum_id":"CCMSLIB00017231597","spectrum_index":13018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 341.293 Da; putative annotation: N/A; putative formula: C20H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.541,"smiles":null,"spectrum_id":"CCMSLIB00017231598","spectrum_index":13019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 284.2704 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.309,"smiles":null,"spectrum_id":"CCMSLIB00017231600","spectrum_index":13020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidinol (delta mass: 152.0473 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.228,"smiles":null,"spectrum_id":"CCMSLIB00017231602","spectrum_index":13021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 905.1009 Da; putative annotation: N/A; putative formula: C48H31N3O8S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1215.21,"smiles":null,"spectrum_id":"CCMSLIB00017231603","spectrum_index":13022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 160.1256 Da; putative annotation: N/A; putative formula: C12H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.316,"smiles":null,"spectrum_id":"CCMSLIB00017231606","spectrum_index":13023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 122.1097 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.31,"smiles":null,"spectrum_id":"CCMSLIB00017231607","spectrum_index":13024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 299.122 Da; putative annotation: N/A; putative formula: C13H22N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.307,"smiles":null,"spectrum_id":"CCMSLIB00017231610","spectrum_index":13025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 119.0947 Da; putative annotation: N/A; putative formula: CH9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.395,"smiles":null,"spectrum_id":"CCMSLIB00017231611","spectrum_index":13026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 28.0316 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017231614","spectrum_index":13027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 355.3603 Da; putative annotation: N/A; putative formula: C26H45NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.645,"smiles":null,"spectrum_id":"CCMSLIB00017231615","spectrum_index":13028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 275.0803 Da; putative annotation: N/A; putative formula: C15H17NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.182,"smiles":null,"spectrum_id":"CCMSLIB00017231618","spectrum_index":13029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 575.2764 Da; putative annotation: N/A; putative formula: C27H45NO10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":852.493,"smiles":null,"spectrum_id":"CCMSLIB00017231619","spectrum_index":13030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 101.0921 Da; putative annotation: N/A; putative formula: C4H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.199,"smiles":null,"spectrum_id":"CCMSLIB00017231622","spectrum_index":13031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-methylpentanoic acid (delta mass: 71.0372 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.139,"smiles":null,"spectrum_id":"CCMSLIB00017231623","spectrum_index":13032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 408.2788 Da; putative annotation: N/A; putative formula: C19H36N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.339,"smiles":null,"spectrum_id":"CCMSLIB00017231625","spectrum_index":13033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 144.0571 Da; putative annotation: N/A; putative formula: C10H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.128,"smiles":null,"spectrum_id":"CCMSLIB00017231627","spectrum_index":13034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 132.0783 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.165,"smiles":null,"spectrum_id":"CCMSLIB00017231628","spectrum_index":13035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 727.3493 Da; putative annotation: N/A; putative formula: C43H41N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":949.446,"smiles":null,"spectrum_id":"CCMSLIB00017231631","spectrum_index":13036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 770.8971 Da; putative annotation: N/A; putative formula: C19H17NO22S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":992.994,"smiles":null,"spectrum_id":"CCMSLIB00017231632","spectrum_index":13037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Blood Group H Trisaccharide (delta mass: 330.1658 Da; putative annotation: N/A; putative formula: C20H26O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.374,"smiles":null,"spectrum_id":"CCMSLIB00017231635","spectrum_index":13038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-2-hydroxybenzoic acid (delta mass: 32.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.045,"smiles":null,"spectrum_id":"CCMSLIB00017231636","spectrum_index":13039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 92.0488 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.224,"smiles":null,"spectrum_id":"CCMSLIB00017231639","spectrum_index":13040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2,4-dihydroxy-3-[(E)-4-hydroxy-3-methyl-5-(1,2,6-trimethyl-3-oxocyclohexyl)pent-2-enyl]-6-methylbenzaldehyde (delta mass: 59.0367 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.23,"smiles":null,"spectrum_id":"CCMSLIB00017231640","spectrum_index":13041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethoxy-4-hydroxycinnamic acid (delta mass: 27.0492 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.125,"smiles":null,"spectrum_id":"CCMSLIB00017231641","spectrum_index":13042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Misoprostol (free acid) (delta mass: 134.0745 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.338,"smiles":null,"spectrum_id":"CCMSLIB00017231644","spectrum_index":13043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zinterol (delta mass: 70.0488 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.217,"smiles":null,"spectrum_id":"CCMSLIB00017231645","spectrum_index":13044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 24.0367 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.279,"smiles":null,"spectrum_id":"CCMSLIB00017231648","spectrum_index":13045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Formyl-3-hydroxyphenoxy)methyl]benzoic acid (delta mass: 138.0319 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.108,"smiles":null,"spectrum_id":"CCMSLIB00017231649","spectrum_index":13046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 103.9926 Da; putative annotation: N/A; putative formula: C5HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.172,"smiles":null,"spectrum_id":"CCMSLIB00017231651","spectrum_index":13047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levorphanol (delta mass: 162.0537 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.239,"smiles":null,"spectrum_id":"CCMSLIB00017231653","spectrum_index":13048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 98.051 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.293,"smiles":null,"spectrum_id":"CCMSLIB00017231654","spectrum_index":13049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 547.2453 Da; putative annotation: N/A; putative formula: C25H41NO10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.461,"smiles":null,"spectrum_id":"CCMSLIB00017231657","spectrum_index":13050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sumaresinolic acid (delta mass: 110.0513 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.414,"smiles":null,"spectrum_id":"CCMSLIB00017231658","spectrum_index":13051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Hydroxypregnenolone (delta mass: 60.0357 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.278,"smiles":null,"spectrum_id":"CCMSLIB00017231661","spectrum_index":13052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 488.1308 Da; putative annotation: N/A; putative formula: C18H25N4O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":753.286,"smiles":null,"spectrum_id":"CCMSLIB00017231662","spectrum_index":13053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 76.0565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017231663","spectrum_index":13054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 96.0421 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017231666","spectrum_index":13055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 283.2013 Da; putative annotation: N/A; putative formula: C13H25N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.48,"smiles":null,"spectrum_id":"CCMSLIB00017231669","spectrum_index":13056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 14.0163 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.128,"smiles":null,"spectrum_id":"CCMSLIB00017231670","spectrum_index":13057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 416.2841 Da; putative annotation: N/A; putative formula: C26H41O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.37,"smiles":null,"spectrum_id":"CCMSLIB00017231673","spectrum_index":13058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 54.0468 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017231674","spectrum_index":13059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 130.0994 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.159,"smiles":null,"spectrum_id":"CCMSLIB00017231676","spectrum_index":13060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 64.0308 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.253,"smiles":null,"spectrum_id":"CCMSLIB00017231678","spectrum_index":13061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Abietic acid (delta mass: 38.0481 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.28,"smiles":null,"spectrum_id":"CCMSLIB00017231680","spectrum_index":13062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 104.0468 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.279,"smiles":null,"spectrum_id":"CCMSLIB00017231682","spectrum_index":13063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 70.8966 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.972,"smiles":null,"spectrum_id":"CCMSLIB00017231683","spectrum_index":13064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid (delta mass: 270.2559 Da; putative annotation: N/A; putative formula: C17H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.519,"smiles":null,"spectrum_id":"CCMSLIB00017231686","spectrum_index":13065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 216.0425 Da; putative annotation: N/A; putative formula: C12H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.165,"smiles":null,"spectrum_id":"CCMSLIB00017231687","spectrum_index":13066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 162.0529 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.238,"smiles":null,"spectrum_id":"CCMSLIB00017231690","spectrum_index":13067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 75.0317 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.139,"smiles":null,"spectrum_id":"CCMSLIB00017231691","spectrum_index":13068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 42.0083 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.079,"smiles":null,"spectrum_id":"CCMSLIB00017231693","spectrum_index":13069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 18.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.284,"smiles":null,"spectrum_id":"CCMSLIB00017231695","spectrum_index":13070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 221.2142 Da; putative annotation: N/A; putative formula: C15H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.353,"smiles":null,"spectrum_id":"CCMSLIB00017231696","spectrum_index":13071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 184.1467 Da; putative annotation: N/A; putative formula: C11H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.217,"smiles":null,"spectrum_id":"CCMSLIB00017231699","spectrum_index":13072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bis(2-hydroxyethyl) phthalate (delta mass: 371.0987 Da; putative annotation: N/A; putative formula: C16H17N7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.185,"smiles":null,"spectrum_id":"CCMSLIB00017231700","spectrum_index":13073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Arachidonoyltaurine (delta mass: 74.0466 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.298,"smiles":null,"spectrum_id":"CCMSLIB00017231701","spectrum_index":13074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 4.2048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.5,"smiles":null,"spectrum_id":"CCMSLIB00017231704","spectrum_index":13075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C22:6 (delta mass: 98.0571 Da; putative annotation: N/A; putative formula: C6H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.326,"smiles":null,"spectrum_id":"CCMSLIB00017231705","spectrum_index":13076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexanone, 2-(ethylamino)-2-phenyl- (delta mass: 239.1962 Da; putative annotation: N/A; putative formula: C9H21N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.35,"smiles":null,"spectrum_id":"CCMSLIB00017231708","spectrum_index":13077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 9.9372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.997,"smiles":null,"spectrum_id":"CCMSLIB00017231709","spectrum_index":13078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 26.9968 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.208,"smiles":null,"spectrum_id":"CCMSLIB00017231712","spectrum_index":13079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 154.137 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.364,"smiles":null,"spectrum_id":"CCMSLIB00017231713","spectrum_index":13080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 172.0915 Da; putative annotation: N/A; putative formula: C9H16OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.188,"smiles":null,"spectrum_id":"CCMSLIB00017231716","spectrum_index":13081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 208.0733 Da; putative annotation: N/A; putative formula: C11H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.123,"smiles":null,"spectrum_id":"CCMSLIB00017231717","spectrum_index":13082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 147.1262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.389,"smiles":null,"spectrum_id":"CCMSLIB00017231718","spectrum_index":13083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alphitolic acid (delta mass: 158.0372 Da; putative annotation: N/A; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.4,"smiles":null,"spectrum_id":"CCMSLIB00017231721","spectrum_index":13084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 50.3722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.5,"smiles":null,"spectrum_id":"CCMSLIB00017231722","spectrum_index":13085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4S,5S,6R)-2-[[7-hydroxy-4-[(Z)-5-hydroxy-3-methylpent-3-enyl]-4a,8,8-trimethyl-3-methylidene-2,4,5,6,7,8a-hexahydro-1H-naphthalen-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 156.1291 Da; putative annotation: N/A; putative formula: C13H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.44,"smiles":null,"spectrum_id":"CCMSLIB00017231725","spectrum_index":13086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Omeprazole sulfide (delta mass: 448.335 Da; putative annotation: N/A; putative formula: C24H44N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.462,"smiles":null,"spectrum_id":"CCMSLIB00017231726","spectrum_index":13087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 353.1216 Da; putative annotation: N/A; putative formula: C17H24NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.162,"smiles":null,"spectrum_id":"CCMSLIB00017231727","spectrum_index":13088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 200.1771 Da; putative annotation: N/A; putative formula: C12H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.44,"smiles":null,"spectrum_id":"CCMSLIB00017231730","spectrum_index":13089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylpiperazine (delta mass: 71.0007 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.124,"smiles":null,"spectrum_id":"CCMSLIB00017231731","spectrum_index":13090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.164,"smiles":null,"spectrum_id":"CCMSLIB00017231734","spectrum_index":13091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 48.0453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.29,"smiles":null,"spectrum_id":"CCMSLIB00017231735","spectrum_index":13092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 677.3134 Da; putative annotation: N/A; putative formula: C29H43N9O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1061.46,"smiles":null,"spectrum_id":"CCMSLIB00017231738","spectrum_index":13093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine CollisionEnergy:102040 (delta mass: 65.0178 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.115,"smiles":null,"spectrum_id":"CCMSLIB00017231739","spectrum_index":13094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 188.1041 Da; putative annotation: N/A; putative formula: C9H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.336,"smiles":null,"spectrum_id":"CCMSLIB00017231742","spectrum_index":13095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hexyldecanoic acid (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.31,"smiles":null,"spectrum_id":"CCMSLIB00017231743","spectrum_index":13096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 166.0994 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.159,"smiles":null,"spectrum_id":"CCMSLIB00017231744","spectrum_index":13097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 174.0155 Da; putative annotation: N/A; putative formula: C10H8O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.144,"smiles":null,"spectrum_id":"CCMSLIB00017231747","spectrum_index":13098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 346.2849 Da; putative annotation: N/A; putative formula: C19H34N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.408,"smiles":null,"spectrum_id":"CCMSLIB00017231748","spectrum_index":13099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dihydro-5H-cyclopentapyrimidin-4-amine (delta mass: 46.0051 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.092,"smiles":null,"spectrum_id":"CCMSLIB00017231751","spectrum_index":13100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 285.082 Da; putative annotation: N/A; putative formula: C18H12N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.22,"smiles":null,"spectrum_id":"CCMSLIB00017231752","spectrum_index":13101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 95.0401 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.095,"smiles":null,"spectrum_id":"CCMSLIB00017231755","spectrum_index":13102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 100.0754 Da; putative annotation: N/A; putative formula: C3H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.245,"smiles":null,"spectrum_id":"CCMSLIB00017231756","spectrum_index":13103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 34.0411 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.127,"smiles":null,"spectrum_id":"CCMSLIB00017231759","spectrum_index":13104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 155.0649 Da; putative annotation: N/A; putative formula: C5H9N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.198,"smiles":null,"spectrum_id":"CCMSLIB00017231760","spectrum_index":13105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 100.07 Da; putative annotation: N/A; putative formula: C6H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.281,"smiles":null,"spectrum_id":"CCMSLIB00017231761","spectrum_index":13106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 76.0678 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.117,"smiles":null,"spectrum_id":"CCMSLIB00017231764","spectrum_index":13107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 39.9579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.039,"smiles":null,"spectrum_id":"CCMSLIB00017231765","spectrum_index":13108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine (delta mass: 160.9717 Da; putative annotation: N/A; putative formula: C3H3N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.058,"smiles":null,"spectrum_id":"CCMSLIB00017231768","spectrum_index":13109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 48.0347 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.283,"smiles":null,"spectrum_id":"CCMSLIB00017231769","spectrum_index":13110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 190.1575 Da; putative annotation: N/A; putative formula: C11H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.216,"smiles":null,"spectrum_id":"CCMSLIB00017231770","spectrum_index":13111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 72.0411 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.273,"smiles":null,"spectrum_id":"CCMSLIB00017231773","spectrum_index":13112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 200.1086 Da; putative annotation: N/A; putative formula: C9H17N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.354,"smiles":null,"spectrum_id":"CCMSLIB00017231774","spectrum_index":13113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 74.0486 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.338,"smiles":null,"spectrum_id":"CCMSLIB00017231777","spectrum_index":13114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 340.3341 Da; putative annotation: N/A; putative formula: C22H44O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.371,"smiles":null,"spectrum_id":"CCMSLIB00017231778","spectrum_index":13115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.07,"smiles":null,"spectrum_id":"CCMSLIB00017231780","spectrum_index":13116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 50.0522 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.19,"smiles":null,"spectrum_id":"CCMSLIB00017231782","spectrum_index":13117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 55.0672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.154,"smiles":null,"spectrum_id":"CCMSLIB00017231783","spectrum_index":13118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 39.0467 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.107,"smiles":null,"spectrum_id":"CCMSLIB00017231786","spectrum_index":13119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 18.0058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.093,"smiles":null,"spectrum_id":"CCMSLIB00017231787","spectrum_index":13120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 116.0523 Da; putative annotation: N/A; putative formula: C3H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.128,"smiles":null,"spectrum_id":"CCMSLIB00017231789","spectrum_index":13121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 189.1003 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.223,"smiles":null,"spectrum_id":"CCMSLIB00017231791","spectrum_index":13122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 168.0924 Da; putative annotation: N/A; putative formula: C7H13N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.168,"smiles":null,"spectrum_id":"CCMSLIB00017231792","spectrum_index":13123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 443.2158 Da; putative annotation: N/A; putative formula: C24H34N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.255,"smiles":null,"spectrum_id":"CCMSLIB00017231795","spectrum_index":13124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 364.1735 Da; putative annotation: N/A; putative formula: C16H28O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.307,"smiles":null,"spectrum_id":"CCMSLIB00017231796","spectrum_index":13125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-Ranitidine - 40.0 eV (delta mass: 162.0533 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.202,"smiles":null,"spectrum_id":"CCMSLIB00017231799","spectrum_index":13126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 733.2068 Da; putative annotation: N/A; putative formula: C44H35N3O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":893.34,"smiles":null,"spectrum_id":"CCMSLIB00017231800","spectrum_index":13127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 142.078 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.31,"smiles":null,"spectrum_id":"CCMSLIB00017231801","spectrum_index":13128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 110.0482 Da; putative annotation: 3-Aminopiperidine-2,6-dione; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.193,"smiles":null,"spectrum_id":"CCMSLIB00017231804","spectrum_index":13129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PM018176 Spermidine-di-p-coumaroyl (delta mass: 146.0373 Da; putative annotation: 3-Coumaric acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.276,"smiles":null,"spectrum_id":"CCMSLIB00017231806","spectrum_index":13130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 430.0897 Da; putative annotation: Quercitrin; putative formula: C21H18O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.15,"smiles":null,"spectrum_id":"CCMSLIB00017231808","spectrum_index":13131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 86.0375 Da; putative annotation: 3-Hydroxybutyric acid; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.092,"smiles":null,"spectrum_id":"CCMSLIB00017231811","spectrum_index":13132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 190.1751 Da; putative annotation: 1-Ethynylcyclododecanol; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.36,"smiles":null,"spectrum_id":"CCMSLIB00017231812","spectrum_index":13133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 161.0681 Da; putative annotation: Glucosamine - 30.0 eV; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.144,"smiles":null,"spectrum_id":"CCMSLIB00017231813","spectrum_index":13134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLPUTRESCINE (delta mass: 113.084 Da; putative annotation: 4-Aminohexanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.202,"smiles":null,"spectrum_id":"CCMSLIB00017231816","spectrum_index":13135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 145.0736 Da; putative annotation: 1-Deoxynojirimycin; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.165,"smiles":null,"spectrum_id":"CCMSLIB00017231817","spectrum_index":13136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE\"\" (delta mass: 169.0371 Da; putative annotation: Amino(2,4-difluorophenyl)acetic acid; putative formula: C8H5F2NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.139,"smiles":null,"spectrum_id":"CCMSLIB00017231820","spectrum_index":13137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 279.2567 Da; putative annotation: Palmitoleoyl ethanolamide; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.442,"smiles":null,"spectrum_id":"CCMSLIB00017231821","spectrum_index":13138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 910.4953 Da; putative annotation: Bacoside A3; putative formula: C47H74O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1091.57,"smiles":null,"spectrum_id":"CCMSLIB00017231823","spectrum_index":13139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 278.2235 Da; putative annotation: (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.31,"smiles":null,"spectrum_id":"CCMSLIB00017231825","spectrum_index":13140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoolein (delta mass: 96.0953 Da; putative annotation: trans-4-Methylcyclohexanol; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.395,"smiles":null,"spectrum_id":"CCMSLIB00017231826","spectrum_index":13141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 166.0212 Da; putative annotation: 3-Chloro-4'-hydroxypropiophenone; putative formula: C9H7ClO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.06,"smiles":null,"spectrum_id":"CCMSLIB00017231829","spectrum_index":13142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Arg (delta mass: 228.107 Da; putative annotation: Leu-Asp; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.31,"smiles":null,"spectrum_id":"CCMSLIB00017231830","spectrum_index":13143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 82.0785 Da; putative annotation: 5-Hexen-1-ol; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.342,"smiles":null,"spectrum_id":"CCMSLIB00017231832","spectrum_index":13144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 298.2547 Da; putative annotation: NCGC00347859-02!2,3-dihydroxypropyl 13-methyltetradecanoate; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.513,"smiles":null,"spectrum_id":"CCMSLIB00017231834","spectrum_index":13145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 382.2566 Da; putative annotation: Ophiobolin A; putative formula: C25H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.483,"smiles":null,"spectrum_id":"CCMSLIB00017231836","spectrum_index":13146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 92.0364 Da; putative annotation: 4-Pyrimidinylmethanol; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.128,"smiles":null,"spectrum_id":"CCMSLIB00017231838","spectrum_index":13147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyclohexylmethyl)proline (delta mass: 140.1208 Da; putative annotation: Nonanoic acid; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.285,"smiles":null,"spectrum_id":"CCMSLIB00017231839","spectrum_index":13148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol CollisionEnergy:205060 (delta mass: 28.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.226,"smiles":null,"spectrum_id":"CCMSLIB00017231842","spectrum_index":13149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 48.0461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.21,"smiles":null,"spectrum_id":"CCMSLIB00017231843","spectrum_index":13150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 144.0973 Da; putative annotation: N/A; putative formula: C8H16S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.173,"smiles":null,"spectrum_id":"CCMSLIB00017231846","spectrum_index":13151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 23.0178 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.177,"smiles":null,"spectrum_id":"CCMSLIB00017231847","spectrum_index":13152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 203.1802 Da; putative annotation: N/A; putative formula: C13H21N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.257,"smiles":null,"spectrum_id":"CCMSLIB00017231849","spectrum_index":13153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 193.0944 Da; putative annotation: N/A; putative formula: C7H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.218,"smiles":null,"spectrum_id":"CCMSLIB00017231851","spectrum_index":13154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 415.4184 Da; putative annotation: N/A; putative formula: C29H53N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.489,"smiles":null,"spectrum_id":"CCMSLIB00017231853","spectrum_index":13155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,19-Cyclolanost-25-ene-3,24-diol (delta mass: 167.1213 Da; putative annotation: N/A; putative formula: C10H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.51,"smiles":null,"spectrum_id":"CCMSLIB00017231855","spectrum_index":13156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.102,"smiles":null,"spectrum_id":"CCMSLIB00017231856","spectrum_index":13157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 123.0476 Da; putative annotation: N/A; putative formula: C10H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.129,"smiles":null,"spectrum_id":"CCMSLIB00017231859","spectrum_index":13158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocorticosterone (delta mass: 435.2613 Da; putative annotation: N/A; putative formula: C28H39NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.514,"smiles":null,"spectrum_id":"CCMSLIB00017231860","spectrum_index":13159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,19-Dihydroxy-3-oxo-12-ursen-28-oic acid (delta mass: 166.114 Da; putative annotation: N/A; putative formula: C14H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.456,"smiles":null,"spectrum_id":"CCMSLIB00017231863","spectrum_index":13160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 28.0315 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.243,"smiles":null,"spectrum_id":"CCMSLIB00017231864","spectrum_index":13161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 80.0292 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.24,"smiles":null,"spectrum_id":"CCMSLIB00017231867","spectrum_index":13162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 131.0946 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.191,"smiles":null,"spectrum_id":"CCMSLIB00017231868","spectrum_index":13163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLAMIDE (delta mass: 169.085 Da; putative annotation: N/A; putative formula: C7H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.14,"smiles":null,"spectrum_id":"CCMSLIB00017231870","spectrum_index":13164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 108.0202 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.091,"smiles":null,"spectrum_id":"CCMSLIB00017231872","spectrum_index":13165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 154.1783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.274,"smiles":null,"spectrum_id":"CCMSLIB00017231873","spectrum_index":13166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 179.0799 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.265,"smiles":null,"spectrum_id":"CCMSLIB00017231876","spectrum_index":13167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 348.1813 Da; putative annotation: N/A; putative formula: C15H29N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.252,"smiles":null,"spectrum_id":"CCMSLIB00017231877","spectrum_index":13168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 136.0372 Da; putative annotation: N/A; putative formula: C4H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017231880","spectrum_index":13169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 268.2673 Da; putative annotation: N/A; putative formula: C18H37O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.364,"smiles":null,"spectrum_id":"CCMSLIB00017231881","spectrum_index":13170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.185,"smiles":null,"spectrum_id":"CCMSLIB00017231882","spectrum_index":13171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 326.2432 Da; putative annotation: N/A; putative formula: C19H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.47,"smiles":null,"spectrum_id":"CCMSLIB00017231885","spectrum_index":13172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 110.0727 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.31,"smiles":null,"spectrum_id":"CCMSLIB00017231888","spectrum_index":13173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S,4aR)-4-(Hydroxymethyl)-3,4a,8,8-tetramethyl-4a,5,6,7,8,8a-hexahydronaphthalen-1(4H)-one (delta mass: 102.0317 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.217,"smiles":null,"spectrum_id":"CCMSLIB00017231889","spectrum_index":13174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 276.1163 Da; putative annotation: N/A; putative formula: C19H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.275,"smiles":null,"spectrum_id":"CCMSLIB00017231891","spectrum_index":13175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 214.1948 Da; putative annotation: N/A; putative formula: C12H27N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.272,"smiles":null,"spectrum_id":"CCMSLIB00017231893","spectrum_index":13176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 222.1984 Da; putative annotation: N/A; putative formula: C15H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.269,"smiles":null,"spectrum_id":"CCMSLIB00017231894","spectrum_index":13177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-yl)-N-(4-methoxyphenyl)acetamide (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.139,"smiles":null,"spectrum_id":"CCMSLIB00017231897","spectrum_index":13178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 67.9927 Da; putative annotation: N/A; putative formula: C2HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017231898","spectrum_index":13179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 179.0793 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.16,"smiles":null,"spectrum_id":"CCMSLIB00017231901","spectrum_index":13180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 139.029 Da; putative annotation: N/A; putative formula: C7HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.11,"smiles":null,"spectrum_id":"CCMSLIB00017231902","spectrum_index":13181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19,20-Dihydroxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 72.0561 Da; putative annotation: N/A; putative formula: H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.309,"smiles":null,"spectrum_id":"CCMSLIB00017231904","spectrum_index":13182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 173.0681 Da; putative annotation: N/A; putative formula: C7H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.118,"smiles":null,"spectrum_id":"CCMSLIB00017231906","spectrum_index":13183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 415.1688 Da; putative annotation: N/A; putative formula: C13H17N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.385,"smiles":null,"spectrum_id":"CCMSLIB00017231907","spectrum_index":13184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-5E,7Z,10Z,13Z,16Z,19Z-docosahexaenoic acid (delta mass: 135.0691 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.311,"smiles":null,"spectrum_id":"CCMSLIB00017231910","spectrum_index":13185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 385.2206 Da; putative annotation: N/A; putative formula: C22H33N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.286,"smiles":null,"spectrum_id":"CCMSLIB00017231911","spectrum_index":13186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 175.084 Da; putative annotation: N/A; putative formula: C7H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.139,"smiles":null,"spectrum_id":"CCMSLIB00017231914","spectrum_index":13187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.242,"smiles":null,"spectrum_id":"CCMSLIB00017231915","spectrum_index":13188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017231916","spectrum_index":13189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholestenoic acid (delta mass: 42.0137 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.35,"smiles":null,"spectrum_id":"CCMSLIB00017231919","spectrum_index":13190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 159.0651 Da; putative annotation: N/A; putative formula: C6H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.167,"smiles":null,"spectrum_id":"CCMSLIB00017231920","spectrum_index":13191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 163.0159 Da; putative annotation: N/A; putative formula: C2H5N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.087,"smiles":null,"spectrum_id":"CCMSLIB00017231923","spectrum_index":13192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 40.0666 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.179,"smiles":null,"spectrum_id":"CCMSLIB00017231924","spectrum_index":13193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 48.0937 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.191,"smiles":null,"spectrum_id":"CCMSLIB00017231927","spectrum_index":13194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 31.9893 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.101,"smiles":null,"spectrum_id":"CCMSLIB00017231928","spectrum_index":13195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 173.1037 Da; putative annotation: N/A; putative formula: C4H11N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.19,"smiles":null,"spectrum_id":"CCMSLIB00017231930","spectrum_index":13196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 27.154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.219,"smiles":null,"spectrum_id":"CCMSLIB00017231932","spectrum_index":13197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apomorphine (delta mass: 32.0218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.155,"smiles":null,"spectrum_id":"CCMSLIB00017231933","spectrum_index":13198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of galanthamine (delta mass: 262.2299 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.389,"smiles":null,"spectrum_id":"CCMSLIB00017231936","spectrum_index":13199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 470.1634 Da; putative annotation: N/A; putative formula: C24H30N4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.239,"smiles":null,"spectrum_id":"CCMSLIB00017231937","spectrum_index":13200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Docosenoic acid (delta mass: 78.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.369,"smiles":null,"spectrum_id":"CCMSLIB00017231940","spectrum_index":13201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 328.2954 Da; putative annotation: N/A; putative formula: C16H36N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.398,"smiles":null,"spectrum_id":"CCMSLIB00017231941","spectrum_index":13202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.208,"smiles":null,"spectrum_id":"CCMSLIB00017231944","spectrum_index":13203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethylbenzoic acid (delta mass: 43.9246 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017231945","spectrum_index":13204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 70.053 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.161,"smiles":null,"spectrum_id":"CCMSLIB00017231946","spectrum_index":13205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 17.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.278,"smiles":null,"spectrum_id":"CCMSLIB00017231949","spectrum_index":13206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Pro (delta mass: 113.0848 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.24,"smiles":null,"spectrum_id":"CCMSLIB00017231950","spectrum_index":13207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 183.993 Da; putative annotation: N/A; putative formula: C8H9O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.079,"smiles":null,"spectrum_id":"CCMSLIB00017231953","spectrum_index":13208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 851.3752 Da; putative annotation: N/A; putative formula: C47H57N5O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1096.47,"smiles":null,"spectrum_id":"CCMSLIB00017231954","spectrum_index":13209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.075,"smiles":null,"spectrum_id":"CCMSLIB00017231956","spectrum_index":13210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 42.005 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.977,"smiles":null,"spectrum_id":"CCMSLIB00017231958","spectrum_index":13211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 72.046 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.133,"smiles":null,"spectrum_id":"CCMSLIB00017231959","spectrum_index":13212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 111.0597 Da; putative annotation: N/A; putative formula: C6H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.161,"smiles":null,"spectrum_id":"CCMSLIB00017231962","spectrum_index":13213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 17.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.123,"smiles":null,"spectrum_id":"CCMSLIB00017231963","spectrum_index":13214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 16.0549 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.152,"smiles":null,"spectrum_id":"CCMSLIB00017231966","spectrum_index":13215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 216.0844 Da; putative annotation: N/A; putative formula: C9H17N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.316,"smiles":null,"spectrum_id":"CCMSLIB00017231967","spectrum_index":13216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 327.1837 Da; putative annotation: N/A; putative formula: C20H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.249,"smiles":null,"spectrum_id":"CCMSLIB00017231970","spectrum_index":13217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 563.475 Da; putative annotation: N/A; putative formula: C28H57N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.535,"smiles":null,"spectrum_id":"CCMSLIB00017231971","spectrum_index":13218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 361.1399 Da; putative annotation: N/A; putative formula: C17H15N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.252,"smiles":null,"spectrum_id":"CCMSLIB00017231974","spectrum_index":13219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy-4(15),11(13)-eudesmadien-12,6-olide (delta mass: 42.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.2,"smiles":null,"spectrum_id":"CCMSLIB00017231975","spectrum_index":13220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 92.0441 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.255,"smiles":null,"spectrum_id":"CCMSLIB00017231978","spectrum_index":13221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 80.0666 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.311,"smiles":null,"spectrum_id":"CCMSLIB00017231979","spectrum_index":13222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 159.0858 Da; putative annotation: N/A; putative formula: C3H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.172,"smiles":null,"spectrum_id":"CCMSLIB00017231980","spectrum_index":13223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOATE - 20.0 eV (delta mass: 158.139 Da; putative annotation: N/A; putative formula: C4H14N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.194,"smiles":null,"spectrum_id":"CCMSLIB00017231983","spectrum_index":13224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 1.979 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":120.044,"smiles":null,"spectrum_id":"CCMSLIB00017231984","spectrum_index":13225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 56.0487 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.108,"smiles":null,"spectrum_id":"CCMSLIB00017231987","spectrum_index":13226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 67.0757 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.135,"smiles":null,"spectrum_id":"CCMSLIB00017231988","spectrum_index":13227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017231991","spectrum_index":13228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 59.9342 Da; putative annotation: N/A; putative formula: H-2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.026,"smiles":null,"spectrum_id":"CCMSLIB00017231992","spectrum_index":13229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 719.3982 Da; putative annotation: N/A; putative formula: C31H58N7O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.439,"smiles":null,"spectrum_id":"CCMSLIB00017231993","spectrum_index":13230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(hydroxymethyl)-4,9a-dimethyl-2,7,8,9-tetrahydro-1H-benzo[7]annulen-3-one (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017231996","spectrum_index":13231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 502.1084 Da; putative annotation: N/A; putative formula: C20H18N6O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.169,"smiles":null,"spectrum_id":"CCMSLIB00017231999","spectrum_index":13232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 16.8856 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.956,"smiles":null,"spectrum_id":"CCMSLIB00017232000","spectrum_index":13233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Val (delta mass: 71.0374 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.208,"smiles":null,"spectrum_id":"CCMSLIB00017232002","spectrum_index":13234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 102.0824 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017232004","spectrum_index":13235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 142.0774 Da; putative annotation: N/A; putative formula: C5H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.429,"smiles":null,"spectrum_id":"CCMSLIB00017232007","spectrum_index":13236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 43.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.09,"smiles":null,"spectrum_id":"CCMSLIB00017232008","spectrum_index":13237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 47.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.113,"smiles":null,"spectrum_id":"CCMSLIB00017232011","spectrum_index":13238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 226.9709 Da; putative annotation: N/A; putative formula: C8H5NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.057,"smiles":null,"spectrum_id":"CCMSLIB00017232012","spectrum_index":13239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 40.8401 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.89,"smiles":null,"spectrum_id":"CCMSLIB00017232015","spectrum_index":13240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 226.1565 Da; putative annotation: N/A; putative formula: C13H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.216,"smiles":null,"spectrum_id":"CCMSLIB00017232016","spectrum_index":13241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 180.9603 Da; putative annotation: N/A; putative formula: C4H8NO-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.062,"smiles":null,"spectrum_id":"CCMSLIB00017232019","spectrum_index":13242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 69.0577 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017232020","spectrum_index":13243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 541.2254 Da; putative annotation: N/A; putative formula: C36H31NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.38,"smiles":null,"spectrum_id":"CCMSLIB00017232022","spectrum_index":13244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 714.5025 Da; putative annotation: N/A; putative formula: C51H62N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":991.719,"smiles":null,"spectrum_id":"CCMSLIB00017232024","spectrum_index":13245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,18.Xi.)-3-Oxolup-20(29)-ene-27,28-dioic acid (delta mass: 92.0644 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.391,"smiles":null,"spectrum_id":"CCMSLIB00017232026","spectrum_index":13246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 31.0142 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.085,"smiles":null,"spectrum_id":"CCMSLIB00017232028","spectrum_index":13247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 19.0285 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.11,"smiles":null,"spectrum_id":"CCMSLIB00017232030","spectrum_index":13248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 10.0296 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.128,"smiles":null,"spectrum_id":"CCMSLIB00017232033","spectrum_index":13249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (((3a,7a)-3,7-trihydroxy-24-oxocholan-22-en-24-yl)amino)ethanesulfonic acid (delta mass: 130.1173 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.406,"smiles":null,"spectrum_id":"CCMSLIB00017232034","spectrum_index":13250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 162.0318 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.086,"smiles":null,"spectrum_id":"CCMSLIB00017232035","spectrum_index":13251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 506.3013 Da; putative annotation: N/A; putative formula: C25H47O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.388,"smiles":null,"spectrum_id":"CCMSLIB00017232038","spectrum_index":13252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of aminoadipic-acid-C8:0 (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017232039","spectrum_index":13253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 184.0371 Da; putative annotation: N/A; putative formula: C8H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.087,"smiles":null,"spectrum_id":"CCMSLIB00017232042","spectrum_index":13254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 123.0536 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.181,"smiles":null,"spectrum_id":"CCMSLIB00017232045","spectrum_index":13255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 46.0822 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.216,"smiles":null,"spectrum_id":"CCMSLIB00017232046","spectrum_index":13256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 32.9981 Da; putative annotation: N/A; putative formula: C3H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017232048","spectrum_index":13257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetylbenzoic acid (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017232050","spectrum_index":13258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 55.0068 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.072,"smiles":null,"spectrum_id":"CCMSLIB00017232051","spectrum_index":13259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 125.0469 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.16,"smiles":null,"spectrum_id":"CCMSLIB00017232054","spectrum_index":13260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 289.1628 Da; putative annotation: N/A; putative formula: C14H28NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.243,"smiles":null,"spectrum_id":"CCMSLIB00017232055","spectrum_index":13261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 86.0372 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017232058","spectrum_index":13262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetylamino-6-formylamino-3-methyluracil (delta mass: 35.0301 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.108,"smiles":null,"spectrum_id":"CCMSLIB00017232059","spectrum_index":13263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 88.1255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.17,"smiles":null,"spectrum_id":"CCMSLIB00017232061","spectrum_index":13264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 88.0682 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017232063","spectrum_index":13265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl .alpha.-D-mannopyranoside (delta mass: 163.0437 Da; putative annotation: N/A; putative formula: C12H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.13,"smiles":null,"spectrum_id":"CCMSLIB00017232064","spectrum_index":13266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 220.1441 Da; putative annotation: N/A; putative formula: C10H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.209,"smiles":null,"spectrum_id":"CCMSLIB00017232067","spectrum_index":13267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cefotaxime (delta mass: 834.8964 Da; putative annotation: N/A; putative formula: C60H114)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1290.96,"smiles":null,"spectrum_id":"CCMSLIB00017232068","spectrum_index":13268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 51.0353 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.086,"smiles":null,"spectrum_id":"CCMSLIB00017232071","spectrum_index":13269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopentan-2-ol (delta mass: 84.0209 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017232072","spectrum_index":13270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 65.0264 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.113,"smiles":null,"spectrum_id":"CCMSLIB00017232075","spectrum_index":13271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 752.3507 Da; putative annotation: N/A; putative formula: C37H44N12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.468,"smiles":null,"spectrum_id":"CCMSLIB00017232076","spectrum_index":13272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6-methylbenzoic acid (delta mass: 38.0957 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.116,"smiles":null,"spectrum_id":"CCMSLIB00017232078","spectrum_index":13273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Phenyl-1H-indol-1-yl)propanoic acid (delta mass: 14.0202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.138,"smiles":null,"spectrum_id":"CCMSLIB00017232080","spectrum_index":13274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 112.0898 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.176,"smiles":null,"spectrum_id":"CCMSLIB00017232081","spectrum_index":13275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 113.0993 Da; putative annotation: N/A; putative formula: C5H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.159,"smiles":null,"spectrum_id":"CCMSLIB00017232084","spectrum_index":13276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 10.0092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017232085","spectrum_index":13277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 63.9982 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.095,"smiles":null,"spectrum_id":"CCMSLIB00017232088","spectrum_index":13278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 34.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017232089","spectrum_index":13279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 80.0624 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017232092","spectrum_index":13280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 681.3577 Da; putative annotation: N/A; putative formula: C45H51N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":958.574,"smiles":null,"spectrum_id":"CCMSLIB00017232093","spectrum_index":13281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.259,"smiles":null,"spectrum_id":"CCMSLIB00017232094","spectrum_index":13282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 505.3618 Da; putative annotation: N/A; putative formula: C26H51NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.432,"smiles":null,"spectrum_id":"CCMSLIB00017232097","spectrum_index":13283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine - 40.0 eV (delta mass: 77.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.15,"smiles":null,"spectrum_id":"CCMSLIB00017232098","spectrum_index":13284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne Acetate (delta mass: 106.0785 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017232101","spectrum_index":13285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 141.0785 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.248,"smiles":null,"spectrum_id":"CCMSLIB00017232102","spectrum_index":13286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uzarigenin (delta mass: 80.0615 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.315,"smiles":null,"spectrum_id":"CCMSLIB00017232105","spectrum_index":13287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isomyristic acid (delta mass: 70.0414 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.258,"smiles":null,"spectrum_id":"CCMSLIB00017232106","spectrum_index":13288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 280.1832 Da; putative annotation: N/A; putative formula: C13H24N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.27,"smiles":null,"spectrum_id":"CCMSLIB00017232108","spectrum_index":13289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 25.9731 Da; putative annotation: N/A; putative formula: C14H19N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.075,"smiles":null,"spectrum_id":"CCMSLIB00017232110","spectrum_index":13290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 184.1099 Da; putative annotation: N/A; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.238,"smiles":null,"spectrum_id":"CCMSLIB00017232111","spectrum_index":13291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 220.1673 Da; putative annotation: N/A; putative formula: C12H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.344,"smiles":null,"spectrum_id":"CCMSLIB00017232114","spectrum_index":13292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-METHOXYBENZOIC ACID CollisionEnergy:102040 (delta mass: 39.0496 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.104,"smiles":null,"spectrum_id":"CCMSLIB00017232115","spectrum_index":13293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 91.0424 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.113,"smiles":null,"spectrum_id":"CCMSLIB00017232118","spectrum_index":13294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 288.846 Da; putative annotation: N/A; putative formula: C3H4N3O-1PS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.088,"smiles":null,"spectrum_id":"CCMSLIB00017232119","spectrum_index":13295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 109.0751 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.26,"smiles":null,"spectrum_id":"CCMSLIB00017232122","spectrum_index":13296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 76.0152 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.102,"smiles":null,"spectrum_id":"CCMSLIB00017232123","spectrum_index":13297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 10.8868 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.962,"smiles":null,"spectrum_id":"CCMSLIB00017232124","spectrum_index":13298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 337.2417 Da; putative annotation: N/A; putative formula: C23H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.282,"smiles":null,"spectrum_id":"CCMSLIB00017232127","spectrum_index":13299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eleutherazine B (delta mass: 162.0527 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.323,"smiles":null,"spectrum_id":"CCMSLIB00017232128","spectrum_index":13300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 86.0516 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017232131","spectrum_index":13301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 282.2558 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.321,"smiles":null,"spectrum_id":"CCMSLIB00017232132","spectrum_index":13302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 149.1056 Da; putative annotation: N/A; putative formula: C7H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.176,"smiles":null,"spectrum_id":"CCMSLIB00017232134","spectrum_index":13303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 17.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017232136","spectrum_index":13304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 313.2626 Da; putative annotation: N/A; putative formula: C19H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.547,"smiles":null,"spectrum_id":"CCMSLIB00017232137","spectrum_index":13305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 182.1674 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017232140","spectrum_index":13306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 5.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.186,"smiles":null,"spectrum_id":"CCMSLIB00017232141","spectrum_index":13307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 396.2879 Da; putative annotation: N/A; putative formula: C23H40O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.348,"smiles":null,"spectrum_id":"CCMSLIB00017232144","spectrum_index":13308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 95.9844 Da; putative annotation: N/A; putative formula: C4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.049,"smiles":null,"spectrum_id":"CCMSLIB00017232145","spectrum_index":13309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-C5:0 (delta mass: 146.0328 Da; putative annotation: N/A; putative formula: C4H6N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.172,"smiles":null,"spectrum_id":"CCMSLIB00017232148","spectrum_index":13310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 74.0477 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.098,"smiles":null,"spectrum_id":"CCMSLIB00017232149","spectrum_index":13311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 391.2472 Da; putative annotation: N/A; putative formula: C21H33N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.553,"smiles":null,"spectrum_id":"CCMSLIB00017232152","spectrum_index":13312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 100.0677 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.279,"smiles":null,"spectrum_id":"CCMSLIB00017232153","spectrum_index":13313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 118.0993 Da; putative annotation: N/A; putative formula: C2H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.389,"smiles":null,"spectrum_id":"CCMSLIB00017232156","spectrum_index":13314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 59.0365 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.117,"smiles":null,"spectrum_id":"CCMSLIB00017232157","spectrum_index":13315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 45.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.279,"smiles":null,"spectrum_id":"CCMSLIB00017232160","spectrum_index":13316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 211.0684 Da; putative annotation: N/A; putative formula: C10H15NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.415,"smiles":null,"spectrum_id":"CCMSLIB00017232161","spectrum_index":13317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 694.4294 Da; putative annotation: N/A; putative formula: C38H62O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.49,"smiles":null,"spectrum_id":"CCMSLIB00017232162","spectrum_index":13318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LITHOCHOLIC ACID CollisionEnergy:205060 (delta mass: 72.041 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.346,"smiles":null,"spectrum_id":"CCMSLIB00017232165","spectrum_index":13319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 28.8387 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.91,"smiles":null,"spectrum_id":"CCMSLIB00017232166","spectrum_index":13320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.211,"smiles":null,"spectrum_id":"CCMSLIB00017232169","spectrum_index":13321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Eicosenoic acid (delta mass: 570.4638 Da; putative annotation: N/A; putative formula: C37H62O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.758,"smiles":null,"spectrum_id":"CCMSLIB00017232170","spectrum_index":13322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 589.1692 Da; putative annotation: N/A; putative formula: C43H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.21,"smiles":null,"spectrum_id":"CCMSLIB00017232173","spectrum_index":13323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.092,"smiles":null,"spectrum_id":"CCMSLIB00017232174","spectrum_index":13324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 119.079 Da; putative annotation: N/A; putative formula: C2H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.144,"smiles":null,"spectrum_id":"CCMSLIB00017232175","spectrum_index":13325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 818.4497 Da; putative annotation: N/A; putative formula: C34H62N10O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1063.55,"smiles":null,"spectrum_id":"CCMSLIB00017232178","spectrum_index":13326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 202.1571 Da; putative annotation: N/A; putative formula: C11H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.275,"smiles":null,"spectrum_id":"CCMSLIB00017232179","spectrum_index":13327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 28.0311 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.2,"smiles":null,"spectrum_id":"CCMSLIB00017232182","spectrum_index":13328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 321.1658 Da; putative annotation: N/A; putative formula: C12H19N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.341,"smiles":null,"spectrum_id":"CCMSLIB00017232183","spectrum_index":13329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl tyramine (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.097,"smiles":null,"spectrum_id":"CCMSLIB00017232186","spectrum_index":13330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 290.224 Da; putative annotation: N/A; putative formula: C13H31N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.305,"smiles":null,"spectrum_id":"CCMSLIB00017232187","spectrum_index":13331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Lys (delta mass: 113.0844 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.266,"smiles":null,"spectrum_id":"CCMSLIB00017232188","spectrum_index":13332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-5Z,8Z,11Z,13E,17Z-eicosapentaenoic acid (delta mass: 53.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017232191","spectrum_index":13333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-Gln (delta mass: 284.2465 Da; putative annotation: N/A; putative formula: C16H32N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.36,"smiles":null,"spectrum_id":"CCMSLIB00017232192","spectrum_index":13334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8(9)-Epoxy-5Z,11Z,14Z-eicosatrienoic acid (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.28,"smiles":null,"spectrum_id":"CCMSLIB00017232195","spectrum_index":13335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycoursodeoxycholic acid (delta mass: 98.0595 Da; putative annotation: N/A; putative formula: C3H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.381,"smiles":null,"spectrum_id":"CCMSLIB00017232196","spectrum_index":13336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 40.9767 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.11,"smiles":null,"spectrum_id":"CCMSLIB00017232199","spectrum_index":13337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxycinnamate (delta mass: 64.0312 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.102,"smiles":null,"spectrum_id":"CCMSLIB00017232200","spectrum_index":13338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-5-hydroxytryptamine (delta mass: 58.0203 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.138,"smiles":null,"spectrum_id":"CCMSLIB00017232201","spectrum_index":13339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dimethyloct-6-ene-1,2,3-triol (delta mass: 46.0205 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.169,"smiles":null,"spectrum_id":"CCMSLIB00017232204","spectrum_index":13340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 194.1455 Da; putative annotation: N/A; putative formula: C16H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.498,"smiles":null,"spectrum_id":"CCMSLIB00017232205","spectrum_index":13341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-3-piperidinamine (delta mass: 133.0529 Da; putative annotation: N/A; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.171,"smiles":null,"spectrum_id":"CCMSLIB00017232208","spectrum_index":13342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 210.1255 Da; putative annotation: N/A; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.163,"smiles":null,"spectrum_id":"CCMSLIB00017232209","spectrum_index":13343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 391.2287 Da; putative annotation: N/A; putative formula: C21H33N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.356,"smiles":null,"spectrum_id":"CCMSLIB00017232212","spectrum_index":13344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Debromohymenialdisine (delta mass: 240.2073 Da; putative annotation: N/A; putative formula: C11H24N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.306,"smiles":null,"spectrum_id":"CCMSLIB00017232213","spectrum_index":13345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 431.1794 Da; putative annotation: N/A; putative formula: C19H29NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.266,"smiles":null,"spectrum_id":"CCMSLIB00017232215","spectrum_index":13346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP012803 Benzoic acid (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.059,"smiles":null,"spectrum_id":"CCMSLIB00017232217","spectrum_index":13347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.055,"smiles":null,"spectrum_id":"CCMSLIB00017232218","spectrum_index":13348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 136.0161 Da; putative annotation: N/A; putative formula: C7H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.071,"smiles":null,"spectrum_id":"CCMSLIB00017232221","spectrum_index":13349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 378.1874 Da; putative annotation: N/A; putative formula: C22H34O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.279,"smiles":null,"spectrum_id":"CCMSLIB00017232222","spectrum_index":13350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 175.0632 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.181,"smiles":null,"spectrum_id":"CCMSLIB00017232225","spectrum_index":13351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 118.0783 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.321,"smiles":null,"spectrum_id":"CCMSLIB00017232226","spectrum_index":13352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 169.1115 Da; putative annotation: N/A; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.156,"smiles":null,"spectrum_id":"CCMSLIB00017232227","spectrum_index":13353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 511.2875 Da; putative annotation: N/A; putative formula: C37H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.41,"smiles":null,"spectrum_id":"CCMSLIB00017232230","spectrum_index":13354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.148,"smiles":null,"spectrum_id":"CCMSLIB00017232231","spectrum_index":13355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dimethyl (R)-(+)-malate (delta mass: 276.0899 Da; putative annotation: N/A; putative formula: C17H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.15,"smiles":null,"spectrum_id":"CCMSLIB00017232234","spectrum_index":13356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Coumaric acid (delta mass: 144.0537 Da; putative annotation: N/A; putative formula: C5H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.108,"smiles":null,"spectrum_id":"CCMSLIB00017232237","spectrum_index":13357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 40.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.128,"smiles":null,"spectrum_id":"CCMSLIB00017232238","spectrum_index":13358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 88.0526 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.201,"smiles":null,"spectrum_id":"CCMSLIB00017232241","spectrum_index":13359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 98.9992 Da; putative annotation: N/A; putative formula: C2H2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.116,"smiles":null,"spectrum_id":"CCMSLIB00017232242","spectrum_index":13360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholesterol (delta mass: 267.2495 Da; putative annotation: N/A; putative formula: C17H34NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.612,"smiles":null,"spectrum_id":"CCMSLIB00017232245","spectrum_index":13361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Hydroxyphenylalanine (delta mass: 32.0083 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.089,"smiles":null,"spectrum_id":"CCMSLIB00017232246","spectrum_index":13362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 115.0445 Da; putative annotation: N/A; putative formula: C5H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.141,"smiles":null,"spectrum_id":"CCMSLIB00017232249","spectrum_index":13363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 34.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.279,"smiles":null,"spectrum_id":"CCMSLIB00017232250","spectrum_index":13364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 503.1844 Da; putative annotation: N/A; putative formula: C31H25N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.313,"smiles":null,"spectrum_id":"CCMSLIB00017232253","spectrum_index":13365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-1,3-Dihydroxydammara-12,24-dien-26-oic acid (delta mass: 52.0671 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.43,"smiles":null,"spectrum_id":"CCMSLIB00017232254","spectrum_index":13366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347453-02!(E)-1,7-bis(4-hydroxyphenyl)hept-4-en-3-one (delta mass: 213.073 Da; putative annotation: N/A; putative formula: C12H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.221,"smiles":null,"spectrum_id":"CCMSLIB00017232257","spectrum_index":13367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-1,4-diazepane (delta mass: 101.0521 Da; putative annotation: N/A; putative formula: C3H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.17,"smiles":null,"spectrum_id":"CCMSLIB00017232258","spectrum_index":13368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 211.2028 Da; putative annotation: N/A; putative formula: C12H25N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.32,"smiles":null,"spectrum_id":"CCMSLIB00017232261","spectrum_index":13369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 82.0786 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.316,"smiles":null,"spectrum_id":"CCMSLIB00017232262","spectrum_index":13370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 54.0475 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.353,"smiles":null,"spectrum_id":"CCMSLIB00017232265","spectrum_index":13371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Formyl-3-hydroxyphenoxy)methyl]benzoic acid (delta mass: 132.0423 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.118,"smiles":null,"spectrum_id":"CCMSLIB00017232267","spectrum_index":13372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 152.0838 Da; putative annotation: N/A; putative formula: C9H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017232269","spectrum_index":13373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Isopinocampheol (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.154,"smiles":null,"spectrum_id":"CCMSLIB00017232272","spectrum_index":13374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 134.0585 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.139,"smiles":null,"spectrum_id":"CCMSLIB00017232273","spectrum_index":13375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 76.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.107,"smiles":null,"spectrum_id":"CCMSLIB00017232276","spectrum_index":13376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 98.0815 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.148,"smiles":null,"spectrum_id":"CCMSLIB00017232277","spectrum_index":13377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.108,"smiles":null,"spectrum_id":"CCMSLIB00017232280","spectrum_index":13378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-1-piperazinyl)acetic acid (delta mass: 88.0202 Da; putative annotation: N/A; putative formula: CH4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017232281","spectrum_index":13379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 429.2442 Da; putative annotation: N/A; putative formula: C26H32N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.285,"smiles":null,"spectrum_id":"CCMSLIB00017232284","spectrum_index":13380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 70.0411 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017232285","spectrum_index":13381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100014 Serotonin|5-HT|5-Hydoxytryptamine|3-(2-Aminoethyl)-5-hydroxyindole|Enteramine (delta mass: 489.2919 Da; putative annotation: N/A; putative formula: C21H35N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.394,"smiles":null,"spectrum_id":"CCMSLIB00017232288","spectrum_index":13382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 103.0506 Da; putative annotation: N/A; putative formula: CH5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.126,"smiles":null,"spectrum_id":"CCMSLIB00017232289","spectrum_index":13383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 229.7921 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.868,"smiles":null,"spectrum_id":"CCMSLIB00017232291","spectrum_index":13384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Untitled CollisionEnergy:102040 (delta mass: 197.1785 Da; putative annotation: N/A; putative formula: C12H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.343,"smiles":null,"spectrum_id":"CCMSLIB00017232293","spectrum_index":13385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 218.1878 Da; putative annotation: N/A; putative formula: C13H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.253,"smiles":null,"spectrum_id":"CCMSLIB00017232295","spectrum_index":13386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 66.0463 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.252,"smiles":null,"spectrum_id":"CCMSLIB00017232297","spectrum_index":13387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-methyl-9H-pyrido[3,4-b]indol-7-ol hydrochloride dihydrate (delta mass: 120.0445 Da; putative annotation: N/A; putative formula: C3H9N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.129,"smiles":null,"spectrum_id":"CCMSLIB00017232300","spectrum_index":13388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 123.052 Da; putative annotation: N/A; putative formula: C7H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.139,"smiles":null,"spectrum_id":"CCMSLIB00017232303","spectrum_index":13389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dimyristoyl-sn-glycero-3-phosphoethanolamine - 40.0 eV (delta mass: 110.1077 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.568,"smiles":null,"spectrum_id":"CCMSLIB00017232304","spectrum_index":13390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 44.98 Da; putative annotation: N/A; putative formula: NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.15,"smiles":null,"spectrum_id":"CCMSLIB00017232307","spectrum_index":13391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 740.533 Da; putative annotation: N/A; putative formula: C36H76N4O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1333.81,"smiles":null,"spectrum_id":"CCMSLIB00017232308","spectrum_index":13392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 74.0521 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.315,"smiles":null,"spectrum_id":"CCMSLIB00017232311","spectrum_index":13393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Norepiandrosterone (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017232312","spectrum_index":13394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 78.0829 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.206,"smiles":null,"spectrum_id":"CCMSLIB00017232315","spectrum_index":13395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 154.1359 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.227,"smiles":null,"spectrum_id":"CCMSLIB00017232316","spectrum_index":13396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 202.099 Da; putative annotation: N/A; putative formula: C13H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.164,"smiles":null,"spectrum_id":"CCMSLIB00017232319","spectrum_index":13397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxyculmorin (delta mass: 59.0365 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.232,"smiles":null,"spectrum_id":"CCMSLIB00017232320","spectrum_index":13398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxysalicylic acid CollisionEnergy:205060 (delta mass: 59.0276 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.077,"smiles":null,"spectrum_id":"CCMSLIB00017232321","spectrum_index":13399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 987.072 Da; putative annotation: N/A; putative formula: C40H29N9O14S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1209.17,"smiles":null,"spectrum_id":"CCMSLIB00017232324","spectrum_index":13400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one (delta mass: 50.0523 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.268,"smiles":null,"spectrum_id":"CCMSLIB00017232325","spectrum_index":13401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 315.181 Da; putative annotation: N/A; putative formula: C15H21N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.294,"smiles":null,"spectrum_id":"CCMSLIB00017232328","spectrum_index":13402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 590.2898 Da; putative annotation: N/A; putative formula: C29H38N10O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":935.532,"smiles":null,"spectrum_id":"CCMSLIB00017232329","spectrum_index":13403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of theobromine CollisionEnergy:102040 (delta mass: 59.9134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.985,"smiles":null,"spectrum_id":"CCMSLIB00017232332","spectrum_index":13404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 562.202 Da; putative annotation: N/A; putative formula: C24H38N2O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.293,"smiles":null,"spectrum_id":"CCMSLIB00017232333","spectrum_index":13405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 797.4569 Da; putative annotation: N/A; putative formula: C52H64NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.517,"smiles":null,"spectrum_id":"CCMSLIB00017232335","spectrum_index":13406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dioxa-4,10-diazacyclododecane (delta mass: 17.0065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.151,"smiles":null,"spectrum_id":"CCMSLIB00017232337","spectrum_index":13407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-4Z,6E,10Z,13Z,16Z,19Z-docosahexaenoic acid (delta mass: 72.035 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.277,"smiles":null,"spectrum_id":"CCMSLIB00017232338","spectrum_index":13408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP030402 ?-linolenic acid|linolenic acid|(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid (delta mass: 314.2445 Da; putative annotation: N/A; putative formula: C18H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.476,"smiles":null,"spectrum_id":"CCMSLIB00017232341","spectrum_index":13409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,18.Xi.)-3-Oxolup-20(29)-ene-27,28-dioic acid (delta mass: 54.0453 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.372,"smiles":null,"spectrum_id":"CCMSLIB00017232342","spectrum_index":13410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hederagenin (delta mass: 70.042 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.404,"smiles":null,"spectrum_id":"CCMSLIB00017232345","spectrum_index":13411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 76.5087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.58,"smiles":null,"spectrum_id":"CCMSLIB00017232346","spectrum_index":13412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-Acetylspermine (delta mass: 106.0417 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.275,"smiles":null,"spectrum_id":"CCMSLIB00017232347","spectrum_index":13413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one (delta mass: 38.0509 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.21,"smiles":null,"spectrum_id":"CCMSLIB00017232350","spectrum_index":13414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 351.2976 Da; putative annotation: N/A; putative formula: C15H33N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.514,"smiles":null,"spectrum_id":"CCMSLIB00017232351","spectrum_index":13415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 114.032 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.119,"smiles":null,"spectrum_id":"CCMSLIB00017232354","spectrum_index":13416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-1H-indole-3-carbaldehyde (delta mass: 168.1038 Da; putative annotation: N/A; putative formula: C12H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.125,"smiles":null,"spectrum_id":"CCMSLIB00017232355","spectrum_index":13417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 258.1929 Da; putative annotation: N/A; putative formula: C15H31O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.342,"smiles":null,"spectrum_id":"CCMSLIB00017232358","spectrum_index":13418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aureonitol (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.201,"smiles":null,"spectrum_id":"CCMSLIB00017232359","spectrum_index":13419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cinnamylpiperazine (delta mass: 63.0207 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017232361","spectrum_index":13420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-methoxybenzoic acid (delta mass: 185.1048 Da; putative annotation: N/A; putative formula: C9H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.154,"smiles":null,"spectrum_id":"CCMSLIB00017232363","spectrum_index":13421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 264.1117 Da; putative annotation: N/A; putative formula: C14H20N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.25,"smiles":null,"spectrum_id":"CCMSLIB00017232366","spectrum_index":13422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 106.0787 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.311,"smiles":null,"spectrum_id":"CCMSLIB00017232367","spectrum_index":13423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydro-11-deoxycorticosterone (delta mass: 88.0719 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.33,"smiles":null,"spectrum_id":"CCMSLIB00017232369","spectrum_index":13424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 162.1413 Da; putative annotation: N/A; putative formula: C12H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.352,"smiles":null,"spectrum_id":"CCMSLIB00017232371","spectrum_index":13425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 142.0746 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.177,"smiles":null,"spectrum_id":"CCMSLIB00017232374","spectrum_index":13426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyacetophenone (delta mass: 26.0007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.06,"smiles":null,"spectrum_id":"CCMSLIB00017232375","spectrum_index":13427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15S-Hydroxy-8Z,11Z,13E-eicosatrienoic acid (delta mass: 283.2875 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.546,"smiles":null,"spectrum_id":"CCMSLIB00017232376","spectrum_index":13428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxo-4-cholestenoic acid (delta mass: 17.974 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.295,"smiles":null,"spectrum_id":"CCMSLIB00017232379","spectrum_index":13429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 40.9434 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.009,"smiles":null,"spectrum_id":"CCMSLIB00017232380","spectrum_index":13430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-3,8a-dimethyl-5-methylidene-4a,6,7,8,9,9a-hexahydro-4H-benzo[f][1]benzofuran-2-one (delta mass: 438.3484 Da; putative annotation: N/A; putative formula: C24H47N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.497,"smiles":null,"spectrum_id":"CCMSLIB00017232383","spectrum_index":13431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 262.2236 Da; putative annotation: N/A; putative formula: C18H31O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.445,"smiles":null,"spectrum_id":"CCMSLIB00017232384","spectrum_index":13432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vindoline (delta mass: 17.0284 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.262,"smiles":null,"spectrum_id":"CCMSLIB00017232386","spectrum_index":13433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 112.0574 Da; putative annotation: N/A; putative formula: C5H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.144,"smiles":null,"spectrum_id":"CCMSLIB00017232388","spectrum_index":13434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 683.304 Da; putative annotation: N/A; putative formula: C40H41N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1027.49,"smiles":null,"spectrum_id":"CCMSLIB00017232390","spectrum_index":13435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homogentisic acid (delta mass: 133.053 Da; putative annotation: N/A; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.103,"smiles":null,"spectrum_id":"CCMSLIB00017232392","spectrum_index":13436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 88.0522 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.159,"smiles":null,"spectrum_id":"CCMSLIB00017232394","spectrum_index":13437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 148.1455 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.393,"smiles":null,"spectrum_id":"CCMSLIB00017232396","spectrum_index":13438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000103 5-hydroxyculmorin|(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol (delta mass: 230.127 Da; putative annotation: N/A; putative formula: C15H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.323,"smiles":null,"spectrum_id":"CCMSLIB00017232398","spectrum_index":13439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heptaethylene glycol p-tert-octylphenyl ether (delta mass: 60.0297 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.388,"smiles":null,"spectrum_id":"CCMSLIB00017232399","spectrum_index":13440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 232.2062 Da; putative annotation: N/A; putative formula: C14H24N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.271,"smiles":null,"spectrum_id":"CCMSLIB00017232402","spectrum_index":13441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 182.0592 Da; putative annotation: N/A; putative formula: C10H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.109,"smiles":null,"spectrum_id":"CCMSLIB00017232403","spectrum_index":13442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxy-4Z,7Z,9E,13Z,16Z,19Z-docosahexaenoic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017232406","spectrum_index":13443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 41.0279 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.39,"smiles":null,"spectrum_id":"CCMSLIB00017232407","spectrum_index":13444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 71.0047 Da; putative annotation: N/A; putative formula: CH2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.091,"smiles":null,"spectrum_id":"CCMSLIB00017232408","spectrum_index":13445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 192.1518 Da; putative annotation: N/A; putative formula: C13H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.301,"smiles":null,"spectrum_id":"CCMSLIB00017232411","spectrum_index":13446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 636.3003 Da; putative annotation: N/A; putative formula: C40H45O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1132.64,"smiles":null,"spectrum_id":"CCMSLIB00017232412","spectrum_index":13447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 239.0796 Da; putative annotation: N/A; putative formula: C6H10N9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.432,"smiles":null,"spectrum_id":"CCMSLIB00017232415","spectrum_index":13448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 55.0414 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017232418","spectrum_index":13449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 179.4028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.5,"smiles":null,"spectrum_id":"CCMSLIB00017232419","spectrum_index":13450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Hydroxytestosterone (delta mass: 104.0632 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.274,"smiles":null,"spectrum_id":"CCMSLIB00017232422","spectrum_index":13451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 90.0691 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.187,"smiles":null,"spectrum_id":"CCMSLIB00017232423","spectrum_index":13452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 27.047 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.133,"smiles":null,"spectrum_id":"CCMSLIB00017232426","spectrum_index":13453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 165.1191 Da; putative annotation: N/A; putative formula: C10H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.194,"smiles":null,"spectrum_id":"CCMSLIB00017232427","spectrum_index":13454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 73.0038 Da; putative annotation: N/A; putative formula: C4H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.106,"smiles":null,"spectrum_id":"CCMSLIB00017232428","spectrum_index":13455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 442.2923 Da; putative annotation: N/A; putative formula: C28H44P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.394,"smiles":null,"spectrum_id":"CCMSLIB00017232431","spectrum_index":13456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 464.2383 Da; putative annotation: N/A; putative formula: C21H32N6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.325,"smiles":null,"spectrum_id":"CCMSLIB00017232432","spectrum_index":13457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzoic acid (delta mass: 59.9826 Da; putative annotation: N/A; putative formula: CO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.016,"smiles":null,"spectrum_id":"CCMSLIB00017232435","spectrum_index":13458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 80.0623 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.341,"smiles":null,"spectrum_id":"CCMSLIB00017232436","spectrum_index":13459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,4-dihydroxybenzoate (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.065,"smiles":null,"spectrum_id":"CCMSLIB00017232439","spectrum_index":13460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381032-01_C21H32O3_(3R,4R,5R)-3-[(11E)-11,15-Hexadecadien-9-yn-1-yl]-4-hydroxy-5-methyldihydro-2(3H)-furanone (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017232440","spectrum_index":13461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 208.1395 Da; putative annotation: N/A; putative formula: C12H20N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.254,"smiles":null,"spectrum_id":"CCMSLIB00017232442","spectrum_index":13462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 214.1168 Da; putative annotation: N/A; putative formula: C7H14N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.172,"smiles":null,"spectrum_id":"CCMSLIB00017232444","spectrum_index":13463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 158.1365 Da; putative annotation: N/A; putative formula: C4H14N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.202,"smiles":null,"spectrum_id":"CCMSLIB00017232447","spectrum_index":13464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin///(-)-citrinin CollisionEnergy:102040 (delta mass: 141.0691 Da; putative annotation: N/A; putative formula: C9H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.16,"smiles":null,"spectrum_id":"CCMSLIB00017232448","spectrum_index":13465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 88.0526 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.243,"smiles":null,"spectrum_id":"CCMSLIB00017232450","spectrum_index":13466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Untitled CollisionEnergy:205060 (delta mass: 135.135 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.3,"smiles":null,"spectrum_id":"CCMSLIB00017232452","spectrum_index":13467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 207.1102 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.233,"smiles":null,"spectrum_id":"CCMSLIB00017232453","spectrum_index":13468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 184.1084 Da; putative annotation: N/A; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.158,"smiles":null,"spectrum_id":"CCMSLIB00017232456","spectrum_index":13469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol oxide A (delta mass: 63.0686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.269,"smiles":null,"spectrum_id":"CCMSLIB00017232457","spectrum_index":13470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-tridecylpiperidine (delta mass: 88.0885 Da; putative annotation: N/A; putative formula: CH8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.404,"smiles":null,"spectrum_id":"CCMSLIB00017232460","spectrum_index":13471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flecainide meta-O-dealkylated (delta mass: 520.1507 Da; putative annotation: N/A; putative formula: C29H16N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.293,"smiles":null,"spectrum_id":"CCMSLIB00017232461","spectrum_index":13472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 56.0631 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.222,"smiles":null,"spectrum_id":"CCMSLIB00017232463","spectrum_index":13473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 85.051 Da; putative annotation: N/A; putative formula: H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.122,"smiles":null,"spectrum_id":"CCMSLIB00017232465","spectrum_index":13474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 151.0632 Da; putative annotation: PYRIDOXINE; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017232466","spectrum_index":13475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 342.0818 Da; putative annotation: Rosmarinic acid; putative formula: C18H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.123,"smiles":null,"spectrum_id":"CCMSLIB00017232469","spectrum_index":13476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 132.0562 Da; putative annotation: 2,3-Dimethylbenzoic acid; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.117,"smiles":null,"spectrum_id":"CCMSLIB00017232470","spectrum_index":13477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid from NIST14 (delta mass: 296.2353 Da; putative annotation: 12,13-Dihydroxy-9Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.462,"smiles":null,"spectrum_id":"CCMSLIB00017232473","spectrum_index":13478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 113.084 Da; putative annotation: Massbank:CE000616 Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.207,"smiles":null,"spectrum_id":"CCMSLIB00017232474","spectrum_index":13479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 268.1307 Da; putative annotation: methyl 2-ethyl-4-[(3R,4R,5S)-5-hydroxy-4,5-dimethyl-2-oxooxolan-3-yl]-2-methyl-3-oxobutanoate; putative formula: C14H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.212,"smiles":null,"spectrum_id":"CCMSLIB00017232475","spectrum_index":13480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 296.2336 Da; putative annotation: 12,13-Dihydroxy-9Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.476,"smiles":null,"spectrum_id":"CCMSLIB00017232478","spectrum_index":13481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of Massbank:RP006902 ?-Tauromuricholic acid|2-[4-(3,6,7-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]ethanesulfonic acid (delta mass: 479.27 Da; putative annotation: \"\"2-((4R)-4-((3R,5S,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid\"\"; putative formula: C26H41NO5S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":995.569,"smiles":null,"spectrum_id":"CCMSLIB00017232479","spectrum_index":13482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLAMIDE (delta mass: 137.045 Da; putative annotation: 5-Isopropyl-3-isoxazolecarboxylic acid; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.1,"smiles":null,"spectrum_id":"CCMSLIB00017232482","spectrum_index":13483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 280.2414 Da; putative annotation: 6-Oxooctadecanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.468,"smiles":null,"spectrum_id":"CCMSLIB00017232483","spectrum_index":13484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 260.2113 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.328,"smiles":null,"spectrum_id":"CCMSLIB00017232485","spectrum_index":13485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 248.138 Da; putative annotation: Aspterric acid; putative formula: C15H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.318,"smiles":null,"spectrum_id":"CCMSLIB00017232487","spectrum_index":13486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 228.115 Da; putative annotation: Asp-Leu; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.186,"smiles":null,"spectrum_id":"CCMSLIB00017232489","spectrum_index":13487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Trp (delta mass: 241.1412 Da; putative annotation: N/A; putative formula: C13H24NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.307,"smiles":null,"spectrum_id":"CCMSLIB00017232491","spectrum_index":13488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 162.198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.258,"smiles":null,"spectrum_id":"CCMSLIB00017232493","spectrum_index":13489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 225.2092 Da; putative annotation: N/A; putative formula: C14H27NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.467,"smiles":null,"spectrum_id":"CCMSLIB00017232495","spectrum_index":13490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Nitroanilino)-2-pyrrolidinone (delta mass: 54.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.113,"smiles":null,"spectrum_id":"CCMSLIB00017232496","spectrum_index":13491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 90.0469 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.133,"smiles":null,"spectrum_id":"CCMSLIB00017232499","spectrum_index":13492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 38.0157 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017232500","spectrum_index":13493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4,6-dihydroxy-2,3-dimethylbenzoate (delta mass: 42.047 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017232502","spectrum_index":13494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 53.0631 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.102,"smiles":null,"spectrum_id":"CCMSLIB00017232504","spectrum_index":13495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Adamantanol (delta mass: 97.9955 Da; putative annotation: N/A; putative formula: C3H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.123,"smiles":null,"spectrum_id":"CCMSLIB00017232506","spectrum_index":13496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 387.1386 Da; putative annotation: N/A; putative formula: C24H22NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.199,"smiles":null,"spectrum_id":"CCMSLIB00017232508","spectrum_index":13497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.139,"smiles":null,"spectrum_id":"CCMSLIB00017232510","spectrum_index":13498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 38.0609 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.102,"smiles":null,"spectrum_id":"CCMSLIB00017232512","spectrum_index":13499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid methyl ester (delta mass: 170.115 Da; putative annotation: N/A; putative formula: C3H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.498,"smiles":null,"spectrum_id":"CCMSLIB00017232515","spectrum_index":13500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 622.3581 Da; putative annotation: N/A; putative formula: C32H62O3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.395,"smiles":null,"spectrum_id":"CCMSLIB00017232516","spectrum_index":13501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arachidonic acid leelamide (delta mass: 86.0577 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.54,"smiles":null,"spectrum_id":"CCMSLIB00017232519","spectrum_index":13502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 312.303 Da; putative annotation: N/A; putative formula: C20H40O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.34,"smiles":null,"spectrum_id":"CCMSLIB00017232520","spectrum_index":13503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labdanolic acid (delta mass: 64.0684 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.342,"smiles":null,"spectrum_id":"CCMSLIB00017232523","spectrum_index":13504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 287.1354 Da; putative annotation: N/A; putative formula: C10H13N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.227,"smiles":null,"spectrum_id":"CCMSLIB00017232524","spectrum_index":13505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 92.0988 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.367,"smiles":null,"spectrum_id":"CCMSLIB00017232527","spectrum_index":13506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 609.1852 Da; putative annotation: N/A; putative formula: C24H31N7O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.282,"smiles":null,"spectrum_id":"CCMSLIB00017232528","spectrum_index":13507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 793.4617 Da; putative annotation: N/A; putative formula: C42H67NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.532,"smiles":null,"spectrum_id":"CCMSLIB00017232530","spectrum_index":13508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 114.0725 Da; putative annotation: N/A; putative formula: C5H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.252,"smiles":null,"spectrum_id":"CCMSLIB00017232532","spectrum_index":13509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 210.1256 Da; putative annotation: N/A; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.201,"smiles":null,"spectrum_id":"CCMSLIB00017232533","spectrum_index":13510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 231.1035 Da; putative annotation: N/A; putative formula: C11H14N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.248,"smiles":null,"spectrum_id":"CCMSLIB00017232536","spectrum_index":13511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381166-01_C15H26O3_ (delta mass: 254.1862 Da; putative annotation: N/A; putative formula: C11H22N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.382,"smiles":null,"spectrum_id":"CCMSLIB00017232537","spectrum_index":13512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 276.2207 Da; putative annotation: N/A; putative formula: C17H28N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.359,"smiles":null,"spectrum_id":"CCMSLIB00017232540","spectrum_index":13513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 69.0421 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.264,"smiles":null,"spectrum_id":"CCMSLIB00017232541","spectrum_index":13514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 116.0523 Da; putative annotation: N/A; putative formula: C3H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.134,"smiles":null,"spectrum_id":"CCMSLIB00017232543","spectrum_index":13515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 341.2598 Da; putative annotation: N/A; putative formula: C18H36N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.492,"smiles":null,"spectrum_id":"CCMSLIB00017232545","spectrum_index":13516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 132.1113 Da; putative annotation: N/A; putative formula: C3H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.223,"smiles":null,"spectrum_id":"CCMSLIB00017232546","spectrum_index":13517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 288.1209 Da; putative annotation: N/A; putative formula: C13H20O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.197,"smiles":null,"spectrum_id":"CCMSLIB00017232549","spectrum_index":13518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 141.0608 Da; putative annotation: N/A; putative formula: C7H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.189,"smiles":null,"spectrum_id":"CCMSLIB00017232550","spectrum_index":13519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-tryptophan (delta mass: 122.0372 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.145,"smiles":null,"spectrum_id":"CCMSLIB00017232553","spectrum_index":13520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 27.9625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017232554","spectrum_index":13521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 340.262 Da; putative annotation: N/A; putative formula: C21H40O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.328,"smiles":null,"spectrum_id":"CCMSLIB00017232557","spectrum_index":13522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 76.0673 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.31,"smiles":null,"spectrum_id":"CCMSLIB00017232558","spectrum_index":13523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Dodecanedioic acid from NIST14 (delta mass: 39.0114 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.171,"smiles":null,"spectrum_id":"CCMSLIB00017232561","spectrum_index":13524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 40.9344 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.989,"smiles":null,"spectrum_id":"CCMSLIB00017232562","spectrum_index":13525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.216,"smiles":null,"spectrum_id":"CCMSLIB00017232563","spectrum_index":13526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 124.089 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.217,"smiles":null,"spectrum_id":"CCMSLIB00017232566","spectrum_index":13527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-5-hydroxybenzoic acid (delta mass: 15.0332 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.083,"smiles":null,"spectrum_id":"CCMSLIB00017232567","spectrum_index":13528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 278.8684 Da; putative annotation: N/A; putative formula: HN5O3S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.139,"smiles":null,"spectrum_id":"CCMSLIB00017232570","spectrum_index":13529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholestan-3-ol, (3.alpha.,5.beta.)- (delta mass: 62.0517 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.43,"smiles":null,"spectrum_id":"CCMSLIB00017232571","spectrum_index":13530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 272.1534 Da; putative annotation: N/A; putative formula: C14H25O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.24,"smiles":null,"spectrum_id":"CCMSLIB00017232574","spectrum_index":13531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 80.065 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.37,"smiles":null,"spectrum_id":"CCMSLIB00017232575","spectrum_index":13532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-1H-indole-5-carbonitrile (delta mass: 76.0418 Da; putative annotation: N/A; putative formula: C5H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.097,"smiles":null,"spectrum_id":"CCMSLIB00017232578","spectrum_index":13533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 58.0415 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017232579","spectrum_index":13534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 36.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.113,"smiles":null,"spectrum_id":"CCMSLIB00017232580","spectrum_index":13535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 29.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.102,"smiles":null,"spectrum_id":"CCMSLIB00017232583","spectrum_index":13536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 24.0361 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.247,"smiles":null,"spectrum_id":"CCMSLIB00017232584","spectrum_index":13537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 52.0319 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.165,"smiles":null,"spectrum_id":"CCMSLIB00017232587","spectrum_index":13538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 35.0983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.195,"smiles":null,"spectrum_id":"CCMSLIB00017232588","spectrum_index":13539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cyclohexylethanol (delta mass: 175.0026 Da; putative annotation: N/A; putative formula: HN9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.13,"smiles":null,"spectrum_id":"CCMSLIB00017232591","spectrum_index":13540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 301.1008 Da; putative annotation: N/A; putative formula: C22H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.353,"smiles":null,"spectrum_id":"CCMSLIB00017232592","spectrum_index":13541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-methyl-1-propanol (delta mass: 27.0471 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":117.138,"smiles":null,"spectrum_id":"CCMSLIB00017232594","spectrum_index":13542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 184.1463 Da; putative annotation: N/A; putative formula: C11H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.227,"smiles":null,"spectrum_id":"CCMSLIB00017232596","spectrum_index":13543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 90.0321 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.28,"smiles":null,"spectrum_id":"CCMSLIB00017232597","spectrum_index":13544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Nitroanilino)-2-pyrrolidinone (delta mass: 17.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.103,"smiles":null,"spectrum_id":"CCMSLIB00017232600","spectrum_index":13545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 165.0531 Da; putative annotation: N/A; putative formula: C7H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.228,"smiles":null,"spectrum_id":"CCMSLIB00017232601","spectrum_index":13546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 84.1019 Da; putative annotation: N/A; putative formula: C5H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.201,"smiles":null,"spectrum_id":"CCMSLIB00017232604","spectrum_index":13547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 90.0832 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.346,"smiles":null,"spectrum_id":"CCMSLIB00017232605","spectrum_index":13548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 46.0196 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017232608","spectrum_index":13549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleanolic acid methyl ester (delta mass: 162.1379 Da; putative annotation: N/A; putative formula: C12H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.521,"smiles":null,"spectrum_id":"CCMSLIB00017232609","spectrum_index":13550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 92.0676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.383,"smiles":null,"spectrum_id":"CCMSLIB00017232612","spectrum_index":13551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 43.0137 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.35,"smiles":null,"spectrum_id":"CCMSLIB00017232613","spectrum_index":13552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 92.0467 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.149,"smiles":null,"spectrum_id":"CCMSLIB00017232616","spectrum_index":13553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Hydroperoxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 67.0637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.285,"smiles":null,"spectrum_id":"CCMSLIB00017232617","spectrum_index":13554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arachidonoyl amide (delta mass: 98.0579 Da; putative annotation: N/A; putative formula: C3H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.321,"smiles":null,"spectrum_id":"CCMSLIB00017232619","spectrum_index":13555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 42.0832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017232621","spectrum_index":13556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 363.2613 Da; putative annotation: N/A; putative formula: C22H39NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.493,"smiles":null,"spectrum_id":"CCMSLIB00017232624","spectrum_index":13557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 172.0367 Da; putative annotation: N/A; putative formula: C7H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.097,"smiles":null,"spectrum_id":"CCMSLIB00017232625","spectrum_index":13558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 488.1732 Da; putative annotation: N/A; putative formula: C23H28N4O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.265,"smiles":null,"spectrum_id":"CCMSLIB00017232628","spectrum_index":13559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 344.1404 Da; putative annotation: N/A; putative formula: C15H24N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.185,"smiles":null,"spectrum_id":"CCMSLIB00017232629","spectrum_index":13560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 224.0648 Da; putative annotation: N/A; putative formula: C9H13N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.151,"smiles":null,"spectrum_id":"CCMSLIB00017232632","spectrum_index":13561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydroprostaglandin F2.alpha. (delta mass: 48.036 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.3,"smiles":null,"spectrum_id":"CCMSLIB00017232633","spectrum_index":13562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026502 5?-CHOLANIC ACID-3?_ 12?-DIOL-7-ONE|7-Ketodeoxycholic acid|(4R)-4-[(3R,5S,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]ph (delta mass: 488.3099 Da; putative annotation: N/A; putative formula: C24H44N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.589,"smiles":null,"spectrum_id":"CCMSLIB00017232635","spectrum_index":13563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 257.0903 Da; putative annotation: N/A; putative formula: C11H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.188,"smiles":null,"spectrum_id":"CCMSLIB00017232637","spectrum_index":13564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 122.1132 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.34,"smiles":null,"spectrum_id":"CCMSLIB00017232638","spectrum_index":13565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 330.1899 Da; putative annotation: N/A; putative formula: C24H27O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.25,"smiles":null,"spectrum_id":"CCMSLIB00017232641","spectrum_index":13566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 46.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.253,"smiles":null,"spectrum_id":"CCMSLIB00017232642","spectrum_index":13567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 55.0421 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.138,"smiles":null,"spectrum_id":"CCMSLIB00017232645","spectrum_index":13568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 329.257 Da; putative annotation: N/A; putative formula: C19H39NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.489,"smiles":null,"spectrum_id":"CCMSLIB00017232646","spectrum_index":13569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 79.0264 Da; putative annotation: N/A; putative formula: C2HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.18,"smiles":null,"spectrum_id":"CCMSLIB00017232648","spectrum_index":13570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 337.11 Da; putative annotation: N/A; putative formula: C23H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.151,"smiles":null,"spectrum_id":"CCMSLIB00017232650","spectrum_index":13571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.beta.-Hydroxy-17.alpha.-methyl-5.alpha.-androstan-1-en-3-one (delta mass: 340.24 Da; putative annotation: N/A; putative formula: C23H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.472,"smiles":null,"spectrum_id":"CCMSLIB00017232652","spectrum_index":13572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 143.0581 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.149,"smiles":null,"spectrum_id":"CCMSLIB00017232654","spectrum_index":13573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 99.032 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017232655","spectrum_index":13574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 537.2307 Da; putative annotation: N/A; putative formula: C30H39N3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.271,"smiles":null,"spectrum_id":"CCMSLIB00017232658","spectrum_index":13575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 120.0789 Da; putative annotation: N/A; putative formula: C6H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.113,"smiles":null,"spectrum_id":"CCMSLIB00017232659","spectrum_index":13576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 713.4673 Da; putative annotation: N/A; putative formula: C33H67N3O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.506,"smiles":null,"spectrum_id":"CCMSLIB00017232662","spectrum_index":13577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 100.0691 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.322,"smiles":null,"spectrum_id":"CCMSLIB00017232663","spectrum_index":13578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic LL-D253.alpha. (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017232665","spectrum_index":13579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 118.0284 Da; putative annotation: N/A; putative formula: C5H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.104,"smiles":null,"spectrum_id":"CCMSLIB00017232667","spectrum_index":13580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 142.1564 Da; putative annotation: N/A; putative formula: C7H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.243,"smiles":null,"spectrum_id":"CCMSLIB00017232669","spectrum_index":13581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 80.0623 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.326,"smiles":null,"spectrum_id":"CCMSLIB00017232671","spectrum_index":13582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Gallic acid from NIST14 (delta mass: 146.0264 Da; putative annotation: N/A; putative formula: C3H6N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.055,"smiles":null,"spectrum_id":"CCMSLIB00017232673","spectrum_index":13583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 906.9605 Da; putative annotation: N/A; putative formula: C63H122N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1412.14,"smiles":null,"spectrum_id":"CCMSLIB00017232675","spectrum_index":13584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 102.0836 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017232678","spectrum_index":13585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 69.0215 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.092,"smiles":null,"spectrum_id":"CCMSLIB00017232679","spectrum_index":13586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 207.1806 Da; putative annotation: N/A; putative formula: C2H17N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.356,"smiles":null,"spectrum_id":"CCMSLIB00017232682","spectrum_index":13587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.alpha.,9.Xi.)-3-Hydroxyolean-12-en-24-oic acid (delta mass: 146.1154 Da; putative annotation: N/A; putative formula: CH10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.483,"smiles":null,"spectrum_id":"CCMSLIB00017232683","spectrum_index":13588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cinchonine (delta mass: 75.0787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017232686","spectrum_index":13589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 236.9154 Da; putative annotation: N/A; putative formula: CH4NO7PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.075,"smiles":null,"spectrum_id":"CCMSLIB00017232687","spectrum_index":13590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE0; MS2Dec (delta mass: 137.0842 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.16,"smiles":null,"spectrum_id":"CCMSLIB00017232690","spectrum_index":13591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 36.0115 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.109,"smiles":null,"spectrum_id":"CCMSLIB00017232691","spectrum_index":13592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 164.1206 Da; putative annotation: N/A; putative formula: C11H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.202,"smiles":null,"spectrum_id":"CCMSLIB00017232694","spectrum_index":13593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 177.9999 Da; putative annotation: N/A; putative formula: CH3N6O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.06,"smiles":null,"spectrum_id":"CCMSLIB00017232695","spectrum_index":13594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzoic acid (delta mass: 258.0561 Da; putative annotation: N/A; putative formula: C11H14O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.09,"smiles":null,"spectrum_id":"CCMSLIB00017232698","spectrum_index":13595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000072 Averufin|Averufine (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.107,"smiles":null,"spectrum_id":"CCMSLIB00017232699","spectrum_index":13596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 258.1971 Da; putative annotation: N/A; putative formula: C12H27N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.267,"smiles":null,"spectrum_id":"CCMSLIB00017232702","spectrum_index":13597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 766.3046 Da; putative annotation: N/A; putative formula: C37H50O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":985.406,"smiles":null,"spectrum_id":"CCMSLIB00017232703","spectrum_index":13598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 542.3438 Da; putative annotation: N/A; putative formula: C34H54O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.404,"smiles":null,"spectrum_id":"CCMSLIB00017232706","spectrum_index":13599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benserazide (delta mass: 165.0816 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.19,"smiles":null,"spectrum_id":"CCMSLIB00017232707","spectrum_index":13600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one (delta mass: 108.0609 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.22,"smiles":null,"spectrum_id":"CCMSLIB00017232709","spectrum_index":13601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Fluorohexahydro-1H-azepine (delta mass: 100.0445 Da; putative annotation: N/A; putative formula: C5H9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.147,"smiles":null,"spectrum_id":"CCMSLIB00017232711","spectrum_index":13602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 17.3986 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.646,"smiles":null,"spectrum_id":"CCMSLIB00017232714","spectrum_index":13603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 187.1202 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.191,"smiles":null,"spectrum_id":"CCMSLIB00017232715","spectrum_index":13604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 40.0424 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.14,"smiles":null,"spectrum_id":"CCMSLIB00017232718","spectrum_index":13605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 226.1662 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.258,"smiles":null,"spectrum_id":"CCMSLIB00017232719","spectrum_index":13606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00179862-03_C20H32O2_1-Naphthalenecarboxaldehyde, decahydro-5-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-1,4a-dimethyl-6-methylene-, (1R,4aR,5S)- (delta mass: 161.1418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.389,"smiles":null,"spectrum_id":"CCMSLIB00017232720","spectrum_index":13607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxyculmorin (delta mass: 172.1608 Da; putative annotation: N/A; putative formula: C14H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.356,"smiles":null,"spectrum_id":"CCMSLIB00017232723","spectrum_index":13608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 63.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.144,"smiles":null,"spectrum_id":"CCMSLIB00017232724","spectrum_index":13609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 773.6405 Da; putative annotation: N/A; putative formula: C45H83N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":951.727,"smiles":null,"spectrum_id":"CCMSLIB00017232727","spectrum_index":13610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-Gentiobiose (delta mass: 608.2622 Da; putative annotation: N/A; putative formula: C39H38N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":951.386,"smiles":null,"spectrum_id":"CCMSLIB00017232728","spectrum_index":13611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 40.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.139,"smiles":null,"spectrum_id":"CCMSLIB00017232731","spectrum_index":13612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Hydroxybutorphanol (delta mass: 146.0578 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.28,"smiles":null,"spectrum_id":"CCMSLIB00017232732","spectrum_index":13613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 99.0508 Da; putative annotation: N/A; putative formula: C5H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.106,"smiles":null,"spectrum_id":"CCMSLIB00017232735","spectrum_index":13614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.,5.beta.-Tetrahydrocortisone (delta mass: 86.0552 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.288,"smiles":null,"spectrum_id":"CCMSLIB00017232736","spectrum_index":13615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Isopulegol (delta mass: 59.0367 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.18,"smiles":null,"spectrum_id":"CCMSLIB00017232739","spectrum_index":13616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 102.069 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.129,"smiles":null,"spectrum_id":"CCMSLIB00017232740","spectrum_index":13617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 27.994 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.085,"smiles":null,"spectrum_id":"CCMSLIB00017232742","spectrum_index":13618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 250.2067 Da; putative annotation: N/A; putative formula: C20H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.428,"smiles":null,"spectrum_id":"CCMSLIB00017232744","spectrum_index":13619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 43.9873 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.11,"smiles":null,"spectrum_id":"CCMSLIB00017232745","spectrum_index":13620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 78.0427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.108,"smiles":null,"spectrum_id":"CCMSLIB00017232748","spectrum_index":13621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 700.3027 Da; putative annotation: N/A; putative formula: C28H44N8O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.344,"smiles":null,"spectrum_id":"CCMSLIB00017232749","spectrum_index":13622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 41.0264 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.113,"smiles":null,"spectrum_id":"CCMSLIB00017232752","spectrum_index":13623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,4-dihydroxybenzoate (delta mass: 124.0534 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.103,"smiles":null,"spectrum_id":"CCMSLIB00017232753","spectrum_index":13624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Desmethylspirolide C (delta mass: 18.0098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.462,"smiles":null,"spectrum_id":"CCMSLIB00017232756","spectrum_index":13625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 25.031 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.117,"smiles":null,"spectrum_id":"CCMSLIB00017232757","spectrum_index":13626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 82.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.176,"smiles":null,"spectrum_id":"CCMSLIB00017232758","spectrum_index":13627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(6-Aminohexanamido)hexanoic acid (delta mass: 129.0791 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.265,"smiles":null,"spectrum_id":"CCMSLIB00017232761","spectrum_index":13628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-.beta.,2,5,5,8a-pentamethyl-3-oxo-, (8aS)- (delta mass: 62.0518 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.294,"smiles":null,"spectrum_id":"CCMSLIB00017232762","spectrum_index":13629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 50.0159 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.065,"smiles":null,"spectrum_id":"CCMSLIB00017232765","spectrum_index":13630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 115.0999 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.202,"smiles":null,"spectrum_id":"CCMSLIB00017232766","spectrum_index":13631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxybenzoate (delta mass: 42.0469 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017232769","spectrum_index":13632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 18.9917 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.12,"smiles":null,"spectrum_id":"CCMSLIB00017232770","spectrum_index":13633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017232773","spectrum_index":13634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 96.0939 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.326,"smiles":null,"spectrum_id":"CCMSLIB00017232774","spectrum_index":13635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385698-01!2-(1H-indol-3-yl)propanoic acid (delta mass: 169.1101 Da; putative annotation: N/A; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.196,"smiles":null,"spectrum_id":"CCMSLIB00017232777","spectrum_index":13636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 230.0525 Da; putative annotation: N/A; putative formula: C5H2N12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.165,"smiles":null,"spectrum_id":"CCMSLIB00017232778","spectrum_index":13637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 210.1256 Da; putative annotation: N/A; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.186,"smiles":null,"spectrum_id":"CCMSLIB00017232780","spectrum_index":13638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 202.1357 Da; putative annotation: N/A; putative formula: C14H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.18,"smiles":null,"spectrum_id":"CCMSLIB00017232782","spectrum_index":13639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 212.2131 Da; putative annotation: N/A; putative formula: C14H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.304,"smiles":null,"spectrum_id":"CCMSLIB00017232784","spectrum_index":13640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 676.3401 Da; putative annotation: N/A; putative formula: C43H48O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.437,"smiles":null,"spectrum_id":"CCMSLIB00017232786","spectrum_index":13641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 194.0296 Da; putative annotation: N/A; putative formula: C4H10N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.369,"smiles":null,"spectrum_id":"CCMSLIB00017232789","spectrum_index":13642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 73.0538 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.166,"smiles":null,"spectrum_id":"CCMSLIB00017232790","spectrum_index":13643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169963-02_C15H26O_(3,3,7-Trimethyltricyclo[5.4.0.0~2,9~]undec-8-yl)methanol (delta mass: 114.086 Da; putative annotation: N/A; putative formula: C7H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.292,"smiles":null,"spectrum_id":"CCMSLIB00017232793","spectrum_index":13644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 62.0521 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.274,"smiles":null,"spectrum_id":"CCMSLIB00017232795","spectrum_index":13645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 254.2248 Da; putative annotation: N/A; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.29,"smiles":null,"spectrum_id":"CCMSLIB00017232797","spectrum_index":13646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 197.1105 Da; putative annotation: N/A; putative formula: C8H15N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.186,"smiles":null,"spectrum_id":"CCMSLIB00017232798","spectrum_index":13647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,3,5-Pentamethyl-1,2,3,8-tetrahydro-7H-pyrrolo[3,2-g]quinolin-7-one (delta mass: 17.0005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.165,"smiles":null,"spectrum_id":"CCMSLIB00017232801","spectrum_index":13648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 254.1886 Da; putative annotation: N/A; putative formula: C15H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.384,"smiles":null,"spectrum_id":"CCMSLIB00017232802","spectrum_index":13649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 36.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.275,"smiles":null,"spectrum_id":"CCMSLIB00017232805","spectrum_index":13650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monopalmitolein (9c) from NIST14 (delta mass: 252.2822 Da; putative annotation: N/A; putative formula: C18H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.551,"smiles":null,"spectrum_id":"CCMSLIB00017232806","spectrum_index":13651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 106.0419 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.096,"smiles":null,"spectrum_id":"CCMSLIB00017232808","spectrum_index":13652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 114.0834 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017232810","spectrum_index":13653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 90.0834 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.445,"smiles":null,"spectrum_id":"CCMSLIB00017232811","spectrum_index":13654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 31.9453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.161,"smiles":null,"spectrum_id":"CCMSLIB00017232814","spectrum_index":13655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C16:1 (delta mass: 17.0157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.269,"smiles":null,"spectrum_id":"CCMSLIB00017232815","spectrum_index":13656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Ferulic acid; [M+H-H2O]+ (delta mass: 236.1517 Da; putative annotation: N/A; putative formula: C13H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.217,"smiles":null,"spectrum_id":"CCMSLIB00017232817","spectrum_index":13657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 126.1054 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.327,"smiles":null,"spectrum_id":"CCMSLIB00017232819","spectrum_index":13658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 86.047 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.3,"smiles":null,"spectrum_id":"CCMSLIB00017232820","spectrum_index":13659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 422.2433 Da; putative annotation: N/A; putative formula: C31H34O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.522,"smiles":null,"spectrum_id":"CCMSLIB00017232823","spectrum_index":13660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 68.0374 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.118,"smiles":null,"spectrum_id":"CCMSLIB00017232824","spectrum_index":13661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 33.0293 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.068,"smiles":null,"spectrum_id":"CCMSLIB00017232827","spectrum_index":13662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 52.0743 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.349,"smiles":null,"spectrum_id":"CCMSLIB00017232828","spectrum_index":13663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 76.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017232831","spectrum_index":13664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxycodone (delta mass: 258.094 Da; putative annotation: N/A; putative formula: C13H14N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.233,"smiles":null,"spectrum_id":"CCMSLIB00017232832","spectrum_index":13665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 202.0631 Da; putative annotation: N/A; putative formula: C12H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.192,"smiles":null,"spectrum_id":"CCMSLIB00017232835","spectrum_index":13666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,6-Dimethylphenyl)benzamide (delta mass: 104.0471 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.17,"smiles":null,"spectrum_id":"CCMSLIB00017232836","spectrum_index":13667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 353.3273 Da; putative annotation: N/A; putative formula: C18H39N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.575,"smiles":null,"spectrum_id":"CCMSLIB00017232837","spectrum_index":13668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 278.1301 Da; putative annotation: N/A; putative formula: C11H22N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.169,"smiles":null,"spectrum_id":"CCMSLIB00017232840","spectrum_index":13669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MELIBIOSE (delta mass: 65.0631 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.187,"smiles":null,"spectrum_id":"CCMSLIB00017232841","spectrum_index":13670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Nitroanilino)-2-pyrrolidinone (delta mass: 29.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.14,"smiles":null,"spectrum_id":"CCMSLIB00017232844","spectrum_index":13671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylpiperidine (delta mass: 17.015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.158,"smiles":null,"spectrum_id":"CCMSLIB00017232845","spectrum_index":13672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxypimara-8(14),15-dien-18-oic acid (delta mass: 102.0831 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.31,"smiles":null,"spectrum_id":"CCMSLIB00017232848","spectrum_index":13673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 158.1298 Da; putative annotation: N/A; putative formula: C9H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.216,"smiles":null,"spectrum_id":"CCMSLIB00017232849","spectrum_index":13674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 379.2107 Da; putative annotation: N/A; putative formula: C19H29N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.277,"smiles":null,"spectrum_id":"CCMSLIB00017232852","spectrum_index":13675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00179862-03_C20H32O2_1-Naphthalenecarboxaldehyde, decahydro-5-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-1,4a-dimethyl-6-methylene-, (1R,4aR,5S)- (delta mass: 74.0366 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.284,"smiles":null,"spectrum_id":"CCMSLIB00017232853","spectrum_index":13676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 260.0163 Da; putative annotation: N/A; putative formula: C9H8O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.363,"smiles":null,"spectrum_id":"CCMSLIB00017232856","spectrum_index":13677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aceritannin (delta mass: 400.0796 Da; putative annotation: N/A; putative formula: C13H24N2O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.177,"smiles":null,"spectrum_id":"CCMSLIB00017232857","spectrum_index":13678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 58.0383 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.119,"smiles":null,"spectrum_id":"CCMSLIB00017232859","spectrum_index":13679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-5-Phenyl-2,4-pentadienoic acid (delta mass: 71.0735 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.149,"smiles":null,"spectrum_id":"CCMSLIB00017232861","spectrum_index":13680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 77.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.181,"smiles":null,"spectrum_id":"CCMSLIB00017232862","spectrum_index":13681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homoveratrylamine (delta mass: 103.0782 Da; putative annotation: N/A; putative formula: C8H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.196,"smiles":null,"spectrum_id":"CCMSLIB00017232865","spectrum_index":13682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 931.5159 Da; putative annotation: N/A; putative formula: C47H73N5O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1094.58,"smiles":null,"spectrum_id":"CCMSLIB00017232866","spectrum_index":13683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 88.0273 Da; putative annotation: N/A; putative formula: C2H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017232869","spectrum_index":13684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 74.0363 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.326,"smiles":null,"spectrum_id":"CCMSLIB00017232870","spectrum_index":13685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 267.2556 Da; putative annotation: N/A; putative formula: C17H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.77,"smiles":null,"spectrum_id":"CCMSLIB00017232873","spectrum_index":13686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 318.2562 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.38,"smiles":null,"spectrum_id":"CCMSLIB00017232874","spectrum_index":13687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 47.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.117,"smiles":null,"spectrum_id":"CCMSLIB00017232877","spectrum_index":13688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 215.225 Da; putative annotation: N/A; putative formula: C9H25N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.436,"smiles":null,"spectrum_id":"CCMSLIB00017232878","spectrum_index":13689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5S,6R)-2-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 108.0206 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.253,"smiles":null,"spectrum_id":"CCMSLIB00017232879","spectrum_index":13690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Pro (delta mass: 163.0639 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.187,"smiles":null,"spectrum_id":"CCMSLIB00017232882","spectrum_index":13691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11-Eicosenoic acid (delta mass: 79.9568 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.251,"smiles":null,"spectrum_id":"CCMSLIB00017232883","spectrum_index":13692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 70.037 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.086,"smiles":null,"spectrum_id":"CCMSLIB00017232886","spectrum_index":13693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tuberonic acid (delta mass: 110.0735 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.201,"smiles":null,"spectrum_id":"CCMSLIB00017232887","spectrum_index":13694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 15.9932 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.262,"smiles":null,"spectrum_id":"CCMSLIB00017232890","spectrum_index":13695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 953.7195 Da; putative annotation: N/A; putative formula: C72H91NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1628.96,"smiles":null,"spectrum_id":"CCMSLIB00017232891","spectrum_index":13696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 61.2187 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.352,"smiles":null,"spectrum_id":"CCMSLIB00017232892","spectrum_index":13697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 92.0459 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.174,"smiles":null,"spectrum_id":"CCMSLIB00017232895","spectrum_index":13698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyphenethyl alcohol (delta mass: 22.0246 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017232896","spectrum_index":13699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 98.0608 Da; putative annotation: N/A; putative formula: C3H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.133,"smiles":null,"spectrum_id":"CCMSLIB00017232899","spectrum_index":13700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 70.0384 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.088,"smiles":null,"spectrum_id":"CCMSLIB00017232900","spectrum_index":13701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 693.5049 Da; putative annotation: N/A; putative formula: C38H63N9O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1000.77,"smiles":null,"spectrum_id":"CCMSLIB00017232903","spectrum_index":13702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one (delta mass: 46.0457 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.138,"smiles":null,"spectrum_id":"CCMSLIB00017232904","spectrum_index":13703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 23.9996 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.179,"smiles":null,"spectrum_id":"CCMSLIB00017232907","spectrum_index":13704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 424.2206 Da; putative annotation: N/A; putative formula: C21H32N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1099.47,"smiles":null,"spectrum_id":"CCMSLIB00017232908","spectrum_index":13705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 194.0254 Da; putative annotation: N/A; putative formula: C7H14S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.2,"smiles":null,"spectrum_id":"CCMSLIB00017232909","spectrum_index":13706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dyphylline (delta mass: 73.0526 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.161,"smiles":null,"spectrum_id":"CCMSLIB00017232912","spectrum_index":13707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 396.1245 Da; putative annotation: N/A; putative formula: C19H24O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.248,"smiles":null,"spectrum_id":"CCMSLIB00017232913","spectrum_index":13708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 147.126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.191,"smiles":null,"spectrum_id":"CCMSLIB00017232916","spectrum_index":13709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 28.0302 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.293,"smiles":null,"spectrum_id":"CCMSLIB00017232917","spectrum_index":13710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Leu (delta mass: 254.1145 Da; putative annotation: N/A; putative formula: C7H19N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.285,"smiles":null,"spectrum_id":"CCMSLIB00017232920","spectrum_index":13711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol - 30.0 eV (delta mass: 82.0779 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.237,"smiles":null,"spectrum_id":"CCMSLIB00017232921","spectrum_index":13712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 114.0678 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.237,"smiles":null,"spectrum_id":"CCMSLIB00017232922","spectrum_index":13713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10-2 (delta mass: 108.0938 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.341,"smiles":null,"spectrum_id":"CCMSLIB00017232925","spectrum_index":13714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Wilforlide A (delta mass: 154.1206 Da; putative annotation: N/A; putative formula: C7H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.473,"smiles":null,"spectrum_id":"CCMSLIB00017232926","spectrum_index":13715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 184.0517 Da; putative annotation: N/A; putative formula: C12H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.122,"smiles":null,"spectrum_id":"CCMSLIB00017232929","spectrum_index":13716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 90.0434 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.192,"smiles":null,"spectrum_id":"CCMSLIB00017232930","spectrum_index":13717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 108.0946 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.28,"smiles":null,"spectrum_id":"CCMSLIB00017232933","spectrum_index":13718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 174.0317 Da; putative annotation: N/A; putative formula: C10H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.076,"smiles":null,"spectrum_id":"CCMSLIB00017232934","spectrum_index":13719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 309.3015 Da; putative annotation: N/A; putative formula: C16H35N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.544,"smiles":null,"spectrum_id":"CCMSLIB00017232937","spectrum_index":13720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4R,5R,6S)-2-[[(2R,3S,4S,5R,6R)-6-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol (delta mass: 358.0284 Da; putative annotation: N/A; putative formula: C12H10N2O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":967.319,"smiles":null,"spectrum_id":"CCMSLIB00017232938","spectrum_index":13721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 148.1939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.29,"smiles":null,"spectrum_id":"CCMSLIB00017232939","spectrum_index":13722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 167.1676 Da; putative annotation: N/A; putative formula: C11H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.28,"smiles":null,"spectrum_id":"CCMSLIB00017232942","spectrum_index":13723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:205060 (delta mass: 216.0848 Da; putative annotation: N/A; putative formula: C9H17N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.353,"smiles":null,"spectrum_id":"CCMSLIB00017232943","spectrum_index":13724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 45.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.16,"smiles":null,"spectrum_id":"CCMSLIB00017232946","spectrum_index":13725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 165.2532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.315,"smiles":null,"spectrum_id":"CCMSLIB00017232947","spectrum_index":13726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 248.1274 Da; putative annotation: N/A; putative formula: C12H16N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.375,"smiles":null,"spectrum_id":"CCMSLIB00017232950","spectrum_index":13727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 149.5134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.573,"smiles":null,"spectrum_id":"CCMSLIB00017232951","spectrum_index":13728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxy-4-methoxybenzoic acid (delta mass: 12.0359 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.08,"smiles":null,"spectrum_id":"CCMSLIB00017232954","spectrum_index":13729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 98.0364 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.268,"smiles":null,"spectrum_id":"CCMSLIB00017232955","spectrum_index":13730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 205.9297 Da; putative annotation: N/A; putative formula: CH5O6P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.036,"smiles":null,"spectrum_id":"CCMSLIB00017232958","spectrum_index":13731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381317-01!(E)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-methyldec-8-ene-1,3-dione [IIN-based on: CCMSLIB00000846613] (delta mass: 305.2694 Da; putative annotation: N/A; putative formula: C16H31N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.476,"smiles":null,"spectrum_id":"CCMSLIB00017232959","spectrum_index":13732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Pyrrolidinylcarbonyl)piperidine (delta mass: 44.9386 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.088,"smiles":null,"spectrum_id":"CCMSLIB00017232960","spectrum_index":13733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017232963","spectrum_index":13734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosaminic acid (delta mass: 114.0687 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.15,"smiles":null,"spectrum_id":"CCMSLIB00017232964","spectrum_index":13735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 114.0842 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.254,"smiles":null,"spectrum_id":"CCMSLIB00017232967","spectrum_index":13736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 438.1751 Da; putative annotation: N/A; putative formula: C19H26N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.267,"smiles":null,"spectrum_id":"CCMSLIB00017232968","spectrum_index":13737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 137.9963 Da; putative annotation: N/A; putative formula: C7H6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.103,"smiles":null,"spectrum_id":"CCMSLIB00017232971","spectrum_index":13738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 17.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.128,"smiles":null,"spectrum_id":"CCMSLIB00017232972","spectrum_index":13739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 904.81 Da; putative annotation: N/A; putative formula: C57H108O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1214.92,"smiles":null,"spectrum_id":"CCMSLIB00017232975","spectrum_index":13740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 83.0331 Da; putative annotation: N/A; putative formula: HN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.27,"smiles":null,"spectrum_id":"CCMSLIB00017232976","spectrum_index":13741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 263.3147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.349,"smiles":null,"spectrum_id":"CCMSLIB00017232977","spectrum_index":13742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Virginiaebutanolide C (delta mass: 90.0822 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.226,"smiles":null,"spectrum_id":"CCMSLIB00017232980","spectrum_index":13743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 423.7259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.823,"smiles":null,"spectrum_id":"CCMSLIB00017232981","spectrum_index":13744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 873.5089 Da; putative annotation: N/A; putative formula: C58H63N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1054.58,"smiles":null,"spectrum_id":"CCMSLIB00017232984","spectrum_index":13745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Ethoxy-2-mercaptobenzimidazole (delta mass: 14.0192 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.078,"smiles":null,"spectrum_id":"CCMSLIB00017232985","spectrum_index":13746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 36.0427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.28,"smiles":null,"spectrum_id":"CCMSLIB00017232988","spectrum_index":13747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 102.0712 Da; putative annotation: N/A; putative formula: C4H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.377,"smiles":null,"spectrum_id":"CCMSLIB00017232989","spectrum_index":13748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 182.1058 Da; putative annotation: N/A; putative formula: C9H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.14,"smiles":null,"spectrum_id":"CCMSLIB00017232992","spectrum_index":13749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1269.6034 Da; putative annotation: N/A; putative formula: C77H91NO11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1432.66,"smiles":null,"spectrum_id":"CCMSLIB00017232993","spectrum_index":13750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 182.1306 Da; putative annotation: N/A; putative formula: C11H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.248,"smiles":null,"spectrum_id":"CCMSLIB00017232996","spectrum_index":13751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 321.1421 Da; putative annotation: N/A; putative formula: C13H23NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.244,"smiles":null,"spectrum_id":"CCMSLIB00017232997","spectrum_index":13752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 179.0791 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.306,"smiles":null,"spectrum_id":"CCMSLIB00017233000","spectrum_index":13753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylimbricatolic acid (delta mass: 104.0598 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.328,"smiles":null,"spectrum_id":"CCMSLIB00017233001","spectrum_index":13754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 191.0579 Da; putative annotation: N/A; putative formula: C10H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.149,"smiles":null,"spectrum_id":"CCMSLIB00017233002","spectrum_index":13755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetic acid methyl ester (delta mass: 98.0479 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.41,"smiles":null,"spectrum_id":"CCMSLIB00017233005","spectrum_index":13756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 267.0964 Da; putative annotation: N/A; putative formula: C10H21NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.151,"smiles":null,"spectrum_id":"CCMSLIB00017233006","spectrum_index":13757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 26.0155 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.221,"smiles":null,"spectrum_id":"CCMSLIB00017233009","spectrum_index":13758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 63.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.337,"smiles":null,"spectrum_id":"CCMSLIB00017233010","spectrum_index":13759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 82.1142 Da; putative annotation: N/A; putative formula: C7H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.179,"smiles":null,"spectrum_id":"CCMSLIB00017233013","spectrum_index":13760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 103.027 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.07,"smiles":null,"spectrum_id":"CCMSLIB00017233014","spectrum_index":13761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 340.1747 Da; putative annotation: N/A; putative formula: C15H24N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.27,"smiles":null,"spectrum_id":"CCMSLIB00017233017","spectrum_index":13762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coumaroyl putrescin (delta mass: 584.2152 Da; putative annotation: N/A; putative formula: C25H36N4O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":819.359,"smiles":null,"spectrum_id":"CCMSLIB00017233018","spectrum_index":13763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 579.4813 Da; putative annotation: N/A; putative formula: C42H61N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.552,"smiles":null,"spectrum_id":"CCMSLIB00017233021","spectrum_index":13764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 36.0389 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.25,"smiles":null,"spectrum_id":"CCMSLIB00017233022","spectrum_index":13765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,3-Difluoroazetidin-1-yl)piperidine (delta mass: 111.0602 Da; putative annotation: N/A; putative formula: C6H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.18,"smiles":null,"spectrum_id":"CCMSLIB00017233023","spectrum_index":13766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 61.02 Da; putative annotation: N/A; putative formula: H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.09,"smiles":null,"spectrum_id":"CCMSLIB00017233026","spectrum_index":13767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 66.0108 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.082,"smiles":null,"spectrum_id":"CCMSLIB00017233027","spectrum_index":13768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of salicylic acid CollisionEnergy:205060 (delta mass: 253.2433 Da; putative annotation: N/A; putative formula: C16H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.282,"smiles":null,"spectrum_id":"CCMSLIB00017233030","spectrum_index":13769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Norepiandrosterone (delta mass: 104.0472 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.263,"smiles":null,"spectrum_id":"CCMSLIB00017233031","spectrum_index":13770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 148.0461 Da; putative annotation: N/A; putative formula: C8H8N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.18,"smiles":null,"spectrum_id":"CCMSLIB00017233034","spectrum_index":13771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxycodone (delta mass: 213.1058 Da; putative annotation: N/A; putative formula: C8H15N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.245,"smiles":null,"spectrum_id":"CCMSLIB00017233035","spectrum_index":13772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Idebenone (delta mass: 23.0202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.237,"smiles":null,"spectrum_id":"CCMSLIB00017233038","spectrum_index":13773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisucaberin (delta mass: 99.0327 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.272,"smiles":null,"spectrum_id":"CCMSLIB00017233039","spectrum_index":13774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E,6E,8E,12E)-11-Hydroxy-4,8,10,12-tetramethyltetradeca-3,6,8,12-tetraenoic acid (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.237,"smiles":null,"spectrum_id":"CCMSLIB00017233041","spectrum_index":13775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 84.0559 Da; putative annotation: N/A; putative formula: CH4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.142,"smiles":null,"spectrum_id":"CCMSLIB00017233043","spectrum_index":13776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU248203 7-Amino-4-methylcoumarin|7-amino-4-methylchromen-2-one (delta mass: 54.9922 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.063,"smiles":null,"spectrum_id":"CCMSLIB00017233045","spectrum_index":13777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 282.2554 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.513,"smiles":null,"spectrum_id":"CCMSLIB00017233047","spectrum_index":13778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 116.0472 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.216,"smiles":null,"spectrum_id":"CCMSLIB00017233048","spectrum_index":13779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 99.0889 Da; putative annotation: N/A; putative formula: C3H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.248,"smiles":null,"spectrum_id":"CCMSLIB00017233051","spectrum_index":13780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 58.0992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.165,"smiles":null,"spectrum_id":"CCMSLIB00017233052","spectrum_index":13781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 72.0364 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.221,"smiles":null,"spectrum_id":"CCMSLIB00017233055","spectrum_index":13782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 106.0781 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.3,"smiles":null,"spectrum_id":"CCMSLIB00017233056","spectrum_index":13783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hexylpentanedioic acid (delta mass: 38.0493 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.193,"smiles":null,"spectrum_id":"CCMSLIB00017233059","spectrum_index":13784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatinine - 40.0 eV (delta mass: 131.0253 Da; putative annotation: N/A; putative formula: C3H6N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.092,"smiles":null,"spectrum_id":"CCMSLIB00017233060","spectrum_index":13785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 90.0827 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.305,"smiles":null,"spectrum_id":"CCMSLIB00017233063","spectrum_index":13786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 277.0468 Da; putative annotation: N/A; putative formula: C10H19NP4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.43,"smiles":null,"spectrum_id":"CCMSLIB00017233064","spectrum_index":13787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-ol (delta mass: 179.0791 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.28,"smiles":null,"spectrum_id":"CCMSLIB00017233066","spectrum_index":13788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 96.9927 Da; putative annotation: N/A; putative formula: CN5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.507,"smiles":null,"spectrum_id":"CCMSLIB00017233068","spectrum_index":13789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 46.0026 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.12,"smiles":null,"spectrum_id":"CCMSLIB00017233071","spectrum_index":13790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 209.1257 Da; putative annotation: N/A; putative formula: C5H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.191,"smiles":null,"spectrum_id":"CCMSLIB00017233072","spectrum_index":13791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 31.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.086,"smiles":null,"spectrum_id":"CCMSLIB00017233075","spectrum_index":13792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 44.0413 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.096,"smiles":null,"spectrum_id":"CCMSLIB00017233076","spectrum_index":13793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 285.1325 Da; putative annotation: N/A; putative formula: C12H19N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.214,"smiles":null,"spectrum_id":"CCMSLIB00017233079","spectrum_index":13794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 62.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.092,"smiles":null,"spectrum_id":"CCMSLIB00017233080","spectrum_index":13795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine, 2-(diphenylmethyl)-, (2S)- (delta mass: 159.0681 Da; putative annotation: N/A; putative formula: C10H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.227,"smiles":null,"spectrum_id":"CCMSLIB00017233082","spectrum_index":13796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 158.1005 Da; putative annotation: N/A; putative formula: C6H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.26,"smiles":null,"spectrum_id":"CCMSLIB00017233084","spectrum_index":13797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 92.0622 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.273,"smiles":null,"spectrum_id":"CCMSLIB00017233086","spectrum_index":13798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 41.9259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.029,"smiles":null,"spectrum_id":"CCMSLIB00017233088","spectrum_index":13799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 292.166 Da; putative annotation: N/A; putative formula: C11H25N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.234,"smiles":null,"spectrum_id":"CCMSLIB00017233089","spectrum_index":13800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid CollisionEnergy:205060 (delta mass: 222.9328 Da; putative annotation: N/A; putative formula: C5H6NOPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.962,"smiles":null,"spectrum_id":"CCMSLIB00017233092","spectrum_index":13801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347612-02_C20H30O4_17-Hydroxy-15,16-epoxykauran-18-oic acid (delta mass: 17.0283 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.25,"smiles":null,"spectrum_id":"CCMSLIB00017233093","spectrum_index":13802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 82.0785 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017233096","spectrum_index":13803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 50.9995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017233097","spectrum_index":13804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydro-11-deoxycorticosterone (delta mass: 64.069 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.327,"smiles":null,"spectrum_id":"CCMSLIB00017233100","spectrum_index":13805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 104.0463 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.294,"smiles":null,"spectrum_id":"CCMSLIB00017233101","spectrum_index":13806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 91.0869 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.376,"smiles":null,"spectrum_id":"CCMSLIB00017233104","spectrum_index":13807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 609.4753 Da; putative annotation: N/A; putative formula: C39H63NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.707,"smiles":null,"spectrum_id":"CCMSLIB00017233105","spectrum_index":13808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.102,"smiles":null,"spectrum_id":"CCMSLIB00017233107","spectrum_index":13809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-8,11,14-Eicosatrienoic acid (delta mass: 102.0841 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.347,"smiles":null,"spectrum_id":"CCMSLIB00017233109","spectrum_index":13810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 58.0177 Da; putative annotation: N/A; putative formula: CH2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.063,"smiles":null,"spectrum_id":"CCMSLIB00017233110","spectrum_index":13811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 123.0271 Da; putative annotation: N/A; putative formula: CH5N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.114,"smiles":null,"spectrum_id":"CCMSLIB00017233113","spectrum_index":13812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 253.0214 Da; putative annotation: N/A; putative formula: C10H7NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.082,"smiles":null,"spectrum_id":"CCMSLIB00017233114","spectrum_index":13813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetramethylcyclopropane-1-carboxylic acid (delta mass: 327.1347 Da; putative annotation: N/A; putative formula: C14H22N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.241,"smiles":null,"spectrum_id":"CCMSLIB00017233117","spectrum_index":13814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 29.0265 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.196,"smiles":null,"spectrum_id":"CCMSLIB00017233118","spectrum_index":13815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Dehydropetasol (delta mass: 36.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017233121","spectrum_index":13816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Bromo-2-formylphenoxy)acetic acid (delta mass: 123.9806 Da; putative annotation: N/A; putative formula: C6H4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.941,"smiles":null,"spectrum_id":"CCMSLIB00017233122","spectrum_index":13817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 57.0216 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.076,"smiles":null,"spectrum_id":"CCMSLIB00017233125","spectrum_index":13818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 84.0093 Da; putative annotation: N/A; putative formula: C6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.112,"smiles":null,"spectrum_id":"CCMSLIB00017233126","spectrum_index":13819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 17.927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.006,"smiles":null,"spectrum_id":"CCMSLIB00017233127","spectrum_index":13820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-oxo-3-piperidinecarboxylate (delta mass: 55.0308 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017233130","spectrum_index":13821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 120.0578 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.107,"smiles":null,"spectrum_id":"CCMSLIB00017233131","spectrum_index":13822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 406.2933 Da; putative annotation: N/A; putative formula: C21H42O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.358,"smiles":null,"spectrum_id":"CCMSLIB00017233134","spectrum_index":13823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxymandelic acid (delta mass: 76.0315 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.081,"smiles":null,"spectrum_id":"CCMSLIB00017233135","spectrum_index":13824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 44.1048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.201,"smiles":null,"spectrum_id":"CCMSLIB00017233138","spectrum_index":13825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 144.131 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.379,"smiles":null,"spectrum_id":"CCMSLIB00017233139","spectrum_index":13826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 64.0683 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.311,"smiles":null,"spectrum_id":"CCMSLIB00017233142","spectrum_index":13827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 86.0268 Da; putative annotation: N/A; putative formula: C6H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.102,"smiles":null,"spectrum_id":"CCMSLIB00017233144","spectrum_index":13828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Piperidinyl)-2-pyrrolidinone (delta mass: 86.0002 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.134,"smiles":null,"spectrum_id":"CCMSLIB00017233146","spectrum_index":13829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 297.2672 Da; putative annotation: N/A; putative formula: C18H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.452,"smiles":null,"spectrum_id":"CCMSLIB00017233149","spectrum_index":13830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 118.1159 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.239,"smiles":null,"spectrum_id":"CCMSLIB00017233150","spectrum_index":13831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 247.1126 Da; putative annotation: N/A; putative formula: C14H18NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.178,"smiles":null,"spectrum_id":"CCMSLIB00017233153","spectrum_index":13832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 349.2002 Da; putative annotation: N/A; putative formula: C18H27N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.265,"smiles":null,"spectrum_id":"CCMSLIB00017233154","spectrum_index":13833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 66.0469 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017233157","spectrum_index":13834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 144.0417 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.112,"smiles":null,"spectrum_id":"CCMSLIB00017233158","spectrum_index":13835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 140.0262 Da; putative annotation: N/A; putative formula: C10H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.123,"smiles":null,"spectrum_id":"CCMSLIB00017233160","spectrum_index":13836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 260.2138 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.467,"smiles":null,"spectrum_id":"CCMSLIB00017233162","spectrum_index":13837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 260.2142 Da; putative annotation: Spectral Match to Pinolenic acid from NIST14; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.274,"smiles":null,"spectrum_id":"CCMSLIB00017233164","spectrum_index":13838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linalool oxide (delta mass: 152.122 Da; putative annotation: Linalool oxide; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.26,"smiles":null,"spectrum_id":"CCMSLIB00017233166","spectrum_index":13839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 462.2619 Da; putative annotation: Neoandrographolide; putative formula: C26H38O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.504,"smiles":null,"spectrum_id":"CCMSLIB00017233167","spectrum_index":13840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 162.0507 Da; putative annotation: D-(+)-Mannose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.137,"smiles":null,"spectrum_id":"CCMSLIB00017233170","spectrum_index":13841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 134.1072 Da; putative annotation: 1-Adamantanol; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.48,"smiles":null,"spectrum_id":"CCMSLIB00017233172","spectrum_index":13842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 100.016 Da; putative annotation: D-Erythronic acid .gamma.-lactone; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.076,"smiles":null,"spectrum_id":"CCMSLIB00017233174","spectrum_index":13843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 131.0584 Da; putative annotation: 3-Methyladenine - 40.0 eV; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.129,"smiles":null,"spectrum_id":"CCMSLIB00017233176","spectrum_index":13844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 335.2824 Da; putative annotation: Gly-C19:1; putative formula: C21H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.546,"smiles":null,"spectrum_id":"CCMSLIB00017233179","spectrum_index":13845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 132.0936 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.315,"smiles":null,"spectrum_id":"CCMSLIB00017233181","spectrum_index":13846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 184.1105 Da; putative annotation: sebacic_acid; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.207,"smiles":null,"spectrum_id":"CCMSLIB00017233183","spectrum_index":13847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE - 70.0 eV (delta mass: 192.0776 Da; putative annotation: 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one; putative formula: C11H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.122,"smiles":null,"spectrum_id":"CCMSLIB00017233184","spectrum_index":13848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-oxo-5beta-cholanic acid (delta mass: 338.2052 Da; putative annotation: (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid; putative formula: C19H30O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.495,"smiles":null,"spectrum_id":"CCMSLIB00017233187","spectrum_index":13849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 164.0473 Da; putative annotation: p-Hydroxyphenyllactic acid; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.113,"smiles":null,"spectrum_id":"CCMSLIB00017233188","spectrum_index":13850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 116.0602 Da; putative annotation: (2S)-2-Amino-4-(aminooxy)butanoic acid; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.125,"smiles":null,"spectrum_id":"CCMSLIB00017233191","spectrum_index":13851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 234.1256 Da; putative annotation: \"\"NCGC00160304-01!4-(4-Methyl-pent-3-enyl)-cyclohex-4-ene-1,2-dicarboxylic acid\"\"; putative formula: C14H18O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.31,"smiles":null,"spectrum_id":"CCMSLIB00017233192","spectrum_index":13852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 108.0927 Da; putative annotation: Bicyclo[2.2.1]heptane-2-methanol; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017233194","spectrum_index":13853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline (delta mass: 145.0765 Da; putative annotation: 1-Deoxynojirimycin; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.137,"smiles":null,"spectrum_id":"CCMSLIB00017233196","spectrum_index":13854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 364.2634 Da; putative annotation: 16,16-Dimethylprostaglandin E1; putative formula: C22H36O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.323,"smiles":null,"spectrum_id":"CCMSLIB00017233198","spectrum_index":13855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 352.1059 Da; putative annotation: 1-[3-Carboxy-3-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]propyl]pyridin-1-ium-3-carboxylate; putative formula: C19H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.192,"smiles":null,"spectrum_id":"CCMSLIB00017233200","spectrum_index":13856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Decanoyl-2-hydroxy-sn-glycero-3-phosphocholine (delta mass: 84.0916 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.337,"smiles":null,"spectrum_id":"CCMSLIB00017233202","spectrum_index":13857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valeryl-carnitine; AIF; CE30; CorrDec (delta mass: 54.047 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.217,"smiles":null,"spectrum_id":"CCMSLIB00017233204","spectrum_index":13858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLAMIDE (delta mass: 202.135 Da; putative annotation: N/A; putative formula: C8H19N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.19,"smiles":null,"spectrum_id":"CCMSLIB00017233206","spectrum_index":13859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 257.1248 Da; putative annotation: N/A; putative formula: C9H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.377,"smiles":null,"spectrum_id":"CCMSLIB00017233208","spectrum_index":13860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 478.2337 Da; putative annotation: N/A; putative formula: C26H34N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.513,"smiles":null,"spectrum_id":"CCMSLIB00017233209","spectrum_index":13861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 88.0717 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.277,"smiles":null,"spectrum_id":"CCMSLIB00017233212","spectrum_index":13862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxykaurenolide (delta mass: 96.0576 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.269,"smiles":null,"spectrum_id":"CCMSLIB00017233213","spectrum_index":13863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F1.alpha. alcohol (delta mass: 86.0524 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.337,"smiles":null,"spectrum_id":"CCMSLIB00017233216","spectrum_index":13864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 113.0557 Da; putative annotation: N/A; putative formula: H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.142,"smiles":null,"spectrum_id":"CCMSLIB00017233217","spectrum_index":13865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.alpha.-Hydroxytestosterone (delta mass: 156.0766 Da; putative annotation: N/A; putative formula: C4H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.288,"smiles":null,"spectrum_id":"CCMSLIB00017233220","spectrum_index":13866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 210.089 Da; putative annotation: N/A; putative formula: C11H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017233221","spectrum_index":13867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017233224","spectrum_index":13868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 298.2491 Da; putative annotation: N/A; putative formula: C14H30N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.492,"smiles":null,"spectrum_id":"CCMSLIB00017233226","spectrum_index":13869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU287201 Icaridin|butan-2-yl 2-(2-hydroxyethyl)piperidine-1-carboxylate (delta mass: 265.2035 Da; putative annotation: N/A; putative formula: C16H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.379,"smiles":null,"spectrum_id":"CCMSLIB00017233228","spectrum_index":13870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetic acid, 2-[[2'-(5-ethyl-3,4-diphenyl-1H-pyrazol-1-yl)[1,1'-biphenyl]-3-yl]oxy]- (delta mass: 35.0465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.248,"smiles":null,"spectrum_id":"CCMSLIB00017233229","spectrum_index":13871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 218.1676 Da; putative annotation: N/A; putative formula: C15H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.254,"smiles":null,"spectrum_id":"CCMSLIB00017233232","spectrum_index":13872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 26.0595 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.13,"smiles":null,"spectrum_id":"CCMSLIB00017233235","spectrum_index":13873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 94.0787 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.342,"smiles":null,"spectrum_id":"CCMSLIB00017233236","spectrum_index":13874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 172.0735 Da; putative annotation: N/A; putative formula: C8H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.212,"smiles":null,"spectrum_id":"CCMSLIB00017233239","spectrum_index":13875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-N-stearoylsphingosine (delta mass: 348.3365 Da; putative annotation: N/A; putative formula: C20H40N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.626,"smiles":null,"spectrum_id":"CCMSLIB00017233240","spectrum_index":13876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 397.2313 Da; putative annotation: N/A; putative formula: C17H35NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.286,"smiles":null,"spectrum_id":"CCMSLIB00017233242","spectrum_index":13877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-hydroxybenzoic acid CollisionEnergy:102040 (delta mass: 44.0259 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.076,"smiles":null,"spectrum_id":"CCMSLIB00017233244","spectrum_index":13878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 370.1947 Da; putative annotation: N/A; putative formula: C14H30N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.265,"smiles":null,"spectrum_id":"CCMSLIB00017233246","spectrum_index":13879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroeburicoic acid (delta mass: 154.1149 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.482,"smiles":null,"spectrum_id":"CCMSLIB00017233248","spectrum_index":13880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 288.1474 Da; putative annotation: N/A; putative formula: C16H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.249,"smiles":null,"spectrum_id":"CCMSLIB00017233250","spectrum_index":13881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[5-[(3Z,6Z)-2,12-Dihydroxydodeca-3,6-dienyl]oxolan-2-yl]acetic acid (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.227,"smiles":null,"spectrum_id":"CCMSLIB00017233252","spectrum_index":13882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 64.0675 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.331,"smiles":null,"spectrum_id":"CCMSLIB00017233254","spectrum_index":13883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 53.0468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017233256","spectrum_index":13884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 677.2693 Da; putative annotation: N/A; putative formula: C34H47NO9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.371,"smiles":null,"spectrum_id":"CCMSLIB00017233258","spectrum_index":13885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 29.0255 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.127,"smiles":null,"spectrum_id":"CCMSLIB00017233261","spectrum_index":13886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Hydroxypregnenolone (delta mass: 90.0499 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.292,"smiles":null,"spectrum_id":"CCMSLIB00017233263","spectrum_index":13887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aleuretic Acid (delta mass: 104.0976 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.33,"smiles":null,"spectrum_id":"CCMSLIB00017233265","spectrum_index":13888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 180.0299 Da; putative annotation: N/A; putative formula: C4H9N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.09,"smiles":null,"spectrum_id":"CCMSLIB00017233267","spectrum_index":13889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 117.0578 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.123,"smiles":null,"spectrum_id":"CCMSLIB00017233268","spectrum_index":13890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 152.9938 Da; putative annotation: N/A; putative formula: CH4N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.133,"smiles":null,"spectrum_id":"CCMSLIB00017233271","spectrum_index":13891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-4-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 154.1361 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017233272","spectrum_index":13892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 378.2769 Da; putative annotation: N/A; putative formula: C23H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.337,"smiles":null,"spectrum_id":"CCMSLIB00017233275","spectrum_index":13893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 497.154 Da; putative annotation: N/A; putative formula: C25H28N3O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.214,"smiles":null,"spectrum_id":"CCMSLIB00017233276","spectrum_index":13894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 311.1227 Da; putative annotation: N/A; putative formula: C22H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.323,"smiles":null,"spectrum_id":"CCMSLIB00017233278","spectrum_index":13895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 98.0843 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.171,"smiles":null,"spectrum_id":"CCMSLIB00017233280","spectrum_index":13896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 108.8854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.972,"smiles":null,"spectrum_id":"CCMSLIB00017233281","spectrum_index":13897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-methyl-4-methylidene-7-(propan-2-yl)-1,2,3,3a,4,5,6,8a-octahydroazulen-1-ol (delta mass: 150.1037 Da; putative annotation: N/A; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.294,"smiles":null,"spectrum_id":"CCMSLIB00017233284","spectrum_index":13898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 401.1991 Da; putative annotation: N/A; putative formula: C26H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.296,"smiles":null,"spectrum_id":"CCMSLIB00017233285","spectrum_index":13899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 108.9221 Da; putative annotation: N/A; putative formula: NPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.987,"smiles":null,"spectrum_id":"CCMSLIB00017233288","spectrum_index":13900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.259,"smiles":null,"spectrum_id":"CCMSLIB00017233289","spectrum_index":13901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethyl-4-pentenoic acid (delta mass: 28.0324 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.123,"smiles":null,"spectrum_id":"CCMSLIB00017233291","spectrum_index":13902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 68.0504 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.267,"smiles":null,"spectrum_id":"CCMSLIB00017233293","spectrum_index":13903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(4-Fluorophenyl)-1H-indole (delta mass: 29.0098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.097,"smiles":null,"spectrum_id":"CCMSLIB00017233296","spectrum_index":13904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 94.0385 Da; putative annotation: N/A; putative formula: C2H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.208,"smiles":null,"spectrum_id":"CCMSLIB00017233297","spectrum_index":13905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 41.9992 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.107,"smiles":null,"spectrum_id":"CCMSLIB00017233299","spectrum_index":13906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 73.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.165,"smiles":null,"spectrum_id":"CCMSLIB00017233301","spectrum_index":13907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 394.256 Da; putative annotation: N/A; putative formula: C24H34N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.394,"smiles":null,"spectrum_id":"CCMSLIB00017233303","spectrum_index":13908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carboxyibuprofen (delta mass: 45.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.16,"smiles":null,"spectrum_id":"CCMSLIB00017233305","spectrum_index":13909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (R)-(+)-Citronellic acid from NIST14 (delta mass: 46.0058 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.144,"smiles":null,"spectrum_id":"CCMSLIB00017233307","spectrum_index":13910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Fluoro-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 257.2569 Da; putative annotation: N/A; putative formula: C13H31N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.355,"smiles":null,"spectrum_id":"CCMSLIB00017233309","spectrum_index":13911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 123.0572 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.175,"smiles":null,"spectrum_id":"CCMSLIB00017233311","spectrum_index":13912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5,9-trihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one (delta mass: 100.0647 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.219,"smiles":null,"spectrum_id":"CCMSLIB00017233313","spectrum_index":13913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 105.9762 Da; putative annotation: N/A; putative formula: CH3N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.203,"smiles":null,"spectrum_id":"CCMSLIB00017233315","spectrum_index":13914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 45.067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.133,"smiles":null,"spectrum_id":"CCMSLIB00017233317","spectrum_index":13915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Butylurea (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.165,"smiles":null,"spectrum_id":"CCMSLIB00017233318","spectrum_index":13916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 157.1462 Da; putative annotation: N/A; putative formula: C9H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.28,"smiles":null,"spectrum_id":"CCMSLIB00017233321","spectrum_index":13917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 700.5257 Da; putative annotation: N/A; putative formula: C47H72O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":977.742,"smiles":null,"spectrum_id":"CCMSLIB00017233322","spectrum_index":13918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 173.1421 Da; putative annotation: N/A; putative formula: C9H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.249,"smiles":null,"spectrum_id":"CCMSLIB00017233325","spectrum_index":13919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 90.0811 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.371,"smiles":null,"spectrum_id":"CCMSLIB00017233326","spectrum_index":13920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 98.0061 Da; putative annotation: N/A; putative formula: C2H2N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.087,"smiles":null,"spectrum_id":"CCMSLIB00017233327","spectrum_index":13921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 189.0429 Da; putative annotation: N/A; putative formula: C10H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.093,"smiles":null,"spectrum_id":"CCMSLIB00017233330","spectrum_index":13922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupolyphagin (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.13,"smiles":null,"spectrum_id":"CCMSLIB00017233331","spectrum_index":13923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NEROLIDOL CollisionEnergy:205060 (delta mass: 160.0733 Da; putative annotation: N/A; putative formula: C7H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.279,"smiles":null,"spectrum_id":"CCMSLIB00017233334","spectrum_index":13924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-7-methoxycoumarin (delta mass: 150.1077 Da; putative annotation: N/A; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.157,"smiles":null,"spectrum_id":"CCMSLIB00017233336","spectrum_index":13925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 688.2027 Da; putative annotation: N/A; putative formula: C35H36N4O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.244,"smiles":null,"spectrum_id":"CCMSLIB00017233338","spectrum_index":13926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 47.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.134,"smiles":null,"spectrum_id":"CCMSLIB00017233339","spectrum_index":13927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 187.1215 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.192,"smiles":null,"spectrum_id":"CCMSLIB00017233342","spectrum_index":13928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 120.0185 Da; putative annotation: N/A; putative formula: C3N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.079,"smiles":null,"spectrum_id":"CCMSLIB00017233344","spectrum_index":13929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 56.0283 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.25,"smiles":null,"spectrum_id":"CCMSLIB00017233346","spectrum_index":13930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ent-15-Hydroxy-8(17)-labden-2-one (delta mass: 18.0112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.274,"smiles":null,"spectrum_id":"CCMSLIB00017233347","spectrum_index":13931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 136.0371 Da; putative annotation: N/A; putative formula: C4H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.113,"smiles":null,"spectrum_id":"CCMSLIB00017233350","spectrum_index":13932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 458.1476 Da; putative annotation: N/A; putative formula: C26H22N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.244,"smiles":null,"spectrum_id":"CCMSLIB00017233351","spectrum_index":13933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 171.0675 Da; putative annotation: N/A; putative formula: C5H10N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.18,"smiles":null,"spectrum_id":"CCMSLIB00017233354","spectrum_index":13934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 513.2776 Da; putative annotation: N/A; putative formula: C27H39N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.338,"smiles":null,"spectrum_id":"CCMSLIB00017233356","spectrum_index":13935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 94.0782 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.436,"smiles":null,"spectrum_id":"CCMSLIB00017233358","spectrum_index":13936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 223.1142 Da; putative annotation: N/A; putative formula: C11H17N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.194,"smiles":null,"spectrum_id":"CCMSLIB00017233360","spectrum_index":13937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dichlorokynurenic acid (delta mass: 24.0101 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.982,"smiles":null,"spectrum_id":"CCMSLIB00017233362","spectrum_index":13938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentisic acid (delta mass: 87.0561 Da; putative annotation: N/A; putative formula: CH5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.09,"smiles":null,"spectrum_id":"CCMSLIB00017233363","spectrum_index":13939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 203.1981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.311,"smiles":null,"spectrum_id":"CCMSLIB00017233366","spectrum_index":13940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 144.1306 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.399,"smiles":null,"spectrum_id":"CCMSLIB00017233367","spectrum_index":13941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kirenol (delta mass: 136.1247 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.378,"smiles":null,"spectrum_id":"CCMSLIB00017233369","spectrum_index":13942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 24.9978 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.1,"smiles":null,"spectrum_id":"CCMSLIB00017233371","spectrum_index":13943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 68.009 Da; putative annotation: N/A; putative formula: C4H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.111,"smiles":null,"spectrum_id":"CCMSLIB00017233373","spectrum_index":13944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 131.0945 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.176,"smiles":null,"spectrum_id":"CCMSLIB00017233375","spectrum_index":13945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-butyric acid CollisionEnergy:102040 (delta mass: 83.0364 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.138,"smiles":null,"spectrum_id":"CCMSLIB00017233377","spectrum_index":13946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 315.205 Da; putative annotation: N/A; putative formula: C16H29NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.265,"smiles":null,"spectrum_id":"CCMSLIB00017233379","spectrum_index":13947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 794.449 Da; putative annotation: N/A; putative formula: C45H54N12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":975.52,"smiles":null,"spectrum_id":"CCMSLIB00017233381","spectrum_index":13948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 120.1331 Da; putative annotation: N/A; putative formula: C10H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.198,"smiles":null,"spectrum_id":"CCMSLIB00017233383","spectrum_index":13949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid (delta mass: 14.0162 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.384,"smiles":null,"spectrum_id":"CCMSLIB00017233385","spectrum_index":13950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 51.0324 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.259,"smiles":null,"spectrum_id":"CCMSLIB00017233387","spectrum_index":13951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.082,"smiles":null,"spectrum_id":"CCMSLIB00017233389","spectrum_index":13952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-[(Z)-oct-2-enyl]pentanedioic acid (delta mass: 66.0468 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017233391","spectrum_index":13953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 284.1949 Da; putative annotation: N/A; putative formula: C12H24N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.297,"smiles":null,"spectrum_id":"CCMSLIB00017233393","spectrum_index":13954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zymosterol (delta mass: 68.0625 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.409,"smiles":null,"spectrum_id":"CCMSLIB00017233395","spectrum_index":13955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 676.4455 Da; putative annotation: N/A; putative formula: C41H60N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.532,"smiles":null,"spectrum_id":"CCMSLIB00017233397","spectrum_index":13956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 90.0504 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.22,"smiles":null,"spectrum_id":"CCMSLIB00017233399","spectrum_index":13957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-11-2-1 (delta mass: 211.0697 Da; putative annotation: N/A; putative formula: C9H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.317,"smiles":null,"spectrum_id":"CCMSLIB00017233401","spectrum_index":13958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 4-ethyl-2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 40.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.243,"smiles":null,"spectrum_id":"CCMSLIB00017233402","spectrum_index":13959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin E (delta mass: 35.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.227,"smiles":null,"spectrum_id":"CCMSLIB00017233405","spectrum_index":13960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 634.2627 Da; putative annotation: N/A; putative formula: C38H34N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.364,"smiles":null,"spectrum_id":"CCMSLIB00017233407","spectrum_index":13961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 382.2729 Da; putative annotation: N/A; putative formula: C23H42S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.396,"smiles":null,"spectrum_id":"CCMSLIB00017233409","spectrum_index":13962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zymosterol (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.352,"smiles":null,"spectrum_id":"CCMSLIB00017233411","spectrum_index":13963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU252006 2-(Piperazin-1-yl)ethanamine|1-Piperazineethanamine|2-piperazin-1-ylethanamine (delta mass: 73.8261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.96,"smiles":null,"spectrum_id":"CCMSLIB00017233413","spectrum_index":13964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Didodecyl 3,3'-thiodipropionate oxide from NIST14 - Hydroxylated variant ? (delta mass: 307.2879 Da; putative annotation: N/A; putative formula: C20H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.696,"smiles":null,"spectrum_id":"CCMSLIB00017233414","spectrum_index":13965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 67.0994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.337,"smiles":null,"spectrum_id":"CCMSLIB00017233417","spectrum_index":13966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 78.0314 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.221,"smiles":null,"spectrum_id":"CCMSLIB00017233418","spectrum_index":13967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-C13:1 (delta mass: 69.0658 Da; putative annotation: N/A; putative formula: C3H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.352,"smiles":null,"spectrum_id":"CCMSLIB00017233421","spectrum_index":13968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 351.0894 Da; putative annotation: N/A; putative formula: C23H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.291,"smiles":null,"spectrum_id":"CCMSLIB00017233422","spectrum_index":13969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.alpha.-estrane-3.alpha.,17.beta.-diol (delta mass: 48.0365 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.3,"smiles":null,"spectrum_id":"CCMSLIB00017233425","spectrum_index":13970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 88.0888 Da; putative annotation: N/A; putative formula: CH8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.274,"smiles":null,"spectrum_id":"CCMSLIB00017233426","spectrum_index":13971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 178.1193 Da; putative annotation: N/A; putative formula: C12H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.226,"smiles":null,"spectrum_id":"CCMSLIB00017233428","spectrum_index":13972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 17.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.196,"smiles":null,"spectrum_id":"CCMSLIB00017233430","spectrum_index":13973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 260.25 Da; putative annotation: N/A; putative formula: C19H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.342,"smiles":null,"spectrum_id":"CCMSLIB00017233432","spectrum_index":13974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 386.3512 Da; putative annotation: N/A; putative formula: C22H46N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.399,"smiles":null,"spectrum_id":"CCMSLIB00017233434","spectrum_index":13975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Methionine (delta mass: 114.0676 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.126,"smiles":null,"spectrum_id":"CCMSLIB00017233435","spectrum_index":13976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 139.0875 Da; putative annotation: N/A; putative formula: C5H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.2,"smiles":null,"spectrum_id":"CCMSLIB00017233436","spectrum_index":13977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 131.0465 Da; putative annotation: N/A; putative formula: C7H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.17,"smiles":null,"spectrum_id":"CCMSLIB00017233439","spectrum_index":13978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 129.0528 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.134,"smiles":null,"spectrum_id":"CCMSLIB00017233441","spectrum_index":13979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.066,"smiles":null,"spectrum_id":"CCMSLIB00017233443","spectrum_index":13980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 67.065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.172,"smiles":null,"spectrum_id":"CCMSLIB00017233445","spectrum_index":13981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 74.0751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.213,"smiles":null,"spectrum_id":"CCMSLIB00017233447","spectrum_index":13982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 46.043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.301,"smiles":null,"spectrum_id":"CCMSLIB00017233450","spectrum_index":13983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 39.9927 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017233451","spectrum_index":13984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 110.1093 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017233453","spectrum_index":13985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 86.0004 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017233455","spectrum_index":13986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 162.032 Da; putative annotation: N/A; putative formula: C2H6N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.118,"smiles":null,"spectrum_id":"CCMSLIB00017233457","spectrum_index":13987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 23.0184 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.12,"smiles":null,"spectrum_id":"CCMSLIB00017233459","spectrum_index":13988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylpiperazine (delta mass: 72.1019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.225,"smiles":null,"spectrum_id":"CCMSLIB00017233461","spectrum_index":13989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-4-methylcoumarin (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.044,"smiles":null,"spectrum_id":"CCMSLIB00017233463","spectrum_index":13990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 272.0887 Da; putative annotation: N/A; putative formula: C6H17N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.238,"smiles":null,"spectrum_id":"CCMSLIB00017233466","spectrum_index":13991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 69.0562 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.148,"smiles":null,"spectrum_id":"CCMSLIB00017233467","spectrum_index":13992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 232.0671 Da; putative annotation: N/A; putative formula: C12H12N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.108,"smiles":null,"spectrum_id":"CCMSLIB00017233470","spectrum_index":13993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluorotryptamine (delta mass: 23.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.145,"smiles":null,"spectrum_id":"CCMSLIB00017233471","spectrum_index":13994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,6-Dimethyl-4-octyne-3,6-diol (delta mass: 144.0425 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.181,"smiles":null,"spectrum_id":"CCMSLIB00017233474","spectrum_index":13995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 331.2067 Da; putative annotation: N/A; putative formula: C20H30NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.382,"smiles":null,"spectrum_id":"CCMSLIB00017233475","spectrum_index":13996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 90.052 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.289,"smiles":null,"spectrum_id":"CCMSLIB00017233476","spectrum_index":13997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 97.055 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.25,"smiles":null,"spectrum_id":"CCMSLIB00017233479","spectrum_index":13998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 183.1527 Da; putative annotation: N/A; putative formula: C11H22NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.25,"smiles":null,"spectrum_id":"CCMSLIB00017233480","spectrum_index":13999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 625.4025 Da; putative annotation: N/A; putative formula: C35H55N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.463,"smiles":null,"spectrum_id":"CCMSLIB00017233483","spectrum_index":14000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-8-Methyl-6-nonenoic acid (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.185,"smiles":null,"spectrum_id":"CCMSLIB00017233484","spectrum_index":14001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 193.1415 Da; putative annotation: N/A; putative formula: C8H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.233,"smiles":null,"spectrum_id":"CCMSLIB00017233486","spectrum_index":14002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 260.2135 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.3,"smiles":null,"spectrum_id":"CCMSLIB00017233488","spectrum_index":14003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Octopamine from NIST14 (delta mass: 41.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.138,"smiles":null,"spectrum_id":"CCMSLIB00017233490","spectrum_index":14004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 303.0309 Da; putative annotation: N/A; putative formula: C13H9N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.091,"smiles":null,"spectrum_id":"CCMSLIB00017233492","spectrum_index":14005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 297.1572 Da; putative annotation: N/A; putative formula: C15H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.217,"smiles":null,"spectrum_id":"CCMSLIB00017233494","spectrum_index":14006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 140.0959 Da; putative annotation: N/A; putative formula: C7H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.198,"smiles":null,"spectrum_id":"CCMSLIB00017233497","spectrum_index":14007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyisophthalic acid (delta mass: 24.1081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.137,"smiles":null,"spectrum_id":"CCMSLIB00017233499","spectrum_index":14008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 198.0803 Da; putative annotation: N/A; putative formula: C5H10N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.192,"smiles":null,"spectrum_id":"CCMSLIB00017233501","spectrum_index":14009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Methyl-5.beta.-androstan-3.alpha.,17.beta.-diol (delta mass: 36.0365 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.3,"smiles":null,"spectrum_id":"CCMSLIB00017233503","spectrum_index":14010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 322.1196 Da; putative annotation: N/A; putative formula: C14H19N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.258,"smiles":null,"spectrum_id":"CCMSLIB00017233504","spectrum_index":14011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 88.0671 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.247,"smiles":null,"spectrum_id":"CCMSLIB00017233507","spectrum_index":14012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.258,"smiles":null,"spectrum_id":"CCMSLIB00017233509","spectrum_index":14013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 77.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.107,"smiles":null,"spectrum_id":"CCMSLIB00017233511","spectrum_index":14014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 163.0991 Da; putative annotation: N/A; putative formula: C4H14N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.228,"smiles":null,"spectrum_id":"CCMSLIB00017233513","spectrum_index":14015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin C (delta mass: 210.1632 Da; putative annotation: N/A; putative formula: C13H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.343,"smiles":null,"spectrum_id":"CCMSLIB00017233515","spectrum_index":14016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 8.9341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.0,"smiles":null,"spectrum_id":"CCMSLIB00017233517","spectrum_index":14017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 28.0861 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.198,"smiles":null,"spectrum_id":"CCMSLIB00017233520","spectrum_index":14018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 126.0763 Da; putative annotation: N/A; putative formula: C2H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.266,"smiles":null,"spectrum_id":"CCMSLIB00017233521","spectrum_index":14019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 126.1127 Da; putative annotation: N/A; putative formula: C7H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.215,"smiles":null,"spectrum_id":"CCMSLIB00017233524","spectrum_index":14020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 86.0404 Da; putative annotation: N/A; putative formula: C3H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.179,"smiles":null,"spectrum_id":"CCMSLIB00017233526","spectrum_index":14021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorobenzyl)piperidine (delta mass: 108.0625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.197,"smiles":null,"spectrum_id":"CCMSLIB00017233528","spectrum_index":14022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Amino-5,8-difluorospiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)picolinonitrile (delta mass: 241.0682 Da; putative annotation: N/A; putative formula: C6H3N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.211,"smiles":null,"spectrum_id":"CCMSLIB00017233530","spectrum_index":14023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 329.1839 Da; putative annotation: N/A; putative formula: C16H27NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.255,"smiles":null,"spectrum_id":"CCMSLIB00017233532","spectrum_index":14024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 357.2526 Da; putative annotation: N/A; putative formula: C20H31N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.323,"smiles":null,"spectrum_id":"CCMSLIB00017233535","spectrum_index":14025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 304.1156 Da; putative annotation: N/A; putative formula: C13H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.217,"smiles":null,"spectrum_id":"CCMSLIB00017233536","spectrum_index":14026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 77.9855 Da; putative annotation: N/A; putative formula: C3H-2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.17,"smiles":null,"spectrum_id":"CCMSLIB00017233539","spectrum_index":14027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 957.3165 Da; putative annotation: N/A; putative formula: C48H51N3O18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1138.39,"smiles":null,"spectrum_id":"CCMSLIB00017233540","spectrum_index":14028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 31.0424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.327,"smiles":null,"spectrum_id":"CCMSLIB00017233543","spectrum_index":14029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 47.0022 Da; putative annotation: N/A; putative formula: HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.057,"smiles":null,"spectrum_id":"CCMSLIB00017233544","spectrum_index":14030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 36.0189 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.116,"smiles":null,"spectrum_id":"CCMSLIB00017233547","spectrum_index":14031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.107,"smiles":null,"spectrum_id":"CCMSLIB00017233548","spectrum_index":14032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 23.016 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.155,"smiles":null,"spectrum_id":"CCMSLIB00017233551","spectrum_index":14033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 111.0543 Da; putative annotation: N/A; putative formula: C3H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.145,"smiles":null,"spectrum_id":"CCMSLIB00017233552","spectrum_index":14034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310669 Soyasapogenol B base + O-HexA-Pen-dHex (delta mass: 913.4651 Da; putative annotation: N/A; putative formula: C70H59N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1826.98,"smiles":null,"spectrum_id":"CCMSLIB00017233555","spectrum_index":14035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 221.9946 Da; putative annotation: N/A; putative formula: C5H6N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.09,"smiles":null,"spectrum_id":"CCMSLIB00017233556","spectrum_index":14036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 119.0944 Da; putative annotation: N/A; putative formula: CH9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.264,"smiles":null,"spectrum_id":"CCMSLIB00017233558","spectrum_index":14037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 985.4904 Da; putative annotation: N/A; putative formula: C42H71N11O14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1166.56,"smiles":null,"spectrum_id":"CCMSLIB00017233560","spectrum_index":14038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 954.4834 Da; putative annotation: N/A; putative formula: C47H66N14O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1135.55,"smiles":null,"spectrum_id":"CCMSLIB00017233562","spectrum_index":14039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 489.2207 Da; putative annotation: N/A; putative formula: C35H27N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.291,"smiles":null,"spectrum_id":"CCMSLIB00017233565","spectrum_index":14040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 516.2357 Da; putative annotation: N/A; putative formula: C26H24N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.348,"smiles":null,"spectrum_id":"CCMSLIB00017233566","spectrum_index":14041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 392.7349 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.826,"smiles":null,"spectrum_id":"CCMSLIB00017233568","spectrum_index":14042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 27.0465 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.216,"smiles":null,"spectrum_id":"CCMSLIB00017233570","spectrum_index":14043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 84.0605 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.11,"smiles":null,"spectrum_id":"CCMSLIB00017233572","spectrum_index":14044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 60.0932 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.17,"smiles":null,"spectrum_id":"CCMSLIB00017233574","spectrum_index":14045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2,3-dimethyl-1H-indole (delta mass: 194.0487 Da; putative annotation: N/A; putative formula: C5H6N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.106,"smiles":null,"spectrum_id":"CCMSLIB00017233576","spectrum_index":14046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 243.1265 Da; putative annotation: N/A; putative formula: C8H17N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.395,"smiles":null,"spectrum_id":"CCMSLIB00017233578","spectrum_index":14047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 50.0264 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.124,"smiles":null,"spectrum_id":"CCMSLIB00017233581","spectrum_index":14048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 622.1533 Da; putative annotation: N/A; putative formula: C28H30O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":861.245,"smiles":null,"spectrum_id":"CCMSLIB00017233583","spectrum_index":14049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 102.0562 Da; putative annotation: N/A; putative formula: C7H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.257,"smiles":null,"spectrum_id":"CCMSLIB00017233585","spectrum_index":14050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 665.2979 Da; putative annotation: N/A; putative formula: C34H44N5O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.339,"smiles":null,"spectrum_id":"CCMSLIB00017233586","spectrum_index":14051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lagochilin (delta mass: 120.0943 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.358,"smiles":null,"spectrum_id":"CCMSLIB00017233589","spectrum_index":14052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 122.1092 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.357,"smiles":null,"spectrum_id":"CCMSLIB00017233590","spectrum_index":14053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 372.2871 Da; putative annotation: N/A; putative formula: C21H40O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.509,"smiles":null,"spectrum_id":"CCMSLIB00017233591","spectrum_index":14054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthro[3,2-b]furan-9(1H)-one, 2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro-6,10a-dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl- (delta mass: 130.078 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.295,"smiles":null,"spectrum_id":"CCMSLIB00017233594","spectrum_index":14055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 47.0738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.311,"smiles":null,"spectrum_id":"CCMSLIB00017233595","spectrum_index":14056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-11.alpha.,16R-dihydroxy-17-cyclobutyl-5Z,13E-dien-1-oic acid (delta mass: 62.0514 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.315,"smiles":null,"spectrum_id":"CCMSLIB00017233597","spectrum_index":14057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-1-piperazinyl)acetic acid (delta mass: 61.0272 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.14,"smiles":null,"spectrum_id":"CCMSLIB00017233599","spectrum_index":14058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-1-(2-Hydroxyethyl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol (delta mass: 23.0157 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.248,"smiles":null,"spectrum_id":"CCMSLIB00017233600","spectrum_index":14059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.274,"smiles":null,"spectrum_id":"CCMSLIB00017233603","spectrum_index":14060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 38.0152 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":110.096,"smiles":null,"spectrum_id":"CCMSLIB00017233604","spectrum_index":14061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000619 Syringaldehyde|4-hydroxy-3,5-dimethoxybenzaldehyde (delta mass: 80.0257 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017233607","spectrum_index":14062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 193.0586 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.165,"smiles":null,"spectrum_id":"CCMSLIB00017233608","spectrum_index":14063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 170.1297 Da; putative annotation: N/A; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.236,"smiles":null,"spectrum_id":"CCMSLIB00017233611","spectrum_index":14064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 227.2644 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.46,"smiles":null,"spectrum_id":"CCMSLIB00017233612","spectrum_index":14065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 88.0157 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.055,"smiles":null,"spectrum_id":"CCMSLIB00017233615","spectrum_index":14066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ethyl 4-hydroxy-3-methyl-2-oxohydroquinoline-6-carboxylate CollisionEnergy:205060 (delta mass: 18.0471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.139,"smiles":null,"spectrum_id":"CCMSLIB00017233616","spectrum_index":14067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 91.0263 Da; putative annotation: N/A; putative formula: C2H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.269,"smiles":null,"spectrum_id":"CCMSLIB00017233618","spectrum_index":14068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:205060 (delta mass: 117.9717 Da; putative annotation: N/A; putative formula: C3H2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.016,"smiles":null,"spectrum_id":"CCMSLIB00017233620","spectrum_index":14069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 294.1106 Da; putative annotation: N/A; putative formula: C10H15N8OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.202,"smiles":null,"spectrum_id":"CCMSLIB00017233622","spectrum_index":14070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3r,5r,7r)-Adamantan-1-yl)piperidine (delta mass: 109.0412 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.247,"smiles":null,"spectrum_id":"CCMSLIB00017233623","spectrum_index":14071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 149.0685 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.16,"smiles":null,"spectrum_id":"CCMSLIB00017233626","spectrum_index":14072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11-Eicosatrienoic acid (delta mass: 78.0462 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.309,"smiles":null,"spectrum_id":"CCMSLIB00017233627","spectrum_index":14073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 64.0675 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.299,"smiles":null,"spectrum_id":"CCMSLIB00017233629","spectrum_index":14074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelenteramine (delta mass: 27.9944 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.123,"smiles":null,"spectrum_id":"CCMSLIB00017233631","spectrum_index":14075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 204.117 Da; putative annotation: N/A; putative formula: C12H17N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.24,"smiles":null,"spectrum_id":"CCMSLIB00017233633","spectrum_index":14076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 61.9528 Da; putative annotation: N/A; putative formula: H-1O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.075,"smiles":null,"spectrum_id":"CCMSLIB00017233635","spectrum_index":14077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid, methyl ester (delta mass: 257.1995 Da; putative annotation: N/A; putative formula: C14H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.458,"smiles":null,"spectrum_id":"CCMSLIB00017233638","spectrum_index":14078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 279.0566 Da; putative annotation: N/A; putative formula: C13H13NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.132,"smiles":null,"spectrum_id":"CCMSLIB00017233639","spectrum_index":14079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 244.219 Da; putative annotation: N/A; putative formula: C18H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.316,"smiles":null,"spectrum_id":"CCMSLIB00017233641","spectrum_index":14080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 31.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.289,"smiles":null,"spectrum_id":"CCMSLIB00017233643","spectrum_index":14081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 139.0303 Da; putative annotation: N/A; putative formula: C5H6N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.09,"smiles":null,"spectrum_id":"CCMSLIB00017233645","spectrum_index":14082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 293.9885 Da; putative annotation: N/A; putative formula: C10H6N4O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.049,"smiles":null,"spectrum_id":"CCMSLIB00017233647","spectrum_index":14083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 28.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.133,"smiles":null,"spectrum_id":"CCMSLIB00017233649","spectrum_index":14084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 107.0372 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.187,"smiles":null,"spectrum_id":"CCMSLIB00017233651","spectrum_index":14085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-(3-Hydroxy-2,2,5a-trimethyl-7-methylidenedecahydro-1-benzoxepin-6-yl)ethyl)-2,2,5a,7-tetramethyldecahydro-1-benzoxepine-3,4,6-triol (delta mass: 150.0833 Da; putative annotation: N/A; putative formula: C13H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.467,"smiles":null,"spectrum_id":"CCMSLIB00017233653","spectrum_index":14086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 118.0782 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.431,"smiles":null,"spectrum_id":"CCMSLIB00017233655","spectrum_index":14087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hexyl-4-pentynoic acid (delta mass: 88.0525 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.19,"smiles":null,"spectrum_id":"CCMSLIB00017233657","spectrum_index":14088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 104.0982 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.257,"smiles":null,"spectrum_id":"CCMSLIB00017233660","spectrum_index":14089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 24.0005 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.243,"smiles":null,"spectrum_id":"CCMSLIB00017233662","spectrum_index":14090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,13.alpha.,14.beta.,17.alpha.,20S,24E)-21-Hydroxy-3-oxolanosta-8,24-dien-26-oic acid (delta mass: 54.0349 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.382,"smiles":null,"spectrum_id":"CCMSLIB00017233664","spectrum_index":14091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 754.1311 Da; putative annotation: N/A; putative formula: C40H38N2OS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":964.28,"smiles":null,"spectrum_id":"CCMSLIB00017233667","spectrum_index":14092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 850.2581 Da; putative annotation: N/A; putative formula: C58H34N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1013.32,"smiles":null,"spectrum_id":"CCMSLIB00017233668","spectrum_index":14093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 109.0528 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.123,"smiles":null,"spectrum_id":"CCMSLIB00017233671","spectrum_index":14094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 17.0256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.127,"smiles":null,"spectrum_id":"CCMSLIB00017233672","spectrum_index":14095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-methyl-4-methylidene-7-(propan-2-yl)-1,2,3,3a,4,5,6,8a-octahydroazulen-1-ol (delta mass: 923.3256 Da; putative annotation: N/A; putative formula: C65H49NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1144.52,"smiles":null,"spectrum_id":"CCMSLIB00017233675","spectrum_index":14096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Thiophen-2-yl)piperazin-2-one (delta mass: 546.1269 Da; putative annotation: N/A; putative formula: C23H35N2O3PS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":729.186,"smiles":null,"spectrum_id":"CCMSLIB00017233677","spectrum_index":14097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 160.1183 Da; putative annotation: N/A; putative formula: C7H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.34,"smiles":null,"spectrum_id":"CCMSLIB00017233679","spectrum_index":14098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 150.0529 Da; putative annotation: N/A; putative formula: C5H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017233681","spectrum_index":14099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 577.2911 Da; putative annotation: N/A; putative formula: C32H43N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.507,"smiles":null,"spectrum_id":"CCMSLIB00017233683","spectrum_index":14100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[5-(2-Methylpropyl)-3,6-dioxopiperazin-2-yl]propanoic acid (delta mass: 240.1581 Da; putative annotation: N/A; putative formula: C11H20N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.292,"smiles":null,"spectrum_id":"CCMSLIB00017233686","spectrum_index":14101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 172.1316 Da; putative annotation: N/A; putative formula: C7H16N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.484,"smiles":null,"spectrum_id":"CCMSLIB00017233688","spectrum_index":14102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 209.9715 Da; putative annotation: N/A; putative formula: C8H3O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.063,"smiles":null,"spectrum_id":"CCMSLIB00017233690","spectrum_index":14103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 119.0795 Da; putative annotation: N/A; putative formula: C2H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.144,"smiles":null,"spectrum_id":"CCMSLIB00017233692","spectrum_index":14104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 56.0259 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.268,"smiles":null,"spectrum_id":"CCMSLIB00017233694","spectrum_index":14105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 33.0239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.13,"smiles":null,"spectrum_id":"CCMSLIB00017233696","spectrum_index":14106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 26.0348 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.142,"smiles":null,"spectrum_id":"CCMSLIB00017233698","spectrum_index":14107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4,6-dihydroxy-2,3-dimethylbenzoate (delta mass: 126.0671 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.148,"smiles":null,"spectrum_id":"CCMSLIB00017233699","spectrum_index":14108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 283.1428 Da; putative annotation: N/A; putative formula: C15H25NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.197,"smiles":null,"spectrum_id":"CCMSLIB00017233702","spectrum_index":14109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 204.1039 Da; putative annotation: N/A; putative formula: C7H16N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017233703","spectrum_index":14110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzoic acid (delta mass: 83.0733 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017233705","spectrum_index":14111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 40.0313 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.117,"smiles":null,"spectrum_id":"CCMSLIB00017233707","spectrum_index":14112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-1,2,4-Triazol-1-ylmethyl)benzoic acid (delta mass: 152.0941 Da; putative annotation: N/A; putative formula: C8H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.171,"smiles":null,"spectrum_id":"CCMSLIB00017233709","spectrum_index":14113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 44.0246 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.272,"smiles":null,"spectrum_id":"CCMSLIB00017233711","spectrum_index":14114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 198.0756 Da; putative annotation: N/A; putative formula: C7H10N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.349,"smiles":null,"spectrum_id":"CCMSLIB00017233712","spectrum_index":14115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole (delta mass: 132.0482 Da; putative annotation: N/A; putative formula: C9H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.155,"smiles":null,"spectrum_id":"CCMSLIB00017233714","spectrum_index":14116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 32.0148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.096,"smiles":null,"spectrum_id":"CCMSLIB00017233716","spectrum_index":14117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 70.0228 Da; putative annotation: N/A; putative formula: C4H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.057,"smiles":null,"spectrum_id":"CCMSLIB00017233717","spectrum_index":14118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 14.0513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.278,"smiles":null,"spectrum_id":"CCMSLIB00017233720","spectrum_index":14119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 47.9643 Da; putative annotation: N/A; putative formula: OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.03,"smiles":null,"spectrum_id":"CCMSLIB00017233721","spectrum_index":14120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 13.9791 Da; putative annotation: N/A; putative formula: H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.097,"smiles":null,"spectrum_id":"CCMSLIB00017233724","spectrum_index":14121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 346.0855 Da; putative annotation: N/A; putative formula: C22H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.209,"smiles":null,"spectrum_id":"CCMSLIB00017233725","spectrum_index":14122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 60.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.274,"smiles":null,"spectrum_id":"CCMSLIB00017233727","spectrum_index":14123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 103.0636 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.198,"smiles":null,"spectrum_id":"CCMSLIB00017233729","spectrum_index":14124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 536.2828 Da; putative annotation: N/A; putative formula: C38H36N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.38,"smiles":null,"spectrum_id":"CCMSLIB00017233730","spectrum_index":14125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 112.0677 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.415,"smiles":null,"spectrum_id":"CCMSLIB00017233733","spectrum_index":14126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 129.0427 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.213,"smiles":null,"spectrum_id":"CCMSLIB00017233734","spectrum_index":14127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 175.1568 Da; putative annotation: N/A; putative formula: C5H17N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.311,"smiles":null,"spectrum_id":"CCMSLIB00017233736","spectrum_index":14128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-O-((2E,4E)-9-Carboxy-8-hydroxy-2,7-dimethylnona-2,4-dienoyl)-.beta.-D-glucopyranose (delta mass: 325.116 Da; putative annotation: N/A; putative formula: C15H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.292,"smiles":null,"spectrum_id":"CCMSLIB00017233738","spectrum_index":14129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 395.1788 Da; putative annotation: N/A; putative formula: C29H21N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.312,"smiles":null,"spectrum_id":"CCMSLIB00017233741","spectrum_index":14130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxybenzene-1,2-dicarboxylic acid (delta mass: 100.0311 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.055,"smiles":null,"spectrum_id":"CCMSLIB00017233742","spectrum_index":14131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017233745","spectrum_index":14132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 46.002 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.108,"smiles":null,"spectrum_id":"CCMSLIB00017233746","spectrum_index":14133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 796.6391 Da; putative annotation: N/A; putative formula: C55H80N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":959.699,"smiles":null,"spectrum_id":"CCMSLIB00017233748","spectrum_index":14134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxyphenylacetic acid (delta mass: 108.0946 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.144,"smiles":null,"spectrum_id":"CCMSLIB00017233750","spectrum_index":14135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Piperidin-3-yl)methanesulfonamide (delta mass: 36.0451 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.13,"smiles":null,"spectrum_id":"CCMSLIB00017233752","spectrum_index":14136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 943.2972 Da; putative annotation: N/A; putative formula: C29H60N11O14P3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1136.37,"smiles":null,"spectrum_id":"CCMSLIB00017233753","spectrum_index":14137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 46.005 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.19,"smiles":null,"spectrum_id":"CCMSLIB00017233756","spectrum_index":14138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 33.0242 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.128,"smiles":null,"spectrum_id":"CCMSLIB00017233757","spectrum_index":14139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 114.0682 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017233759","spectrum_index":14140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 94.0794 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.322,"smiles":null,"spectrum_id":"CCMSLIB00017233761","spectrum_index":14141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 59.0259 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017233763","spectrum_index":14142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 854.2784 Da; putative annotation: N/A; putative formula: C46H46O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1073.38,"smiles":null,"spectrum_id":"CCMSLIB00017233765","spectrum_index":14143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 34.0536 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.182,"smiles":null,"spectrum_id":"CCMSLIB00017233767","spectrum_index":14144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 5.015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.117,"smiles":null,"spectrum_id":"CCMSLIB00017233769","spectrum_index":14145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 268.0949 Da; putative annotation: N/A; putative formula: C13H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.165,"smiles":null,"spectrum_id":"CCMSLIB00017233771","spectrum_index":14146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(1H-Indol-3-yl)vinyl]isoquinoline (delta mass: 183.211 Da; putative annotation: N/A; putative formula: C11H25N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.334,"smiles":null,"spectrum_id":"CCMSLIB00017233773","spectrum_index":14147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Populin (delta mass: 50.0192 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.158,"smiles":null,"spectrum_id":"CCMSLIB00017233775","spectrum_index":14148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 88.0157 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.113,"smiles":null,"spectrum_id":"CCMSLIB00017233777","spectrum_index":14149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (25S)-7-Dafachronic acid (delta mass: 122.1164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.437,"smiles":null,"spectrum_id":"CCMSLIB00017233778","spectrum_index":14150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentamethylene bisacetamide (delta mass: 159.0889 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.233,"smiles":null,"spectrum_id":"CCMSLIB00017233781","spectrum_index":14151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminohexanoic acid (delta mass: 41.037 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.139,"smiles":null,"spectrum_id":"CCMSLIB00017233782","spectrum_index":14152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 130.0882 Da; putative annotation: N/A; putative formula: C9H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.222,"smiles":null,"spectrum_id":"CCMSLIB00017233785","spectrum_index":14153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 31.0055 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.081,"smiles":null,"spectrum_id":"CCMSLIB00017233786","spectrum_index":14154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 697.9337 Da; putative annotation: N/A; putative formula: C14H23O22P5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.005,"smiles":null,"spectrum_id":"CCMSLIB00017233787","spectrum_index":14155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kirenol (delta mass: 72.0361 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.289,"smiles":null,"spectrum_id":"CCMSLIB00017233790","spectrum_index":14156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(14,15-Epoxyeicosatrienoyl)glycerol (delta mass: 64.0673 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.346,"smiles":null,"spectrum_id":"CCMSLIB00017233791","spectrum_index":14157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11,14-Eicosadienoic acid (delta mass: 167.0792 Da; putative annotation: N/A; putative formula: C2H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.358,"smiles":null,"spectrum_id":"CCMSLIB00017233794","spectrum_index":14158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 65.0477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.145,"smiles":null,"spectrum_id":"CCMSLIB00017233796","spectrum_index":14159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 184.1229 Da; putative annotation: N/A; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.162,"smiles":null,"spectrum_id":"CCMSLIB00017233798","spectrum_index":14160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 411.174 Da; putative annotation: N/A; putative formula: C14H17N15O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.249,"smiles":null,"spectrum_id":"CCMSLIB00017233800","spectrum_index":14161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 489.365 Da; putative annotation: N/A; putative formula: C23H43N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.571,"smiles":null,"spectrum_id":"CCMSLIB00017233802","spectrum_index":14162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 334.2357 Da; putative annotation: N/A; putative formula: C17H34O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.52,"smiles":null,"spectrum_id":"CCMSLIB00017233804","spectrum_index":14163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 669.4605 Da; putative annotation: N/A; putative formula: C40H63NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1020.71,"smiles":null,"spectrum_id":"CCMSLIB00017233806","spectrum_index":14164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 118.0415 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017233808","spectrum_index":14165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 117.0104 Da; putative annotation: N/A; putative formula: CH3N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.112,"smiles":null,"spectrum_id":"CCMSLIB00017233810","spectrum_index":14166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 164.0834 Da; putative annotation: N/A; putative formula: C10H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.17,"smiles":null,"spectrum_id":"CCMSLIB00017233812","spectrum_index":14167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 17.9299 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.99,"smiles":null,"spectrum_id":"CCMSLIB00017233814","spectrum_index":14168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 9.0004 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.102,"smiles":null,"spectrum_id":"CCMSLIB00017233815","spectrum_index":14169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-.beta.,2,5,5,8a-pentamethyl-3-oxo-, (8aS)- (delta mass: 168.1276 Da; putative annotation: N/A; putative formula: C9H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.37,"smiles":null,"spectrum_id":"CCMSLIB00017233818","spectrum_index":14170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 241.1323 Da; putative annotation: N/A; putative formula: C13H23NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.208,"smiles":null,"spectrum_id":"CCMSLIB00017233819","spectrum_index":14171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 173.1555 Da; putative annotation: N/A; putative formula: C13H19NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.242,"smiles":null,"spectrum_id":"CCMSLIB00017233822","spectrum_index":14172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8(9)-Epoxy-5Z,11Z,14Z,17Z-eicosatetraenoic acid (delta mass: 48.0354 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.262,"smiles":null,"spectrum_id":"CCMSLIB00017233823","spectrum_index":14173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 24.084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.165,"smiles":null,"spectrum_id":"CCMSLIB00017233826","spectrum_index":14174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 453.2584 Da; putative annotation: N/A; putative formula: C21H43NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.407,"smiles":null,"spectrum_id":"CCMSLIB00017233827","spectrum_index":14175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 60.0206 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.284,"smiles":null,"spectrum_id":"CCMSLIB00017233830","spectrum_index":14176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 393.2024 Da; putative annotation: N/A; putative formula: C19H23N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.299,"smiles":null,"spectrum_id":"CCMSLIB00017233831","spectrum_index":14177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 42.0042 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.064,"smiles":null,"spectrum_id":"CCMSLIB00017233833","spectrum_index":14178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.326,"smiles":null,"spectrum_id":"CCMSLIB00017233835","spectrum_index":14179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 1218.9523 Da; putative annotation: N/A; putative formula: C64H118N18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1357.04,"smiles":null,"spectrum_id":"CCMSLIB00017233838","spectrum_index":14180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Diethyl-1,3,4,9-tetrahydro-4-oxo-pyrano[3,4-b]indole-1-acetic acid methyl ester (delta mass: 151.0507 Da; putative annotation: N/A; putative formula: C3H10N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.205,"smiles":null,"spectrum_id":"CCMSLIB00017233839","spectrum_index":14181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 162.0533 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.134,"smiles":null,"spectrum_id":"CCMSLIB00017233842","spectrum_index":14182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopetasol (delta mass: 72.0206 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.19,"smiles":null,"spectrum_id":"CCMSLIB00017233843","spectrum_index":14183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 28.054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.109,"smiles":null,"spectrum_id":"CCMSLIB00017233845","spectrum_index":14184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 72.9828 Da; putative annotation: N/A; putative formula: N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.048,"smiles":null,"spectrum_id":"CCMSLIB00017233847","spectrum_index":14185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indolepropionic acid (delta mass: 18.993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.079,"smiles":null,"spectrum_id":"CCMSLIB00017233849","spectrum_index":14186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 87.1969 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.262,"smiles":null,"spectrum_id":"CCMSLIB00017233851","spectrum_index":14187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 86.019 Da; putative annotation: N/A; putative formula: C4H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.084,"smiles":null,"spectrum_id":"CCMSLIB00017233853","spectrum_index":14188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(R)-4-((3R,5R,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-6-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid\"\" (delta mass: 17.026 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.31,"smiles":null,"spectrum_id":"CCMSLIB00017233855","spectrum_index":14189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 41.051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.236,"smiles":null,"spectrum_id":"CCMSLIB00017233857","spectrum_index":14190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 71.1324 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.213,"smiles":null,"spectrum_id":"CCMSLIB00017233859","spectrum_index":14191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 783.3011 Da; putative annotation: N/A; putative formula: C43H49N3O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.377,"smiles":null,"spectrum_id":"CCMSLIB00017233861","spectrum_index":14192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(E)-octenoyl-L-carnitine (delta mass: 162.0529 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.254,"smiles":null,"spectrum_id":"CCMSLIB00017233863","spectrum_index":14193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Trp (delta mass: 186.0786 Da; putative annotation: Tryptophan; putative formula: C11H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.208,"smiles":null,"spectrum_id":"CCMSLIB00017233865","spectrum_index":14194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 144.088 Da; putative annotation: DL-5-Hydroxylysine; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.211,"smiles":null,"spectrum_id":"CCMSLIB00017233867","spectrum_index":14195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 324.1056 Da; putative annotation: Isomaltose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":991.335,"smiles":null,"spectrum_id":"CCMSLIB00017233869","spectrum_index":14196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 283.288 Da; putative annotation: SPHINGANINE; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.411,"smiles":null,"spectrum_id":"CCMSLIB00017233871","spectrum_index":14197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 310.2524 Da; putative annotation: Avocadene acetate; putative formula: C19H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.469,"smiles":null,"spectrum_id":"CCMSLIB00017233873","spectrum_index":14198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 150.0001 Da; putative annotation: 6-Thioxanthine; putative formula: C5H2N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.06,"smiles":null,"spectrum_id":"CCMSLIB00017233875","spectrum_index":14199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 280.2401 Da; putative annotation: 8-(3-Octyl-2-oxiranyl)octanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.519,"smiles":null,"spectrum_id":"CCMSLIB00017233876","spectrum_index":14200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 288.2093 Da; putative annotation: Oxandrolone; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.447,"smiles":null,"spectrum_id":"CCMSLIB00017233879","spectrum_index":14201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 178.0627 Da; putative annotation: 4',6'-Dimethoxy-2'-hydroxyacetophenone; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.143,"smiles":null,"spectrum_id":"CCMSLIB00017233881","spectrum_index":14202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-11-2-1 (delta mass: 302.225 Da; putative annotation: (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid; putative formula: C20H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.472,"smiles":null,"spectrum_id":"CCMSLIB00017233883","spectrum_index":14203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 212.1383 Da; putative annotation: 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.36,"smiles":null,"spectrum_id":"CCMSLIB00017233885","spectrum_index":14204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-ethenyl-1,4a,7-trimethyl-6-oxo-2,3,4,8,8a,9,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 302.2237 Da; putative annotation: (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid; putative formula: C20H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.435,"smiles":null,"spectrum_id":"CCMSLIB00017233887","spectrum_index":14205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decahydronaphthalene-2-carboxylic acid (delta mass: 94.078 Da; putative annotation: 1,2,3,6-Tetrahydrobenzylalcohol; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017233889","spectrum_index":14206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 198.1252 Da; putative annotation: Virginiaebutanolide C; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.388,"smiles":null,"spectrum_id":"CCMSLIB00017233891","spectrum_index":14207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 278.2606 Da; putative annotation: Phytomonic acid; putative formula: C19H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.524,"smiles":null,"spectrum_id":"CCMSLIB00017233894","spectrum_index":14208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 99.0684 Da; putative annotation: Spectral Match to valine from NIST14-note this is the rearranged loss of ammonia to form a proline see parent mass; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.139,"smiles":null,"spectrum_id":"CCMSLIB00017233895","spectrum_index":14209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 316.2398 Da; putative annotation: 5-Hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid, methyl ester; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.363,"smiles":null,"spectrum_id":"CCMSLIB00017233898","spectrum_index":14210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 296.2343 Da; putative annotation: 12,13-Dihydroxy-9Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.477,"smiles":null,"spectrum_id":"CCMSLIB00017233899","spectrum_index":14211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 550.4951 Da; putative annotation: 1,2-Dihexadecanoyl-sn-glycerol; putative formula: C35H66O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":845.722,"smiles":null,"spectrum_id":"CCMSLIB00017233902","spectrum_index":14212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 260.2141 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.404,"smiles":null,"spectrum_id":"CCMSLIB00017233903","spectrum_index":14213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 778.4508 Da; putative annotation: Hederoside F; putative formula: C42H66O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":959.521,"smiles":null,"spectrum_id":"CCMSLIB00017233905","spectrum_index":14214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 185.0687 Da; putative annotation: 5-Amino-1-phenyl-1H-1,2,3-triazole-4-carboxamide; putative formula: C9H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.149,"smiles":null,"spectrum_id":"CCMSLIB00017233907","spectrum_index":14215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C17:1 (delta mass: 254.2248 Da; putative annotation: DL-.beta.-Hydroxypalmitic acid; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.494,"smiles":null,"spectrum_id":"CCMSLIB00017233908","spectrum_index":14216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Pro (delta mass: 113.0848 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.24,"smiles":null,"spectrum_id":"CCMSLIB00017233911","spectrum_index":14217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 236.1418 Da; putative annotation: 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel-; putative formula: C14H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.228,"smiles":null,"spectrum_id":"CCMSLIB00017233912","spectrum_index":14218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 88.0525 Da; putative annotation: (S)-(-)-1,2,4-Butanetriol; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017233915","spectrum_index":14219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 358.2877 Da; putative annotation: Massbank:RP007201 Isolithocholic acid|(4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid; putative formula: C24H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.416,"smiles":null,"spectrum_id":"CCMSLIB00017233916","spectrum_index":14220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.086,"smiles":null,"spectrum_id":"CCMSLIB00017233919","spectrum_index":14221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 92.026 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017233920","spectrum_index":14222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-C10:0 (delta mass: 110.0389 Da; putative annotation: N/A; putative formula: C5H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.251,"smiles":null,"spectrum_id":"CCMSLIB00017233922","spectrum_index":14223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 99.0322 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.156,"smiles":null,"spectrum_id":"CCMSLIB00017233924","spectrum_index":14224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 141.0785 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.144,"smiles":null,"spectrum_id":"CCMSLIB00017233926","spectrum_index":14225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 46.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.232,"smiles":null,"spectrum_id":"CCMSLIB00017233929","spectrum_index":14226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 366.1163 Da; putative annotation: N/A; putative formula: C14H22O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.176,"smiles":null,"spectrum_id":"CCMSLIB00017233931","spectrum_index":14227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 405.3456 Da; putative annotation: N/A; putative formula: C23H43N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.416,"smiles":null,"spectrum_id":"CCMSLIB00017233933","spectrum_index":14228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[17.3.2.0<1,18>.0<4,17>.0<5,14>.0< 8,13>]tetracosan-10-ol CollisionEnergy:102040\"\" (delta mass: 122.0744 Da; putative annotation: N/A; putative formula: C8H10O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.463,"smiles":null,"spectrum_id":"CCMSLIB00017233935","spectrum_index":14229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 129.0357 Da; putative annotation: N/A; putative formula: C4H7N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.106,"smiles":null,"spectrum_id":"CCMSLIB00017233937","spectrum_index":14230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2,3-dihydrobenzoic acid (delta mass: 22.9897 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.06,"smiles":null,"spectrum_id":"CCMSLIB00017233939","spectrum_index":14231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 311.2478 Da; putative annotation: N/A; putative formula: C19H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.485,"smiles":null,"spectrum_id":"CCMSLIB00017233941","spectrum_index":14232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 135.0766 Da; putative annotation: N/A; putative formula: C2H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.142,"smiles":null,"spectrum_id":"CCMSLIB00017233943","spectrum_index":14233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 40.1042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.154,"smiles":null,"spectrum_id":"CCMSLIB00017233946","spectrum_index":14234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 131.0947 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.186,"smiles":null,"spectrum_id":"CCMSLIB00017233948","spectrum_index":14235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 219.0734 Da; putative annotation: N/A; putative formula: C12H15NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.112,"smiles":null,"spectrum_id":"CCMSLIB00017233950","spectrum_index":14236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: 6-beta-Hydroxycortisol|6beta-Hydroxycortisol|(6R,8S,9S,10R,11S,13S,14S,17R)-6,11,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one (delta mass: 17.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.275,"smiles":null,"spectrum_id":"CCMSLIB00017233953","spectrum_index":14237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 130.1115 Da; putative annotation: N/A; putative formula: C6H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.25,"smiles":null,"spectrum_id":"CCMSLIB00017233954","spectrum_index":14238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 320.3081 Da; putative annotation: N/A; putative formula: C22H40O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.405,"smiles":null,"spectrum_id":"CCMSLIB00017233956","spectrum_index":14239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 67.0192 Da; putative annotation: N/A; putative formula: C2HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.257,"smiles":null,"spectrum_id":"CCMSLIB00017233958","spectrum_index":14240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Aminodecanoic acid (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.227,"smiles":null,"spectrum_id":"CCMSLIB00017233959","spectrum_index":14241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 236.0216 Da; putative annotation: N/A; putative formula: C5H8N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.082,"smiles":null,"spectrum_id":"CCMSLIB00017233962","spectrum_index":14242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 147.0912 Da; putative annotation: N/A; putative formula: C7H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.365,"smiles":null,"spectrum_id":"CCMSLIB00017233963","spectrum_index":14243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 70.0404 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.137,"smiles":null,"spectrum_id":"CCMSLIB00017233964","spectrum_index":14244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 390.9799 Da; putative annotation: N/A; putative formula: C13H17N3O-1S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.04,"smiles":null,"spectrum_id":"CCMSLIB00017233967","spectrum_index":14245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 64.0161 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.076,"smiles":null,"spectrum_id":"CCMSLIB00017233968","spectrum_index":14246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 208.1057 Da; putative annotation: N/A; putative formula: C7H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.327,"smiles":null,"spectrum_id":"CCMSLIB00017233971","spectrum_index":14247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 28.0307 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.143,"smiles":null,"spectrum_id":"CCMSLIB00017233972","spectrum_index":14248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE - 70.0 eV (delta mass: 94.0444 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.089,"smiles":null,"spectrum_id":"CCMSLIB00017233974","spectrum_index":14249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 54.0483 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.259,"smiles":null,"spectrum_id":"CCMSLIB00017233976","spectrum_index":14250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 84.0575 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.206,"smiles":null,"spectrum_id":"CCMSLIB00017233978","spectrum_index":14251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopentan-2-ol (delta mass: 27.943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.05,"smiles":null,"spectrum_id":"CCMSLIB00017233980","spectrum_index":14252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 15.9951 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.271,"smiles":null,"spectrum_id":"CCMSLIB00017233982","spectrum_index":14253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 223.9806 Da; putative annotation: N/A; putative formula: C5H4O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.104,"smiles":null,"spectrum_id":"CCMSLIB00017233983","spectrum_index":14254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 120.0936 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017233986","spectrum_index":14255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 88.0668 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.325,"smiles":null,"spectrum_id":"CCMSLIB00017233987","spectrum_index":14256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 58.9895 Da; putative annotation: N/A; putative formula: CH2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.269,"smiles":null,"spectrum_id":"CCMSLIB00017233988","spectrum_index":14257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-sitosterol (delta mass: 168.1114 Da; putative annotation: N/A; putative formula: C6H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.505,"smiles":null,"spectrum_id":"CCMSLIB00017233991","spectrum_index":14258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 112.0681 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.295,"smiles":null,"spectrum_id":"CCMSLIB00017233992","spectrum_index":14259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2 ethanolamide (delta mass: 48.0362 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.311,"smiles":null,"spectrum_id":"CCMSLIB00017233994","spectrum_index":14260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-phenylpent-1-yn-3-ol (delta mass: 323.1733 Da; putative annotation: N/A; putative formula: C17H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.285,"smiles":null,"spectrum_id":"CCMSLIB00017233996","spectrum_index":14261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(R)-Hydroxyprostaglandin A2 (delta mass: 36.0002 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.217,"smiles":null,"spectrum_id":"CCMSLIB00017233998","spectrum_index":14262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 100.0525 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.139,"smiles":null,"spectrum_id":"CCMSLIB00017234000","spectrum_index":14263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 461.2914 Da; putative annotation: N/A; putative formula: C23H44NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.576,"smiles":null,"spectrum_id":"CCMSLIB00017234002","spectrum_index":14264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hex-3-ynoic acid (delta mass: 103.0632 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017234005","spectrum_index":14265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 24.2545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.5,"smiles":null,"spectrum_id":"CCMSLIB00017234007","spectrum_index":14266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 40.0663 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.11,"smiles":null,"spectrum_id":"CCMSLIB00017234008","spectrum_index":14267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorobenzyl)piperidine (delta mass: 8.9931 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.127,"smiles":null,"spectrum_id":"CCMSLIB00017234011","spectrum_index":14268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 100.0677 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.315,"smiles":null,"spectrum_id":"CCMSLIB00017234012","spectrum_index":14269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 142.0862 Da; putative annotation: N/A; putative formula: C5H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.193,"smiles":null,"spectrum_id":"CCMSLIB00017234015","spectrum_index":14270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 136.1247 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.393,"smiles":null,"spectrum_id":"CCMSLIB00017234016","spectrum_index":14271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,19-Cyclolanost-25-ene-3,24-diol (delta mass: 142.116 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.504,"smiles":null,"spectrum_id":"CCMSLIB00017234018","spectrum_index":14272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 344.1108 Da; putative annotation: N/A; putative formula: C15H20O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.191,"smiles":null,"spectrum_id":"CCMSLIB00017234020","spectrum_index":14273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 104.0272 Da; putative annotation: N/A; putative formula: H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.385,"smiles":null,"spectrum_id":"CCMSLIB00017234021","spectrum_index":14274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 14.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017234024","spectrum_index":14275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 37.9636 Da; putative annotation: N/A; putative formula: C2H-2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.028,"smiles":null,"spectrum_id":"CCMSLIB00017234025","spectrum_index":14276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-1-Azabicyclo[2.2.2]octan-3-amine (delta mass: 226.9885 Da; putative annotation: N/A; putative formula: C8H5NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.112,"smiles":null,"spectrum_id":"CCMSLIB00017234026","spectrum_index":14277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 803.394 Da; putative annotation: N/A; putative formula: C38H61NO17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":966.454,"smiles":null,"spectrum_id":"CCMSLIB00017234029","spectrum_index":14278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 107.0576 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.289,"smiles":null,"spectrum_id":"CCMSLIB00017234031","spectrum_index":14279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 52.0311 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.243,"smiles":null,"spectrum_id":"CCMSLIB00017234033","spectrum_index":14280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitol (delta mass: 255.1099 Da; putative annotation: N/A; putative formula: C9H9N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.196,"smiles":null,"spectrum_id":"CCMSLIB00017234036","spectrum_index":14281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 36.0188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.106,"smiles":null,"spectrum_id":"CCMSLIB00017234037","spectrum_index":14282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arachidonoyl p-nitroaniline (delta mass: 82.0866 Da; putative annotation: N/A; putative formula: C5H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.366,"smiles":null,"spectrum_id":"CCMSLIB00017234040","spectrum_index":14283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 43.985 Da; putative annotation: N/A; putative formula: N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.139,"smiles":null,"spectrum_id":"CCMSLIB00017234041","spectrum_index":14284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Pregnen-3.beta.-ol-20-one (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017234044","spectrum_index":14285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE - 70.0 eV (delta mass: 110.0219 Da; putative annotation: N/A; putative formula: C3H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.066,"smiles":null,"spectrum_id":"CCMSLIB00017234045","spectrum_index":14286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Liensinine Diperchlorate (delta mass: 63.2321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.5,"smiles":null,"spectrum_id":"CCMSLIB00017234047","spectrum_index":14287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperazinyl)nicotinamide (delta mass: 73.0518 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.176,"smiles":null,"spectrum_id":"CCMSLIB00017234049","spectrum_index":14288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 160.0277 Da; putative annotation: N/A; putative formula: C8H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.088,"smiles":null,"spectrum_id":"CCMSLIB00017234052","spectrum_index":14289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-6,10,14,18-tetraene-2,3,22,23-tetrol (delta mass: 126.1031 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.513,"smiles":null,"spectrum_id":"CCMSLIB00017234053","spectrum_index":14290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(6-Aminohexanamido)hexanoic acid (delta mass: 213.1363 Da; putative annotation: N/A; putative formula: C11H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.322,"smiles":null,"spectrum_id":"CCMSLIB00017234056","spectrum_index":14291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alphitolic acid (delta mass: 104.0269 Da; putative annotation: N/A; putative formula: H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.389,"smiles":null,"spectrum_id":"CCMSLIB00017234057","spectrum_index":14292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 258.9707 Da; putative annotation: N/A; putative formula: C8H6NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.088,"smiles":null,"spectrum_id":"CCMSLIB00017234060","spectrum_index":14293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 88.0522 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.102,"smiles":null,"spectrum_id":"CCMSLIB00017234061","spectrum_index":14294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Chloro-L-tyrosine (delta mass: 57.0209 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.063,"smiles":null,"spectrum_id":"CCMSLIB00017234062","spectrum_index":14295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thiamine thiozole (delta mass: 322.1849 Da; putative annotation: N/A; putative formula: C22H27P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.233,"smiles":null,"spectrum_id":"CCMSLIB00017234065","spectrum_index":14296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[(E)-2-Carboxyethenyl]-2-(3,4-dihydroxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid (delta mass: 375.0962 Da; putative annotation: N/A; putative formula: C11H17N7O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":734.172,"smiles":null,"spectrum_id":"CCMSLIB00017234067","spectrum_index":14297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sodium taurodeoxycholate CollisionEnergy:102040 (delta mass: 330.2398 Da; putative annotation: N/A; putative formula: C15H26N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.544,"smiles":null,"spectrum_id":"CCMSLIB00017234069","spectrum_index":14298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-((Diethoxyphosphoryl)methyl)benzoic acid (delta mass: 72.0455 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.134,"smiles":null,"spectrum_id":"CCMSLIB00017234072","spectrum_index":14299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 204.1756 Da; putative annotation: N/A; putative formula: C12H20N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.24,"smiles":null,"spectrum_id":"CCMSLIB00017234073","spectrum_index":14300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380144-01_C20H28O3_(8E)-14-Hydroxy-5,9,12,13-tetramethyl-16-methylene-4-oxatricyclo[10.3.1.0~3,5~]hexadeca-1(15),8-dien-2-one (delta mass: 137.066 Da; putative annotation: N/A; putative formula: C8H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.277,"smiles":null,"spectrum_id":"CCMSLIB00017234076","spectrum_index":14301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 200.1534 Da; putative annotation: N/A; putative formula: C10H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.212,"smiles":null,"spectrum_id":"CCMSLIB00017234078","spectrum_index":14302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 129.0435 Da; putative annotation: N/A; putative formula: C6H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.145,"smiles":null,"spectrum_id":"CCMSLIB00017234080","spectrum_index":14303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510502 Tyramine|4-(2-aminoethyl)phenol (delta mass: 176.9236 Da; putative annotation: N/A; putative formula: C4H3NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.015,"smiles":null,"spectrum_id":"CCMSLIB00017234082","spectrum_index":14304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 167.1157 Da; putative annotation: N/A; putative formula: C7H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.17,"smiles":null,"spectrum_id":"CCMSLIB00017234084","spectrum_index":14305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-CARBOXYBENZALDEHYDE (delta mass: 76.031 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.07,"smiles":null,"spectrum_id":"CCMSLIB00017234087","spectrum_index":14306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 430.3425 Da; putative annotation: N/A; putative formula: C24H42N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.622,"smiles":null,"spectrum_id":"CCMSLIB00017234088","spectrum_index":14307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 535.507 Da; putative annotation: N/A; putative formula: C33H65N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.555,"smiles":null,"spectrum_id":"CCMSLIB00017234091","spectrum_index":14308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYBENZOATE (delta mass: 94.0392 Da; putative annotation: N/A; putative formula: C2H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.078,"smiles":null,"spectrum_id":"CCMSLIB00017234092","spectrum_index":14309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 226.193 Da; putative annotation: N/A; putative formula: C14H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.327,"smiles":null,"spectrum_id":"CCMSLIB00017234093","spectrum_index":14310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 315.2787 Da; putative annotation: N/A; putative formula: C19H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.526,"smiles":null,"spectrum_id":"CCMSLIB00017234096","spectrum_index":14311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 101.0472 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.151,"smiles":null,"spectrum_id":"CCMSLIB00017234097","spectrum_index":14312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxycodone (delta mass: 114.1089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.248,"smiles":null,"spectrum_id":"CCMSLIB00017234100","spectrum_index":14313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026502 5?-CHOLANIC ACID-3?_ 12?-DIOL-7-ONE|7-Ketodeoxycholic acid|(4R)-4-[(3R,5S,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]ph (delta mass: 324.107 Da; putative annotation: N/A; putative formula: C13H16N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.386,"smiles":null,"spectrum_id":"CCMSLIB00017234102","spectrum_index":14314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 64.0165 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.228,"smiles":null,"spectrum_id":"CCMSLIB00017234104","spectrum_index":14315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl morpholine-2-carboxylate (delta mass: 67.042 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.139,"smiles":null,"spectrum_id":"CCMSLIB00017234106","spectrum_index":14316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 145.0732 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.175,"smiles":null,"spectrum_id":"CCMSLIB00017234108","spectrum_index":14317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 35.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.274,"smiles":null,"spectrum_id":"CCMSLIB00017234110","spectrum_index":14318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 45.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.316,"smiles":null,"spectrum_id":"CCMSLIB00017234112","spectrum_index":14319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.055,"smiles":null,"spectrum_id":"CCMSLIB00017234114","spectrum_index":14320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maresin 1 (delta mass: 38.0153 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.253,"smiles":null,"spectrum_id":"CCMSLIB00017234116","spectrum_index":14321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 936.2956 Da; putative annotation: N/A; putative formula: C51H55O11P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1099.36,"smiles":null,"spectrum_id":"CCMSLIB00017234118","spectrum_index":14322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxyculmorin (delta mass: 191.1745 Da; putative annotation: N/A; putative formula: C3H17N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.37,"smiles":null,"spectrum_id":"CCMSLIB00017234120","spectrum_index":14323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 23.9629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.049,"smiles":null,"spectrum_id":"CCMSLIB00017234122","spectrum_index":14324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methoxycarbonyl)but-3-enoic acid (delta mass: 56.063 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.113,"smiles":null,"spectrum_id":"CCMSLIB00017234124","spectrum_index":14325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 241.1327 Da; putative annotation: N/A; putative formula: C13H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.214,"smiles":null,"spectrum_id":"CCMSLIB00017234126","spectrum_index":14326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 185.08 Da; putative annotation: N/A; putative formula: C7H11N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.128,"smiles":null,"spectrum_id":"CCMSLIB00017234128","spectrum_index":14327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 120.0583 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.109,"smiles":null,"spectrum_id":"CCMSLIB00017234130","spectrum_index":14328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 61.0163 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.119,"smiles":null,"spectrum_id":"CCMSLIB00017234132","spectrum_index":14329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Norepiandrosterone (delta mass: 90.0475 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.264,"smiles":null,"spectrum_id":"CCMSLIB00017234134","spectrum_index":14330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 70.0412 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.164,"smiles":null,"spectrum_id":"CCMSLIB00017234136","spectrum_index":14331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 208.1828 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.459,"smiles":null,"spectrum_id":"CCMSLIB00017234138","spectrum_index":14332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 648.2195 Da; putative annotation: N/A; putative formula: C40H32N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.306,"smiles":null,"spectrum_id":"CCMSLIB00017234140","spectrum_index":14333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 120.0917 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.329,"smiles":null,"spectrum_id":"CCMSLIB00017234142","spectrum_index":14334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Eicosenoic acid (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.321,"smiles":null,"spectrum_id":"CCMSLIB00017234144","spectrum_index":14335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 204.1511 Da; putative annotation: N/A; putative formula: C14H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.327,"smiles":null,"spectrum_id":"CCMSLIB00017234146","spectrum_index":14336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin E (delta mass: 32.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.216,"smiles":null,"spectrum_id":"CCMSLIB00017234148","spectrum_index":14337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 240.1209 Da; putative annotation: N/A; putative formula: C12H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.202,"smiles":null,"spectrum_id":"CCMSLIB00017234150","spectrum_index":14338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Hexadecanoyl-sn-glycerol from NIST14 (delta mass: 401.2704 Da; putative annotation: N/A; putative formula: C20H39N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.555,"smiles":null,"spectrum_id":"CCMSLIB00017234151","spectrum_index":14339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 261.4137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.5,"smiles":null,"spectrum_id":"CCMSLIB00017234154","spectrum_index":14340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 41.0608 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.126,"smiles":null,"spectrum_id":"CCMSLIB00017234155","spectrum_index":14341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 259.1215 Da; putative annotation: N/A; putative formula: C8H17N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.218,"smiles":null,"spectrum_id":"CCMSLIB00017234158","spectrum_index":14342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 85.0893 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.192,"smiles":null,"spectrum_id":"CCMSLIB00017234159","spectrum_index":14343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 285.169 Da; putative annotation: N/A; putative formula: C13H23N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.25,"smiles":null,"spectrum_id":"CCMSLIB00017234162","spectrum_index":14344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decanoyl-L-carnitine (delta mass: 122.0373 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.285,"smiles":null,"spectrum_id":"CCMSLIB00017234163","spectrum_index":14345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 58.0418 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.107,"smiles":null,"spectrum_id":"CCMSLIB00017234166","spectrum_index":14346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 101.0842 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017234167","spectrum_index":14347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 330.2357 Da; putative annotation: N/A; putative formula: C25H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.385,"smiles":null,"spectrum_id":"CCMSLIB00017234169","spectrum_index":14348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lauryldiethanolamine (delta mass: 24.7832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.057,"smiles":null,"spectrum_id":"CCMSLIB00017234171","spectrum_index":14349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-undecylpiperidine (delta mass: 58.9892 Da; putative annotation: N/A; putative formula: CH2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.273,"smiles":null,"spectrum_id":"CCMSLIB00017234173","spectrum_index":14350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 120.0944 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.608,"smiles":null,"spectrum_id":"CCMSLIB00017234175","spectrum_index":14351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 11.5039 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.58,"smiles":null,"spectrum_id":"CCMSLIB00017234176","spectrum_index":14352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000102 5-hydroxyculmorin|(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol (delta mass: 209.1054 Da; putative annotation: N/A; putative formula: C11H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.301,"smiles":null,"spectrum_id":"CCMSLIB00017234179","spectrum_index":14353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 95.0718 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.195,"smiles":null,"spectrum_id":"CCMSLIB00017234180","spectrum_index":14354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 191.0883 Da; putative annotation: N/A; putative formula: C10H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.129,"smiles":null,"spectrum_id":"CCMSLIB00017234182","spectrum_index":14355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 415.1101 Da; putative annotation: N/A; putative formula: C22H17N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.207,"smiles":null,"spectrum_id":"CCMSLIB00017234184","spectrum_index":14356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 63.0705 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.287,"smiles":null,"spectrum_id":"CCMSLIB00017234186","spectrum_index":14357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 156.1335 Da; putative annotation: N/A; putative formula: C10H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.412,"smiles":null,"spectrum_id":"CCMSLIB00017234188","spectrum_index":14358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 70.0056 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.113,"smiles":null,"spectrum_id":"CCMSLIB00017234190","spectrum_index":14359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydro-15-deoxy-.DELTA.12,14-prostaglandin J2 (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.222,"smiles":null,"spectrum_id":"CCMSLIB00017234192","spectrum_index":14360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 56.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.129,"smiles":null,"spectrum_id":"CCMSLIB00017234194","spectrum_index":14361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 329.2568 Da; putative annotation: N/A; putative formula: C18H35NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.354,"smiles":null,"spectrum_id":"CCMSLIB00017234196","spectrum_index":14362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 212.0688 Da; putative annotation: N/A; putative formula: C10H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.123,"smiles":null,"spectrum_id":"CCMSLIB00017234199","spectrum_index":14363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 140.0112 Da; putative annotation: N/A; putative formula: C6H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.144,"smiles":null,"spectrum_id":"CCMSLIB00017234200","spectrum_index":14364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Lys (delta mass: 186.0806 Da; putative annotation: N/A; putative formula: C9H15O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.262,"smiles":null,"spectrum_id":"CCMSLIB00017234202","spectrum_index":14365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 28.0315 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017234204","spectrum_index":14366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-pentyl- (delta mass: 30.0099 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.143,"smiles":null,"spectrum_id":"CCMSLIB00017234207","spectrum_index":14367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 94.0055 Da; putative annotation: N/A; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.107,"smiles":null,"spectrum_id":"CCMSLIB00017234209","spectrum_index":14368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 217.0692 Da; putative annotation: N/A; putative formula: C9H16NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.11,"smiles":null,"spectrum_id":"CCMSLIB00017234211","spectrum_index":14369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 35.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.316,"smiles":null,"spectrum_id":"CCMSLIB00017234213","spectrum_index":14370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017234214","spectrum_index":14371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 81.0252 Da; putative annotation: N/A; putative formula: C4H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.08,"smiles":null,"spectrum_id":"CCMSLIB00017234217","spectrum_index":14372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Phe from NIST14 (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.202,"smiles":null,"spectrum_id":"CCMSLIB00017234218","spectrum_index":14373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 27.0315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.154,"smiles":null,"spectrum_id":"CCMSLIB00017234220","spectrum_index":14374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 135.0662 Da; putative annotation: N/A; putative formula: C4H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.121,"smiles":null,"spectrum_id":"CCMSLIB00017234222","spectrum_index":14375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 88.061 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.179,"smiles":null,"spectrum_id":"CCMSLIB00017234224","spectrum_index":14376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 138.0319 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.092,"smiles":null,"spectrum_id":"CCMSLIB00017234226","spectrum_index":14377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 90.0316 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017234228","spectrum_index":14378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 559.146 Da; putative annotation: N/A; putative formula: C27H25N7O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.285,"smiles":null,"spectrum_id":"CCMSLIB00017234230","spectrum_index":14379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,8Z,14Z-Eicosatrienoic acid (delta mass: 74.0549 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.318,"smiles":null,"spectrum_id":"CCMSLIB00017234231","spectrum_index":14380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 202.0964 Da; putative annotation: N/A; putative formula: C9H18N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.203,"smiles":null,"spectrum_id":"CCMSLIB00017234234","spectrum_index":14381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 314.2099 Da; putative annotation: N/A; putative formula: C18H34S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.286,"smiles":null,"spectrum_id":"CCMSLIB00017234236","spectrum_index":14382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 479.2361 Da; putative annotation: N/A; putative formula: C34H29N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.312,"smiles":null,"spectrum_id":"CCMSLIB00017234238","spectrum_index":14383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 27.987 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.136,"smiles":null,"spectrum_id":"CCMSLIB00017234239","spectrum_index":14384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 40.9688 Da; putative annotation: N/A; putative formula: C16H23N7O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.023,"smiles":null,"spectrum_id":"CCMSLIB00017234242","spectrum_index":14385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 103.7148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.786,"smiles":null,"spectrum_id":"CCMSLIB00017234243","spectrum_index":14386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 146.0731 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.144,"smiles":null,"spectrum_id":"CCMSLIB00017234246","spectrum_index":14387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 88.031 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.18,"smiles":null,"spectrum_id":"CCMSLIB00017234247","spectrum_index":14388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 236.1381 Da; putative annotation: N/A; putative formula: C10H16N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.277,"smiles":null,"spectrum_id":"CCMSLIB00017234250","spectrum_index":14389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 165.0788 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.139,"smiles":null,"spectrum_id":"CCMSLIB00017234251","spectrum_index":14390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 27.0763 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.158,"smiles":null,"spectrum_id":"CCMSLIB00017234253","spectrum_index":14391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 62.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.233,"smiles":null,"spectrum_id":"CCMSLIB00017234255","spectrum_index":14392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 730.3286 Da; putative annotation: N/A; putative formula: C33H46N8O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":952.426,"smiles":null,"spectrum_id":"CCMSLIB00017234257","spectrum_index":14393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.227,"smiles":null,"spectrum_id":"CCMSLIB00017234259","spectrum_index":14394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 324.1059 Da; putative annotation: N/A; putative formula: C17H18N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.39,"smiles":null,"spectrum_id":"CCMSLIB00017234261","spectrum_index":14395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 50.0485 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.198,"smiles":null,"spectrum_id":"CCMSLIB00017234263","spectrum_index":14396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 116.0841 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.16,"smiles":null,"spectrum_id":"CCMSLIB00017234265","spectrum_index":14397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 281.0691 Da; putative annotation: N/A; putative formula: C9H19N3OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.348,"smiles":null,"spectrum_id":"CCMSLIB00017234267","spectrum_index":14398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 238.1573 Da; putative annotation: N/A; putative formula: C14H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.194,"smiles":null,"spectrum_id":"CCMSLIB00017234269","spectrum_index":14399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-Gentiobiose (delta mass: 467.338 Da; putative annotation: N/A; putative formula: C26H41N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.461,"smiles":null,"spectrum_id":"CCMSLIB00017234271","spectrum_index":14400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017234273","spectrum_index":14401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3S)-3-Hydroxyleucine (delta mass: 182.1305 Da; putative annotation: N/A; putative formula: C11H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.227,"smiles":null,"spectrum_id":"CCMSLIB00017234275","spectrum_index":14402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 72.0191 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.116,"smiles":null,"spectrum_id":"CCMSLIB00017234277","spectrum_index":14403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylcyclohexanol (delta mass: 71.0732 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.201,"smiles":null,"spectrum_id":"CCMSLIB00017234279","spectrum_index":14404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Deoxyprostaglandin E1 (delta mass: 118.0793 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.332,"smiles":null,"spectrum_id":"CCMSLIB00017234281","spectrum_index":14405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Goshonoside F5 (delta mass: 85.0945 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.458,"smiles":null,"spectrum_id":"CCMSLIB00017234283","spectrum_index":14406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spirodionic acid (delta mass: 179.0792 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.223,"smiles":null,"spectrum_id":"CCMSLIB00017234285","spectrum_index":14407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 147.0536 Da; putative annotation: N/A; putative formula: C6H13NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.165,"smiles":null,"spectrum_id":"CCMSLIB00017234287","spectrum_index":14408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 246.1494 Da; putative annotation: N/A; putative formula: C11H23N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.288,"smiles":null,"spectrum_id":"CCMSLIB00017234289","spectrum_index":14409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 174.125 Da; putative annotation: N/A; putative formula: C9H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.248,"smiles":null,"spectrum_id":"CCMSLIB00017234292","spectrum_index":14410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z-octadecadienoic acid (delta mass: 55.0031 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.23,"smiles":null,"spectrum_id":"CCMSLIB00017234294","spectrum_index":14411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 44.0622 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.101,"smiles":null,"spectrum_id":"CCMSLIB00017234296","spectrum_index":14412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde - 40.0 eV (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017234297","spectrum_index":14413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butyl 4-hydroxybenzoate (delta mass: 82.0416 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017234300","spectrum_index":14414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 54.047 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017234301","spectrum_index":14415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 128.0473 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.107,"smiles":null,"spectrum_id":"CCMSLIB00017234304","spectrum_index":14416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 210.1347 Da; putative annotation: N/A; putative formula: C7H14N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.269,"smiles":null,"spectrum_id":"CCMSLIB00017234305","spectrum_index":14417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 357.2159 Da; putative annotation: N/A; putative formula: C19H35NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.287,"smiles":null,"spectrum_id":"CCMSLIB00017234308","spectrum_index":14418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 381.2514 Da; putative annotation: N/A; putative formula: C21H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.322,"smiles":null,"spectrum_id":"CCMSLIB00017234309","spectrum_index":14419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,19-Cyclolanost-25-ene-3,24-diol (delta mass: 254.1389 Da; putative annotation: N/A; putative formula: C12H14N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.527,"smiles":null,"spectrum_id":"CCMSLIB00017234312","spectrum_index":14420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 727.4505 Da; putative annotation: N/A; putative formula: C33H70N5O6PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.511,"smiles":null,"spectrum_id":"CCMSLIB00017234313","spectrum_index":14421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 196.1097 Da; putative annotation: N/A; putative formula: C11H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.19,"smiles":null,"spectrum_id":"CCMSLIB00017234314","spectrum_index":14422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 104.0095 Da; putative annotation: N/A; putative formula: C7H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.241,"smiles":null,"spectrum_id":"CCMSLIB00017234317","spectrum_index":14423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-[(Z)-oct-2-enyl]pentanedioic acid (delta mass: 48.0358 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.19,"smiles":null,"spectrum_id":"CCMSLIB00017234319","spectrum_index":14424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9H-Xanthene-4-acetic acid, 5,6-dimethyl-9-oxo- (delta mass: 88.015 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.112,"smiles":null,"spectrum_id":"CCMSLIB00017234321","spectrum_index":14425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Salicylic acid (delta mass: 52.0312 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.07,"smiles":null,"spectrum_id":"CCMSLIB00017234323","spectrum_index":14426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 265.1232 Da; putative annotation: N/A; putative formula: C14H20NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.209,"smiles":null,"spectrum_id":"CCMSLIB00017234326","spectrum_index":14427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 273.2689 Da; putative annotation: N/A; putative formula: C12H31N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.48,"smiles":null,"spectrum_id":"CCMSLIB00017234328","spectrum_index":14428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.123,"smiles":null,"spectrum_id":"CCMSLIB00017234329","spectrum_index":14429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyclopropyl-1H-imidazol-2-amine (delta mass: 39.0109 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.098,"smiles":null,"spectrum_id":"CCMSLIB00017234332","spectrum_index":14430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 581.357 Da; putative annotation: N/A; putative formula: C42H48NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.428,"smiles":null,"spectrum_id":"CCMSLIB00017234333","spectrum_index":14431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 911.4908 Da; putative annotation: N/A; putative formula: C49H77N5O3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1194.59,"smiles":null,"spectrum_id":"CCMSLIB00017234336","spectrum_index":14432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 763.4516 Da; putative annotation: N/A; putative formula: C42H61N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.55,"smiles":null,"spectrum_id":"CCMSLIB00017234337","spectrum_index":14433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 482.1929 Da; putative annotation: N/A; putative formula: C32H26N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.305,"smiles":null,"spectrum_id":"CCMSLIB00017234338","spectrum_index":14434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 748.4413 Da; putative annotation: N/A; putative formula: C42H60N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.501,"smiles":null,"spectrum_id":"CCMSLIB00017234341","spectrum_index":14435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.175,"smiles":null,"spectrum_id":"CCMSLIB00017234342","spectrum_index":14436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"6,11-dioxododecanoic acid CollisionEnergy:102040\"\" (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017234344","spectrum_index":14437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 213.2063 Da; putative annotation: N/A; putative formula: C9H23N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.335,"smiles":null,"spectrum_id":"CCMSLIB00017234346","spectrum_index":14438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-1H-indazole-3-carboxylic acid (delta mass: 27.987 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.948,"smiles":null,"spectrum_id":"CCMSLIB00017234347","spectrum_index":14439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 276.082 Da; putative annotation: N/A; putative formula: C15H16O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.158,"smiles":null,"spectrum_id":"CCMSLIB00017234350","spectrum_index":14440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-11.alpha.,16R-dihydroxy-17-cyclobutyl-5Z,13E-dien-1-oic acid (delta mass: 64.0679 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.332,"smiles":null,"spectrum_id":"CCMSLIB00017234351","spectrum_index":14441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 261.0603 Da; putative annotation: N/A; putative formula: C11H12N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.097,"smiles":null,"spectrum_id":"CCMSLIB00017234354","spectrum_index":14442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-isopropylthiophenethylamine (delta mass: 18.0067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.143,"smiles":null,"spectrum_id":"CCMSLIB00017234355","spectrum_index":14443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 108.0949 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.4,"smiles":null,"spectrum_id":"CCMSLIB00017234358","spectrum_index":14444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 448.0938 Da; putative annotation: N/A; putative formula: C12H16N8O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.164,"smiles":null,"spectrum_id":"CCMSLIB00017234359","spectrum_index":14445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 134.1097 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017234360","spectrum_index":14446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxykaurenolide (delta mass: 558.2501 Da; putative annotation: N/A; putative formula: C27H42O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.461,"smiles":null,"spectrum_id":"CCMSLIB00017234363","spectrum_index":14447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 70.0417 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017234364","spectrum_index":14448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Acetyl-11-keto-.beta.-boswellic acid (delta mass: 102.0313 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.389,"smiles":null,"spectrum_id":"CCMSLIB00017234367","spectrum_index":14449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 68.0622 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.237,"smiles":null,"spectrum_id":"CCMSLIB00017234368","spectrum_index":14450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,17,21-triol-11,20-dione (delta mass: 78.0465 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.279,"smiles":null,"spectrum_id":"CCMSLIB00017234371","spectrum_index":14451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.086,"smiles":null,"spectrum_id":"CCMSLIB00017234372","spectrum_index":14452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Dihydrocarveol (delta mass: 60.0209 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.164,"smiles":null,"spectrum_id":"CCMSLIB00017234374","spectrum_index":14453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dihydroxy-5Z,8Z,14Z-eicosatrienoic acid (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.315,"smiles":null,"spectrum_id":"CCMSLIB00017234376","spectrum_index":14454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 909.3823 Da; putative annotation: N/A; putative formula: C38H75N3O9S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1077.48,"smiles":null,"spectrum_id":"CCMSLIB00017234378","spectrum_index":14455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 45.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017234380","spectrum_index":14456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazole (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":97.0392,"smiles":null,"spectrum_id":"CCMSLIB00017234382","spectrum_index":14457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazole (delta mass: 41.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":110.096,"smiles":null,"spectrum_id":"CCMSLIB00017234384","spectrum_index":14458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 118.0413 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.096,"smiles":null,"spectrum_id":"CCMSLIB00017234387","spectrum_index":14459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.118,"smiles":null,"spectrum_id":"CCMSLIB00017234389","spectrum_index":14460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(R)-Hydroxyprostaglandin A2 (delta mass: 35.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.254,"smiles":null,"spectrum_id":"CCMSLIB00017234391","spectrum_index":14461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA001641 Coniine (delta mass: 242.1512 Da; putative annotation: N/A; putative formula: C13H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.295,"smiles":null,"spectrum_id":"CCMSLIB00017234392","spectrum_index":14462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 120.0928 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.34,"smiles":null,"spectrum_id":"CCMSLIB00017234395","spectrum_index":14463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vialinin A (delta mass: 136.052 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.222,"smiles":null,"spectrum_id":"CCMSLIB00017234397","spectrum_index":14464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 424.2826 Da; putative annotation: N/A; putative formula: C24H40O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.384,"smiles":null,"spectrum_id":"CCMSLIB00017234399","spectrum_index":14465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 57.01 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017234401","spectrum_index":14466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufalin (delta mass: 370.2709 Da; putative annotation: N/A; putative formula: C18H30N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.524,"smiles":null,"spectrum_id":"CCMSLIB00017234403","spectrum_index":14467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 76.0422 Da; putative annotation: N/A; putative formula: C5H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.149,"smiles":null,"spectrum_id":"CCMSLIB00017234405","spectrum_index":14468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 102.9935 Da; putative annotation: N/A; putative formula: CH2N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.069,"smiles":null,"spectrum_id":"CCMSLIB00017234407","spectrum_index":14469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2-1-glyceryl ester (delta mass: 166.115 Da; putative annotation: N/A; putative formula: C14H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.384,"smiles":null,"spectrum_id":"CCMSLIB00017234408","spectrum_index":14470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.197,"smiles":null,"spectrum_id":"CCMSLIB00017234411","spectrum_index":14471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 422.2435 Da; putative annotation: N/A; putative formula: C20H39O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.314,"smiles":null,"spectrum_id":"CCMSLIB00017234412","spectrum_index":14472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 70.0414 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.273,"smiles":null,"spectrum_id":"CCMSLIB00017234415","spectrum_index":14473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,5R,9S,13R)-14-formyl-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadec-14-ene-5-carboxylic acid (delta mass: 35.0355 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.247,"smiles":null,"spectrum_id":"CCMSLIB00017234416","spectrum_index":14474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.232,"smiles":null,"spectrum_id":"CCMSLIB00017234419","spectrum_index":14475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 30.0 eV (delta mass: 867.283 Da; putative annotation: N/A; putative formula: C42H45N9O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1210.41,"smiles":null,"spectrum_id":"CCMSLIB00017234421","spectrum_index":14476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 935.8419 Da; putative annotation: N/A; putative formula: C60H109N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1603.07,"smiles":null,"spectrum_id":"CCMSLIB00017234423","spectrum_index":14477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-5-hydroxybenzoic acid (delta mass: 27.9953 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.045,"smiles":null,"spectrum_id":"CCMSLIB00017234425","spectrum_index":14478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydro-11-deoxycorticosterone (delta mass: 203.1528 Da; putative annotation: N/A; putative formula: C11H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.411,"smiles":null,"spectrum_id":"CCMSLIB00017234427","spectrum_index":14479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 235.1794 Da; putative annotation: N/A; putative formula: C12H21N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.411,"smiles":null,"spectrum_id":"CCMSLIB00017234429","spectrum_index":14480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phlorobenzophenone (delta mass: 56.0983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.164,"smiles":null,"spectrum_id":"CCMSLIB00017234431","spectrum_index":14481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 399.2613 Da; putative annotation: N/A; putative formula: C21H37NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.328,"smiles":null,"spectrum_id":"CCMSLIB00017234433","spectrum_index":14482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 58.0616 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.2,"smiles":null,"spectrum_id":"CCMSLIB00017234435","spectrum_index":14483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 476.2772 Da; putative annotation: N/A; putative formula: C27H40O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.348,"smiles":null,"spectrum_id":"CCMSLIB00017234438","spectrum_index":14484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-6,10,14,18-tetraene-2,3,22,23-tetrol (delta mass: 200.1567 Da; putative annotation: N/A; putative formula: C15H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.566,"smiles":null,"spectrum_id":"CCMSLIB00017234440","spectrum_index":14485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Acetyloxy)-2-naphthoic acid (delta mass: 46.0048 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.07,"smiles":null,"spectrum_id":"CCMSLIB00017234441","spectrum_index":14486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 117.0752 Da; putative annotation: N/A; putative formula: CH7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.156,"smiles":null,"spectrum_id":"CCMSLIB00017234444","spectrum_index":14487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 58.9596 Da; putative annotation: N/A; putative formula: H-2NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.025,"smiles":null,"spectrum_id":"CCMSLIB00017234445","spectrum_index":14488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 72.0356 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.267,"smiles":null,"spectrum_id":"CCMSLIB00017234448","spectrum_index":14489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 383.3396 Da; putative annotation: N/A; putative formula: C23H45NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.582,"smiles":null,"spectrum_id":"CCMSLIB00017234449","spectrum_index":14490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 51.0064 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.109,"smiles":null,"spectrum_id":"CCMSLIB00017234452","spectrum_index":14491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 184.1183 Da; putative annotation: N/A; putative formula: C5H12N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.34,"smiles":null,"spectrum_id":"CCMSLIB00017234453","spectrum_index":14492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-4-(trifluoromethyl)- (delta mass: 15.0134 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.118,"smiles":null,"spectrum_id":"CCMSLIB00017234456","spectrum_index":14493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 31.0309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.169,"smiles":null,"spectrum_id":"CCMSLIB00017234459","spectrum_index":14494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxypropionic acid (delta mass: 58.0532 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.124,"smiles":null,"spectrum_id":"CCMSLIB00017234460","spectrum_index":14495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 102.068 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.133,"smiles":null,"spectrum_id":"CCMSLIB00017234461","spectrum_index":14496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 112.0283 Da; putative annotation: N/A; putative formula: C4H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.12,"smiles":null,"spectrum_id":"CCMSLIB00017234464","spectrum_index":14497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 291.1936 Da; putative annotation: N/A; putative formula: C16H25N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.405,"smiles":null,"spectrum_id":"CCMSLIB00017234467","spectrum_index":14498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 241.2777 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.536,"smiles":null,"spectrum_id":"CCMSLIB00017234468","spectrum_index":14499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 121.02 Da; putative annotation: N/A; putative formula: C3H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.222,"smiles":null,"spectrum_id":"CCMSLIB00017234471","spectrum_index":14500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,9-Dihydroxy-6-methyl-3,10-dimethylidene-4,7,8,9,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one (delta mass: 163.0566 Da; putative annotation: N/A; putative formula: C8H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.2,"smiles":null,"spectrum_id":"CCMSLIB00017234472","spectrum_index":14501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 84.0326 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.202,"smiles":null,"spectrum_id":"CCMSLIB00017234474","spectrum_index":14502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lumisterol 3 (delta mass: 46.0071 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.354,"smiles":null,"spectrum_id":"CCMSLIB00017234476","spectrum_index":14503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Colubrinic acid (delta mass: 100.0637 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.411,"smiles":null,"spectrum_id":"CCMSLIB00017234478","spectrum_index":14504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 73.0896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.343,"smiles":null,"spectrum_id":"CCMSLIB00017234480","spectrum_index":14505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-nornuciferine (delta mass: 45.0217 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.171,"smiles":null,"spectrum_id":"CCMSLIB00017234482","spectrum_index":14506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-carbinol CollisionEnergy:205060 (delta mass: 24.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.133,"smiles":null,"spectrum_id":"CCMSLIB00017234485","spectrum_index":14507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017234487","spectrum_index":14508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 246.0837 Da; putative annotation: N/A; putative formula: C6H6N12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.17,"smiles":null,"spectrum_id":"CCMSLIB00017234488","spectrum_index":14509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 465.3682 Da; putative annotation: N/A; putative formula: C25H47N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.522,"smiles":null,"spectrum_id":"CCMSLIB00017234491","spectrum_index":14510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 57.0206 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.206,"smiles":null,"spectrum_id":"CCMSLIB00017234492","spectrum_index":14511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 123.0528 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.206,"smiles":null,"spectrum_id":"CCMSLIB00017234495","spectrum_index":14512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 389.3132 Da; putative annotation: N/A; putative formula: C18H35N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.535,"smiles":null,"spectrum_id":"CCMSLIB00017234496","spectrum_index":14513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(R)-Hydroxyprostaglandin E2 (delta mass: 72.0357 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.263,"smiles":null,"spectrum_id":"CCMSLIB00017234499","spectrum_index":14514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 906.9502 Da; putative annotation: N/A; putative formula: C64H122O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1217.06,"smiles":null,"spectrum_id":"CCMSLIB00017234500","spectrum_index":14515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Eicosenoic acid (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.305,"smiles":null,"spectrum_id":"CCMSLIB00017234502","spectrum_index":14516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 114.0502 Da; putative annotation: N/A; putative formula: C6H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.225,"smiles":null,"spectrum_id":"CCMSLIB00017234504","spectrum_index":14517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 177.1365 Da; putative annotation: N/A; putative formula: C9H15N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.176,"smiles":null,"spectrum_id":"CCMSLIB00017234505","spectrum_index":14518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 255.2237 Da; putative annotation: N/A; putative formula: C14H30N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.315,"smiles":null,"spectrum_id":"CCMSLIB00017234508","spectrum_index":14519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 57.0344 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.152,"smiles":null,"spectrum_id":"CCMSLIB00017234510","spectrum_index":14520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13(S)-HODE methyl ester from NIST14 (delta mass: 353.2536 Da; putative annotation: N/A; putative formula: C16H31N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.512,"smiles":null,"spectrum_id":"CCMSLIB00017234512","spectrum_index":14521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-5-(3,3-dimethylguanidine-1-yl)pentanoic acid (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.129,"smiles":null,"spectrum_id":"CCMSLIB00017234513","spectrum_index":14522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOATE (delta mass: 16.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.081,"smiles":null,"spectrum_id":"CCMSLIB00017234516","spectrum_index":14523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydroprostaglandin F2.alpha. (delta mass: 100.0666 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.33,"smiles":null,"spectrum_id":"CCMSLIB00017234517","spectrum_index":14524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 70.0419 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.269,"smiles":null,"spectrum_id":"CCMSLIB00017234520","spectrum_index":14525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 44.0086 Da; putative annotation: N/A; putative formula: C2H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.084,"smiles":null,"spectrum_id":"CCMSLIB00017234521","spectrum_index":14526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 56.971 Da; putative annotation: N/A; putative formula: C28H42N10O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.083,"smiles":null,"spectrum_id":"CCMSLIB00017234524","spectrum_index":14527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 82.0267 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.232,"smiles":null,"spectrum_id":"CCMSLIB00017234525","spectrum_index":14528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 720.4451 Da; putative annotation: N/A; putative formula: C40H64O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.516,"smiles":null,"spectrum_id":"CCMSLIB00017234527","spectrum_index":14529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 118.1148 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.357,"smiles":null,"spectrum_id":"CCMSLIB00017234529","spectrum_index":14530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 211.1684 Da; putative annotation: N/A; putative formula: C11H21N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.268,"smiles":null,"spectrum_id":"CCMSLIB00017234531","spectrum_index":14531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 14.0161 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.227,"smiles":null,"spectrum_id":"CCMSLIB00017234533","spectrum_index":14532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 135.0037 Da; putative annotation: N/A; putative formula: C2H6N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.064,"smiles":null,"spectrum_id":"CCMSLIB00017234534","spectrum_index":14533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arachidonoyl p-nitroaniline (delta mass: 88.077 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.357,"smiles":null,"spectrum_id":"CCMSLIB00017234537","spectrum_index":14534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maresin 1 (delta mass: 48.0357 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.273,"smiles":null,"spectrum_id":"CCMSLIB00017234538","spectrum_index":14535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Makisterone A (delta mass: 138.0818 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.413,"smiles":null,"spectrum_id":"CCMSLIB00017234541","spectrum_index":14536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311155 Vanillic acid (not validated) (delta mass: 84.0541 Da; putative annotation: N/A; putative formula: CH4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.119,"smiles":null,"spectrum_id":"CCMSLIB00017234542","spectrum_index":14537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 58.1558 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.128,"smiles":null,"spectrum_id":"CCMSLIB00017234545","spectrum_index":14538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 206.103 Da; putative annotation: N/A; putative formula: C7H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.181,"smiles":null,"spectrum_id":"CCMSLIB00017234548","spectrum_index":14539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 84.0575 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017234549","spectrum_index":14540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 649.5617 Da; putative annotation: N/A; putative formula: C36H71N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.632,"smiles":null,"spectrum_id":"CCMSLIB00017234552","spectrum_index":14541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 709.5629 Da; putative annotation: N/A; putative formula: C42H67N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.634,"smiles":null,"spectrum_id":"CCMSLIB00017234553","spectrum_index":14542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Hydroxyprogesterone (delta mass: 50.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.264,"smiles":null,"spectrum_id":"CCMSLIB00017234554","spectrum_index":14543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dimethyl-1,3-benzenediol (delta mass: 209.2146 Da; putative annotation: N/A; putative formula: C14H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.29,"smiles":null,"spectrum_id":"CCMSLIB00017234557","spectrum_index":14544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decahydronaphthalene-2-carboxylic acid (delta mass: 120.0937 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.232,"smiles":null,"spectrum_id":"CCMSLIB00017234559","spectrum_index":14545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S-Allyl-L-Cysteine (delta mass: 41.0217 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.08,"smiles":null,"spectrum_id":"CCMSLIB00017234561","spectrum_index":14546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 45.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.129,"smiles":null,"spectrum_id":"CCMSLIB00017234562","spectrum_index":14547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 122.1114 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.343,"smiles":null,"spectrum_id":"CCMSLIB00017234565","spectrum_index":14548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 88.0609 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.34,"smiles":null,"spectrum_id":"CCMSLIB00017234566","spectrum_index":14549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Peruvinine (delta mass: 42.0102 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.154,"smiles":null,"spectrum_id":"CCMSLIB00017234569","spectrum_index":14550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(2-Aminophenyl)heptanoic acid (delta mass: 42.0115 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.16,"smiles":null,"spectrum_id":"CCMSLIB00017234571","spectrum_index":14551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 94.0267 Da; putative annotation: N/A; putative formula: C3H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.113,"smiles":null,"spectrum_id":"CCMSLIB00017234573","spectrum_index":14552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005923 Tetrahydropapaveroline|1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 198.1842 Da; putative annotation: N/A; putative formula: C10H22N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.307,"smiles":null,"spectrum_id":"CCMSLIB00017234574","spectrum_index":14553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 31.0468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017234577","spectrum_index":14554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 9.0096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.086,"smiles":null,"spectrum_id":"CCMSLIB00017234578","spectrum_index":14555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopentylacetic acid (delta mass: 9.9938 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.096,"smiles":null,"spectrum_id":"CCMSLIB00017234580","spectrum_index":14556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Oleoylglycine (delta mass: 16.9939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.279,"smiles":null,"spectrum_id":"CCMSLIB00017234582","spectrum_index":14557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 81.0795 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.322,"smiles":null,"spectrum_id":"CCMSLIB00017234584","spectrum_index":14558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 103.027 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.17,"smiles":null,"spectrum_id":"CCMSLIB00017234587","spectrum_index":14559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxytestosterone (delta mass: 110.0364 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.247,"smiles":null,"spectrum_id":"CCMSLIB00017234588","spectrum_index":14560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 404.3485 Da; putative annotation: N/A; putative formula: C20H40N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.415,"smiles":null,"spectrum_id":"CCMSLIB00017234591","spectrum_index":14561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,3R,4R)-4-Amino-1,2,3-cyclopentanetriol (delta mass: 39.0028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.084,"smiles":null,"spectrum_id":"CCMSLIB00017234592","spectrum_index":14562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 56.0259 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.143,"smiles":null,"spectrum_id":"CCMSLIB00017234594","spectrum_index":14563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 79.0524 Da; putative annotation: N/A; putative formula: C4H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.134,"smiles":null,"spectrum_id":"CCMSLIB00017234596","spectrum_index":14564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 46.0402 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.09,"smiles":null,"spectrum_id":"CCMSLIB00017234599","spectrum_index":14565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACETALDEHYDE (delta mass: 14.0557 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.131,"smiles":null,"spectrum_id":"CCMSLIB00017234600","spectrum_index":14566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 146.1087 Da; putative annotation: N/A; putative formula: C5H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.357,"smiles":null,"spectrum_id":"CCMSLIB00017234603","spectrum_index":14567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ellagic acid CollisionEnergy:205060 (delta mass: 193.0086 Da; putative annotation: N/A; putative formula: C4H10N3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.022,"smiles":null,"spectrum_id":"CCMSLIB00017234604","spectrum_index":14568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Lys (delta mass: 115.0258 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.223,"smiles":null,"spectrum_id":"CCMSLIB00017234607","spectrum_index":14569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Di-.gamma.-linolenin (6c,9c,12c) (delta mass: 64.0773 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.56,"smiles":null,"spectrum_id":"CCMSLIB00017234608","spectrum_index":14570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 64.0335 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.271,"smiles":null,"spectrum_id":"CCMSLIB00017234609","spectrum_index":14571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 158.1083 Da; putative annotation: N/A; putative formula: C6H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.33,"smiles":null,"spectrum_id":"CCMSLIB00017234612","spectrum_index":14572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 76.0727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.31,"smiles":null,"spectrum_id":"CCMSLIB00017234615","spectrum_index":14573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 88.0506 Da; putative annotation: N/A; putative formula: H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.095,"smiles":null,"spectrum_id":"CCMSLIB00017234616","spectrum_index":14574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucine butyl ester (delta mass: 99.0685 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.233,"smiles":null,"spectrum_id":"CCMSLIB00017234617","spectrum_index":14575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 200.96 Da; putative annotation: N/A; putative formula: C4H3N5O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.041,"smiles":null,"spectrum_id":"CCMSLIB00017234620","spectrum_index":14576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 40.0 eV (delta mass: 9.9845 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.06,"smiles":null,"spectrum_id":"CCMSLIB00017234621","spectrum_index":14577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 190.4035 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.5,"smiles":null,"spectrum_id":"CCMSLIB00017234624","spectrum_index":14578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxygypsogenic acid (delta mass: 112.068 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.405,"smiles":null,"spectrum_id":"CCMSLIB00017234626","spectrum_index":14579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.087,"smiles":null,"spectrum_id":"CCMSLIB00017234628","spectrum_index":14580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Acetyl-7-hydroxycoumarin (delta mass: 60.0052 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.055,"smiles":null,"spectrum_id":"CCMSLIB00017234629","spectrum_index":14581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 45.1003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017234632","spectrum_index":14582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 27.9968 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.051,"smiles":null,"spectrum_id":"CCMSLIB00017234633","spectrum_index":14583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 41.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017234636","spectrum_index":14584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 411.0651 Da; putative annotation: N/A; putative formula: C16H18N3O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.136,"smiles":null,"spectrum_id":"CCMSLIB00017234637","spectrum_index":14585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ricinoleic acid methyl ester (delta mass: 179.0793 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.353,"smiles":null,"spectrum_id":"CCMSLIB00017234640","spectrum_index":14586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017234641","spectrum_index":14587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arsubin (delta mass: 267.1324 Da; putative annotation: N/A; putative formula: C13H22N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.281,"smiles":null,"spectrum_id":"CCMSLIB00017234644","spectrum_index":14588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole (delta mass: 264.0906 Da; putative annotation: N/A; putative formula: C9H12N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.198,"smiles":null,"spectrum_id":"CCMSLIB00017234645","spectrum_index":14589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-Hydroxy-6'-methoxyacetophenone (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017234648","spectrum_index":14590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rhetsinine (delta mass: 17.9909 Da; putative annotation: N/A; putative formula: C3H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.13,"smiles":null,"spectrum_id":"CCMSLIB00017234649","spectrum_index":14591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 121.1091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.19,"smiles":null,"spectrum_id":"CCMSLIB00017234652","spectrum_index":14592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxy-4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoic acid (delta mass: 18.0095 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.252,"smiles":null,"spectrum_id":"CCMSLIB00017234653","spectrum_index":14593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 113.084 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.212,"smiles":null,"spectrum_id":"CCMSLIB00017234656","spectrum_index":14594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 301.1424 Da; putative annotation: N/A; putative formula: C16H19N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.239,"smiles":null,"spectrum_id":"CCMSLIB00017234657","spectrum_index":14595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 37.974 Da; putative annotation: N/A; putative formula: C2H-1O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.185,"smiles":null,"spectrum_id":"CCMSLIB00017234659","spectrum_index":14596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 96.0568 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.148,"smiles":null,"spectrum_id":"CCMSLIB00017234661","spectrum_index":14597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 44.8294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.9,"smiles":null,"spectrum_id":"CCMSLIB00017234662","spectrum_index":14598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 308.093 Da; putative annotation: N/A; putative formula: C12H20O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.168,"smiles":null,"spectrum_id":"CCMSLIB00017234665","spectrum_index":14599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Tetrahydro-2H-pyran-4-yl-4-piperidinamine (delta mass: 62.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.201,"smiles":null,"spectrum_id":"CCMSLIB00017234666","spectrum_index":14600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 22(S)-Hydroxycholesterol (delta mass: 152.0996 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.457,"smiles":null,"spectrum_id":"CCMSLIB00017234669","spectrum_index":14601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 382.1115 Da; putative annotation: N/A; putative formula: C17H23N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.161,"smiles":null,"spectrum_id":"CCMSLIB00017234671","spectrum_index":14602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of chenodeoxycholic acid CollisionEnergy:102040 (delta mass: 356.2706 Da; putative annotation: 3.beta.-Hydroxy-5-cholenoic acid; putative formula: C24H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.57,"smiles":null,"spectrum_id":"CCMSLIB00017234673","spectrum_index":14603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 102.0305 Da; putative annotation: Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.127,"smiles":null,"spectrum_id":"CCMSLIB00017234676","spectrum_index":14604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12(13)-Epoxy-9Z-octadecenoic acid from NIST14 (delta mass: 278.2259 Da; putative annotation: 9(10)-Epoxy-12Z-octadecenoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.468,"smiles":null,"spectrum_id":"CCMSLIB00017234677","spectrum_index":14605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 278.2244 Da; putative annotation: Laetisaric acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.435,"smiles":null,"spectrum_id":"CCMSLIB00017234679","spectrum_index":14606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 290.2238 Da; putative annotation: Androstane-3,6,17-triol; putative formula: C19H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.466,"smiles":null,"spectrum_id":"CCMSLIB00017234681","spectrum_index":14607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 236.2147 Da; putative annotation: cis-9-Hexadecenoic acid; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.483,"smiles":null,"spectrum_id":"CCMSLIB00017234683","spectrum_index":14608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 292.2037 Da; putative annotation: NCGC00381339-01!methyl (2E,4E,8E)-7,13-dihydroxy-4,8,12-trimethyltetradeca-2,4,8-trienoate; putative formula: C18H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.415,"smiles":null,"spectrum_id":"CCMSLIB00017234685","spectrum_index":14609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 99.068 Da; putative annotation: L-Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.191,"smiles":null,"spectrum_id":"CCMSLIB00017234688","spectrum_index":14610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 279.2567 Da; putative annotation: Palmitoleoyl ethanolamide; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.437,"smiles":null,"spectrum_id":"CCMSLIB00017234689","spectrum_index":14611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 224.1411 Da; putative annotation: 2-Oct-7-enylpentanedioic acid; putative formula: C13H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017234692","spectrum_index":14612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 194.1307 Da; putative annotation: 9,10-Dihydrojasmonic acid; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.352,"smiles":null,"spectrum_id":"CCMSLIB00017234693","spectrum_index":14613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 99.0683 Da; putative annotation: 5-Aminovaleric acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.144,"smiles":null,"spectrum_id":"CCMSLIB00017234695","spectrum_index":14614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinic Acid (delta mass: 84.0577 Da; putative annotation: Tetrahydro-3-furanylmethanol; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.128,"smiles":null,"spectrum_id":"CCMSLIB00017234697","spectrum_index":14615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 403.2568 Da; putative annotation: PABA-C20:5; putative formula: C27H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.322,"smiles":null,"spectrum_id":"CCMSLIB00017234699","spectrum_index":14616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 188.0581 Da; putative annotation: 2-Hydroxy-3-(2-hydroxyethyl)-4(3H)-quinazolinone; putative formula: C10H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.134,"smiles":null,"spectrum_id":"CCMSLIB00017234701","spectrum_index":14617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nerol (delta mass: 122.0727 Da; putative annotation: (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017234703","spectrum_index":14618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 238.2295 Da; putative annotation: 2-Hexyldecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.482,"smiles":null,"spectrum_id":"CCMSLIB00017234705","spectrum_index":14619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DESMOSTEROL CollisionEnergy:205060 (delta mass: 327.2562 Da; putative annotation: Eicosapentaenoyl ethanolamide; putative formula: C22H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.603,"smiles":null,"spectrum_id":"CCMSLIB00017234708","spectrum_index":14620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Cholesterol from NIST14 (delta mass: 302.2248 Da; putative annotation: 8(9)-Epoxy-5Z,11Z,14Z-eicosatrienoic acid; putative formula: C20H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.587,"smiles":null,"spectrum_id":"CCMSLIB00017234710","spectrum_index":14621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-4,10-Dimethylidene-7-propan-2-ylcyclodec-5-en-1-ol (delta mass: 344.1627 Da; putative annotation: Teukotschyn; putative formula: C20H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.353,"smiles":null,"spectrum_id":"CCMSLIB00017234712","spectrum_index":14622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 66.0107 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.065,"smiles":null,"spectrum_id":"CCMSLIB00017234714","spectrum_index":14623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 94.0781 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017234716","spectrum_index":14624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 60.0323 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.275,"smiles":null,"spectrum_id":"CCMSLIB00017234718","spectrum_index":14625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 61.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017234720","spectrum_index":14626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Leu (delta mass: 129.0579 Da; putative annotation: N/A; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.239,"smiles":null,"spectrum_id":"CCMSLIB00017234722","spectrum_index":14627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine ethyl ester (delta mass: 113.0477 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.14,"smiles":null,"spectrum_id":"CCMSLIB00017234724","spectrum_index":14628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 131.0385 Da; putative annotation: N/A; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.12,"smiles":null,"spectrum_id":"CCMSLIB00017234726","spectrum_index":14629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5'-(N-Ethylcarboxamido)adenosine (delta mass: 924.3494 Da; putative annotation: N/A; putative formula: C42H60N4O15S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1233.48,"smiles":null,"spectrum_id":"CCMSLIB00017234729","spectrum_index":14630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 40.0313 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.107,"smiles":null,"spectrum_id":"CCMSLIB00017234730","spectrum_index":14631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 429.1253 Da; putative annotation: N/A; putative formula: C15H23N7O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.175,"smiles":null,"spectrum_id":"CCMSLIB00017234733","spectrum_index":14632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 88.0681 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.316,"smiles":null,"spectrum_id":"CCMSLIB00017234734","spectrum_index":14633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 102.0314 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.248,"smiles":null,"spectrum_id":"CCMSLIB00017234737","spectrum_index":14634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aspochalasin T (delta mass: 168.1004 Da; putative annotation: N/A; putative formula: C7H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.359,"smiles":null,"spectrum_id":"CCMSLIB00017234738","spectrum_index":14635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.284,"smiles":null,"spectrum_id":"CCMSLIB00017234741","spectrum_index":14636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 59.0362 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.247,"smiles":null,"spectrum_id":"CCMSLIB00017234742","spectrum_index":14637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 511.3401 Da; putative annotation: N/A; putative formula: C30H45N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.435,"smiles":null,"spectrum_id":"CCMSLIB00017234744","spectrum_index":14638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. 1,11-lactone (delta mass: 49.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.29,"smiles":null,"spectrum_id":"CCMSLIB00017234746","spectrum_index":14639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 12.0 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.242,"smiles":null,"spectrum_id":"CCMSLIB00017234749","spectrum_index":14640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 42.0072 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.135,"smiles":null,"spectrum_id":"CCMSLIB00017234750","spectrum_index":14641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Deoxy-9-methyleneprostaglandin E2 (delta mass: 100.0686 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.322,"smiles":null,"spectrum_id":"CCMSLIB00017234751","spectrum_index":14642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 554.1852 Da; putative annotation: N/A; putative formula: C25H35N2O8PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.309,"smiles":null,"spectrum_id":"CCMSLIB00017234754","spectrum_index":14643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"methyl 3-[(2-(2-1,2,3,4-tetrahydroisoquinolyl)acetylamino)methyl]benzoate CollisionEnergy:102040\"\" (delta mass: 160.0812 Da; putative annotation: N/A; putative formula: C11H13O-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.251,"smiles":null,"spectrum_id":"CCMSLIB00017234756","spectrum_index":14644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxypumiloside (delta mass: 496.182 Da; putative annotation: N/A; putative formula: C22H24N8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":993.374,"smiles":null,"spectrum_id":"CCMSLIB00017234758","spectrum_index":14645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLYCOCHOLATE - 70.0 eV (delta mass: 146.1177 Da; putative annotation: N/A; putative formula: C5H14N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.434,"smiles":null,"spectrum_id":"CCMSLIB00017234760","spectrum_index":14646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7-Triazacyclononane (delta mass: 113.9661 Da; putative annotation: N/A; putative formula: CH-2N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.1,"smiles":null,"spectrum_id":"CCMSLIB00017234762","spectrum_index":14647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 131.1892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.27,"smiles":null,"spectrum_id":"CCMSLIB00017234764","spectrum_index":14648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 247.1459 Da; putative annotation: N/A; putative formula: C9H21N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.321,"smiles":null,"spectrum_id":"CCMSLIB00017234766","spectrum_index":14649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 261.1583 Da; putative annotation: N/A; putative formula: C13H27NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.38,"smiles":null,"spectrum_id":"CCMSLIB00017234768","spectrum_index":14650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminobenzoic acid - 40.0 eV (delta mass: 74.0004 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.055,"smiles":null,"spectrum_id":"CCMSLIB00017234770","spectrum_index":14651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 402.2083 Da; putative annotation: N/A; putative formula: C21H38OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.268,"smiles":null,"spectrum_id":"CCMSLIB00017234771","spectrum_index":14652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 301.2003 Da; putative annotation: N/A; putative formula: C14H27N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.355,"smiles":null,"spectrum_id":"CCMSLIB00017234774","spectrum_index":14653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentalenic acid (delta mass: 156.1263 Da; putative annotation: N/A; putative formula: C8H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.29,"smiles":null,"spectrum_id":"CCMSLIB00017234776","spectrum_index":14654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 98.0329 Da; putative annotation: N/A; putative formula: CH2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.203,"smiles":null,"spectrum_id":"CCMSLIB00017234778","spectrum_index":14655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 42.0101 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.081,"smiles":null,"spectrum_id":"CCMSLIB00017234780","spectrum_index":14656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.117,"smiles":null,"spectrum_id":"CCMSLIB00017234784","spectrum_index":14657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.06,"smiles":null,"spectrum_id":"CCMSLIB00017234785","spectrum_index":14658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 88.0534 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.306,"smiles":null,"spectrum_id":"CCMSLIB00017234788","spectrum_index":14659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 70.0424 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.295,"smiles":null,"spectrum_id":"CCMSLIB00017234789","spectrum_index":14660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017234792","spectrum_index":14661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 68.0262 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.269,"smiles":null,"spectrum_id":"CCMSLIB00017234794","spectrum_index":14662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 244.1308 Da; putative annotation: N/A; putative formula: C12H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.274,"smiles":null,"spectrum_id":"CCMSLIB00017234796","spectrum_index":14663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6-quinolinecarboxylic acid (delta mass: 27.9537 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017234798","spectrum_index":14664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 305.1112 Da; putative annotation: N/A; putative formula: C12H19NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.235,"smiles":null,"spectrum_id":"CCMSLIB00017234801","spectrum_index":14665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 33.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.081,"smiles":null,"spectrum_id":"CCMSLIB00017234802","spectrum_index":14666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2R,3aS,3bS,8S,9aR,9bR,11aR)-1-[(2R,4E)-2,6-dihydroxy-6-methyl-3-oxohept-4-en-2-yl]-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-7,10-dione (delta mass: 59.0383 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.354,"smiles":null,"spectrum_id":"CCMSLIB00017234805","spectrum_index":14667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 144.0934 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.43,"smiles":null,"spectrum_id":"CCMSLIB00017234810","spectrum_index":14668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169534-02_C14H18O9_Ethanone, 1-[4-(beta-D-glucopyranosyloxy)-2,6-dihydroxyphenyl]- (delta mass: 146.0431 Da; putative annotation: N/A; putative formula: C5H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.146,"smiles":null,"spectrum_id":"CCMSLIB00017234812","spectrum_index":14669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 3.9945 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.06,"smiles":null,"spectrum_id":"CCMSLIB00017234814","spectrum_index":14670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 48.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.086,"smiles":null,"spectrum_id":"CCMSLIB00017234816","spectrum_index":14671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 9.9918 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.068,"smiles":null,"spectrum_id":"CCMSLIB00017234818","spectrum_index":14672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Tyr (delta mass: 69.0579 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.192,"smiles":null,"spectrum_id":"CCMSLIB00017234821","spectrum_index":14673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 59.9402 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.011,"smiles":null,"spectrum_id":"CCMSLIB00017234823","spectrum_index":14674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 27.9687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.227,"smiles":null,"spectrum_id":"CCMSLIB00017234826","spectrum_index":14675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 57.016 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.087,"smiles":null,"spectrum_id":"CCMSLIB00017234828","spectrum_index":14676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 299.2789 Da; putative annotation: N/A; putative formula: C14H33N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.49,"smiles":null,"spectrum_id":"CCMSLIB00017234829","spectrum_index":14677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroeburicoic acid (delta mass: 86.0624 Da; putative annotation: N/A; putative formula: C5H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.43,"smiles":null,"spectrum_id":"CCMSLIB00017234832","spectrum_index":14678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Abscisic acid (delta mass: 161.0682 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.212,"smiles":null,"spectrum_id":"CCMSLIB00017234833","spectrum_index":14679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 375.2744 Da; putative annotation: N/A; putative formula: C19H41N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.48,"smiles":null,"spectrum_id":"CCMSLIB00017234836","spectrum_index":14680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 104.0263 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.394,"smiles":null,"spectrum_id":"CCMSLIB00017234838","spectrum_index":14681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 152.1201 Da; putative annotation: N/A; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.347,"smiles":null,"spectrum_id":"CCMSLIB00017234840","spectrum_index":14682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Isolongifolol from NIST14 (delta mass: 360.2544 Da; putative annotation: N/A; putative formula: C18H37N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.46,"smiles":null,"spectrum_id":"CCMSLIB00017234842","spectrum_index":14683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 238.2336 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.419,"smiles":null,"spectrum_id":"CCMSLIB00017234844","spectrum_index":14684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norverapamil (delta mass: 258.2252 Da; putative annotation: N/A; putative formula: C13H30N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.5,"smiles":null,"spectrum_id":"CCMSLIB00017234846","spectrum_index":14685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Pyrimidyl)piperazine (delta mass: 41.0258 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.139,"smiles":null,"spectrum_id":"CCMSLIB00017234849","spectrum_index":14686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxycoumarin (delta mass: 162.0628 Da; putative annotation: N/A; putative formula: C7H15PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.102,"smiles":null,"spectrum_id":"CCMSLIB00017234851","spectrum_index":14687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 52.0306 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017234853","spectrum_index":14688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 77.0844 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.296,"smiles":null,"spectrum_id":"CCMSLIB00017234855","spectrum_index":14689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 53.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017234858","spectrum_index":14690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 185.1773 Da; putative annotation: N/A; putative formula: C11H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.284,"smiles":null,"spectrum_id":"CCMSLIB00017234860","spectrum_index":14691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ARABITOL (delta mass: 113.0478 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.124,"smiles":null,"spectrum_id":"CCMSLIB00017234861","spectrum_index":14692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 51.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.306,"smiles":null,"spectrum_id":"CCMSLIB00017234863","spectrum_index":14693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 144.0778 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.18,"smiles":null,"spectrum_id":"CCMSLIB00017234866","spectrum_index":14694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 122.0027 Da; putative annotation: N/A; putative formula: C5H3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.25,"smiles":null,"spectrum_id":"CCMSLIB00017234867","spectrum_index":14695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-15-ketoprostaglandin D1 (delta mass: 154.1143 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.362,"smiles":null,"spectrum_id":"CCMSLIB00017234870","spectrum_index":14696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 47.9981 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017234872","spectrum_index":14697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 316.2613 Da; putative annotation: N/A; putative formula: C18H36O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.54,"smiles":null,"spectrum_id":"CCMSLIB00017234874","spectrum_index":14698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 19.018 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.37,"smiles":null,"spectrum_id":"CCMSLIB00017234876","spectrum_index":14699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 147.1618 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.237,"smiles":null,"spectrum_id":"CCMSLIB00017234878","spectrum_index":14700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 88.0155 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.063,"smiles":null,"spectrum_id":"CCMSLIB00017234880","spectrum_index":14701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 99.068 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.17,"smiles":null,"spectrum_id":"CCMSLIB00017234882","spectrum_index":14702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 302.2323 Da; putative annotation: N/A; putative formula: C14H30N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.344,"smiles":null,"spectrum_id":"CCMSLIB00017234884","spectrum_index":14703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180112-02!2-amino-3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]propanoic acid (delta mass: 78.0161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.16,"smiles":null,"spectrum_id":"CCMSLIB00017234886","spectrum_index":14704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 99.0935 Da; putative annotation: N/A; putative formula: C3H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017234888","spectrum_index":14705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 54.0474 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.539,"smiles":null,"spectrum_id":"CCMSLIB00017234890","spectrum_index":14706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 61.089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017234893","spectrum_index":14707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 76.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.17,"smiles":null,"spectrum_id":"CCMSLIB00017234895","spectrum_index":14708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methylphenyl)azepane (delta mass: 30.9944 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017234897","spectrum_index":14709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 385.2221 Da; putative annotation: N/A; putative formula: C19H35N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.263,"smiles":null,"spectrum_id":"CCMSLIB00017234898","spectrum_index":14710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentalenolactone D (delta mass: 126.0764 Da; putative annotation: N/A; putative formula: C2H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.22,"smiles":null,"spectrum_id":"CCMSLIB00017234901","spectrum_index":14711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 34.0217 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.124,"smiles":null,"spectrum_id":"CCMSLIB00017234902","spectrum_index":14712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 218.0985 Da; putative annotation: N/A; putative formula: C3H10N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.185,"smiles":null,"spectrum_id":"CCMSLIB00017234904","spectrum_index":14713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017234906","spectrum_index":14714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 17.8099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.084,"smiles":null,"spectrum_id":"CCMSLIB00017234908","spectrum_index":14715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 228.0904 Da; putative annotation: N/A; putative formula: C13H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.213,"smiles":null,"spectrum_id":"CCMSLIB00017234910","spectrum_index":14716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Heptynoic acid (delta mass: 84.0574 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017234912","spectrum_index":14717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(11),(5.alpha.)-Androsten-3.beta.-ol-17-one (delta mass: 240.0655 Da; putative annotation: N/A; putative formula: C4H14N6O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.282,"smiles":null,"spectrum_id":"CCMSLIB00017234914","spectrum_index":14718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-(3-Hydroxy-2,2,5a-trimethyl-7-methylidenedecahydro-1-benzoxepin-6-yl)ethyl)-2,2,5a,7-tetramethyldecahydro-1-benzoxepine-3,4,6-triol (delta mass: 90.0833 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.467,"smiles":null,"spectrum_id":"CCMSLIB00017234916","spectrum_index":14719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 179.0586 Da; putative annotation: N/A; putative formula: C9H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.235,"smiles":null,"spectrum_id":"CCMSLIB00017234918","spectrum_index":14720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate (delta mass: 55.1083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.2,"smiles":null,"spectrum_id":"CCMSLIB00017234920","spectrum_index":14721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 200.105 Da; putative annotation: N/A; putative formula: C10H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.452,"smiles":null,"spectrum_id":"CCMSLIB00017234923","spectrum_index":14722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 88.0663 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.314,"smiles":null,"spectrum_id":"CCMSLIB00017234925","spectrum_index":14723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 165.0784 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.19,"smiles":null,"spectrum_id":"CCMSLIB00017234927","spectrum_index":14724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 144.0418 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.175,"smiles":null,"spectrum_id":"CCMSLIB00017234929","spectrum_index":14725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 105.078 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.299,"smiles":null,"spectrum_id":"CCMSLIB00017234931","spectrum_index":14726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 317.2934 Da; putative annotation: N/A; putative formula: C19H35N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.416,"smiles":null,"spectrum_id":"CCMSLIB00017234933","spectrum_index":14727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Chlorophenyl)-1H-pyrazol-5-amine (delta mass: 197.0868 Da; putative annotation: N/A; putative formula: C10H15NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.135,"smiles":null,"spectrum_id":"CCMSLIB00017234935","spectrum_index":14728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 129.0543 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.102,"smiles":null,"spectrum_id":"CCMSLIB00017234937","spectrum_index":14729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylnorfentanyl (delta mass: 63.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.181,"smiles":null,"spectrum_id":"CCMSLIB00017234938","spectrum_index":14730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5?-CHOLANIC ACID-3?-OL-6_7-DIONE (delta mass: 97.9663 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.23,"smiles":null,"spectrum_id":"CCMSLIB00017234941","spectrum_index":14731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10(S),17(S)-Dihydroxy-4Z,7Z,11E,13Z,15E,19Z-docosahexaenoic acid (delta mass: 15.0222 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.259,"smiles":null,"spectrum_id":"CCMSLIB00017234942","spectrum_index":14732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 166.063 Da; putative annotation: N/A; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.16,"smiles":null,"spectrum_id":"CCMSLIB00017234945","spectrum_index":14733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 136.0295 Da; putative annotation: N/A; putative formula: C4H9O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.105,"smiles":null,"spectrum_id":"CCMSLIB00017234946","spectrum_index":14734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethyl-4-hydroxybenzaldehyde (delta mass: 70.0161 Da; putative annotation: N/A; putative formula: C2H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.092,"smiles":null,"spectrum_id":"CCMSLIB00017234949","spectrum_index":14735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 71.0656 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.141,"smiles":null,"spectrum_id":"CCMSLIB00017234950","spectrum_index":14736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 533.2306 Da; putative annotation: N/A; putative formula: C35H36NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.478,"smiles":null,"spectrum_id":"CCMSLIB00017234953","spectrum_index":14737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.077,"smiles":null,"spectrum_id":"CCMSLIB00017234954","spectrum_index":14738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 102.1042 Da; putative annotation: N/A; putative formula: C2H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017234957","spectrum_index":14739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 276.1718 Da; putative annotation: N/A; putative formula: C11H25N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.269,"smiles":null,"spectrum_id":"CCMSLIB00017234958","spectrum_index":14740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 592.4528 Da; putative annotation: N/A; putative formula: C36H64O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.732,"smiles":null,"spectrum_id":"CCMSLIB00017234961","spectrum_index":14741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 250.2296 Da; putative annotation: N/A; putative formula: C17H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.514,"smiles":null,"spectrum_id":"CCMSLIB00017234962","spectrum_index":14742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 111.9925 Da; putative annotation: N/A; putative formula: C2HN4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.068,"smiles":null,"spectrum_id":"CCMSLIB00017234964","spectrum_index":14743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Piperazinecarboxylic acid, methyl ester (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.108,"smiles":null,"spectrum_id":"CCMSLIB00017234966","spectrum_index":14744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 851.6103 Da; putative annotation: N/A; putative formula: C53H89NOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1073.71,"smiles":null,"spectrum_id":"CCMSLIB00017234967","spectrum_index":14745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 282.1371 Da; putative annotation: N/A; putative formula: C15H23O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.213,"smiles":null,"spectrum_id":"CCMSLIB00017234970","spectrum_index":14746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentisic acid (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.049,"smiles":null,"spectrum_id":"CCMSLIB00017234971","spectrum_index":14747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 50.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.206,"smiles":null,"spectrum_id":"CCMSLIB00017234974","spectrum_index":14748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 150.068 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.128,"smiles":null,"spectrum_id":"CCMSLIB00017234975","spectrum_index":14749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 82.0078 Da; putative annotation: N/A; putative formula: C3H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.24,"smiles":null,"spectrum_id":"CCMSLIB00017234978","spectrum_index":14750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 72.022 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.161,"smiles":null,"spectrum_id":"CCMSLIB00017234980","spectrum_index":14751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 206.0427 Da; putative annotation: N/A; putative formula: C7H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.077,"smiles":null,"spectrum_id":"CCMSLIB00017234982","spectrum_index":14752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 133.052 Da; putative annotation: N/A; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.154,"smiles":null,"spectrum_id":"CCMSLIB00017234984","spectrum_index":14753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 37.024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.272,"smiles":null,"spectrum_id":"CCMSLIB00017234986","spectrum_index":14754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 221.0684 Da; putative annotation: N/A; putative formula: C11H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.139,"smiles":null,"spectrum_id":"CCMSLIB00017234988","spectrum_index":14755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 123.032 Da; putative annotation: N/A; putative formula: C6H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.108,"smiles":null,"spectrum_id":"CCMSLIB00017234990","spectrum_index":14756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 447.2827 Da; putative annotation: N/A; putative formula: C22H41NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.347,"smiles":null,"spectrum_id":"CCMSLIB00017234992","spectrum_index":14757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 380.3398 Da; putative annotation: N/A; putative formula: C23H44N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.453,"smiles":null,"spectrum_id":"CCMSLIB00017234994","spectrum_index":14758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 126.0685 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.17,"smiles":null,"spectrum_id":"CCMSLIB00017234996","spectrum_index":14759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Hydroxy-7,14-labdadiene-6-one (delta mass: 48.0325 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.28,"smiles":null,"spectrum_id":"CCMSLIB00017234998","spectrum_index":14760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethoxy-2(1H)-quinolinone (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017234999","spectrum_index":14761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 52.0217 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.102,"smiles":null,"spectrum_id":"CCMSLIB00017235002","spectrum_index":14762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 114.0699 Da; putative annotation: N/A; putative formula: C5H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.146,"smiles":null,"spectrum_id":"CCMSLIB00017235003","spectrum_index":14763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 34.0352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.095,"smiles":null,"spectrum_id":"CCMSLIB00017235006","spectrum_index":14764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 36.0084 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.064,"smiles":null,"spectrum_id":"CCMSLIB00017235007","spectrum_index":14765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 121.0325 Da; putative annotation: N/A; putative formula: C10H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.119,"smiles":null,"spectrum_id":"CCMSLIB00017235010","spectrum_index":14766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 9.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.102,"smiles":null,"spectrum_id":"CCMSLIB00017235011","spectrum_index":14767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 29.0151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.106,"smiles":null,"spectrum_id":"CCMSLIB00017235014","spectrum_index":14768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 38.0511 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.101,"smiles":null,"spectrum_id":"CCMSLIB00017235017","spectrum_index":14769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 66.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.16,"smiles":null,"spectrum_id":"CCMSLIB00017235018","spectrum_index":14770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 390.1888 Da; putative annotation: N/A; putative formula: C16H18N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.264,"smiles":null,"spectrum_id":"CCMSLIB00017235021","spectrum_index":14771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 425.2105 Da; putative annotation: N/A; putative formula: C27H27N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.286,"smiles":null,"spectrum_id":"CCMSLIB00017235022","spectrum_index":14772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 121.0779 Da; putative annotation: N/A; putative formula: C5H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.128,"smiles":null,"spectrum_id":"CCMSLIB00017235024","spectrum_index":14773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrexone (delta mass: 24.9908 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.161,"smiles":null,"spectrum_id":"CCMSLIB00017235026","spectrum_index":14774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 129.0519 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.102,"smiles":null,"spectrum_id":"CCMSLIB00017235028","spectrum_index":14775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU051605 2-Naphthylamine|naphthalen-2-amine (delta mass: 15.8854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.966,"smiles":null,"spectrum_id":"CCMSLIB00017235030","spectrum_index":14776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.17,"smiles":null,"spectrum_id":"CCMSLIB00017235032","spectrum_index":14777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 745.5711 Da; putative annotation: N/A; putative formula: C42H75N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":908.631,"smiles":null,"spectrum_id":"CCMSLIB00017235034","spectrum_index":14778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 510.1601 Da; putative annotation: N/A; putative formula: C21H26N4O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.197,"smiles":null,"spectrum_id":"CCMSLIB00017235036","spectrum_index":14779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 236.2136 Da; putative annotation: N/A; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.289,"smiles":null,"spectrum_id":"CCMSLIB00017235038","spectrum_index":14780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 18.0096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.288,"smiles":null,"spectrum_id":"CCMSLIB00017235041","spectrum_index":14781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Poliumoside (delta mass: 624.2085 Da; putative annotation: N/A; putative formula: C39H32N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1395.48,"smiles":null,"spectrum_id":"CCMSLIB00017235043","spectrum_index":14782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 72.0285 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.276,"smiles":null,"spectrum_id":"CCMSLIB00017235045","spectrum_index":14783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 14.0185 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.193,"smiles":null,"spectrum_id":"CCMSLIB00017235047","spectrum_index":14784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norboldine (delta mass: 206.1931 Da; putative annotation: N/A; putative formula: C12H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.332,"smiles":null,"spectrum_id":"CCMSLIB00017235048","spectrum_index":14785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 193.0562 Da; putative annotation: N/A; putative formula: C10H11NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.122,"smiles":null,"spectrum_id":"CCMSLIB00017235051","spectrum_index":14786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 179.0575 Da; putative annotation: N/A; putative formula: C9H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.17,"smiles":null,"spectrum_id":"CCMSLIB00017235054","spectrum_index":14787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 280.2406 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.306,"smiles":null,"spectrum_id":"CCMSLIB00017235055","spectrum_index":14788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a Zearalenol (delta mass: 96.9849 Da; putative annotation: N/A; putative formula: CH-1N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.155,"smiles":null,"spectrum_id":"CCMSLIB00017235057","spectrum_index":14789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of salicylic acid CollisionEnergy:102040 (delta mass: 26.052 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.091,"smiles":null,"spectrum_id":"CCMSLIB00017235059","spectrum_index":14790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 175.048 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.207,"smiles":null,"spectrum_id":"CCMSLIB00017235061","spectrum_index":14791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 71.037 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.192,"smiles":null,"spectrum_id":"CCMSLIB00017235063","spectrum_index":14792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3aR,4R,5aS,6S,9aR,9bS)-4,6-Dihydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one (delta mass: 173.0685 Da; putative annotation: N/A; putative formula: C7H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.212,"smiles":null,"spectrum_id":"CCMSLIB00017235065","spectrum_index":14793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 121.0733 Da; putative annotation: N/A; putative formula: C5H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.248,"smiles":null,"spectrum_id":"CCMSLIB00017235067","spectrum_index":14794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Arachidonoylglycerol (delta mass: 369.2432 Da; putative annotation: N/A; putative formula: C20H36NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.528,"smiles":null,"spectrum_id":"CCMSLIB00017235069","spectrum_index":14795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hernagine (delta mass: 58.0058 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.16,"smiles":null,"spectrum_id":"CCMSLIB00017235071","spectrum_index":14796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 13.9903 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.113,"smiles":null,"spectrum_id":"CCMSLIB00017235073","spectrum_index":14797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 63.176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.28,"smiles":null,"spectrum_id":"CCMSLIB00017235075","spectrum_index":14798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 29.0071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.087,"smiles":null,"spectrum_id":"CCMSLIB00017235078","spectrum_index":14799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-3-carboxylic acid (delta mass: 46.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017235080","spectrum_index":14800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 139.9275 Da; putative annotation: N/A; putative formula: CH4P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.988,"smiles":null,"spectrum_id":"CCMSLIB00017235082","spectrum_index":14801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-5,8,11,14-Eicosatetraenoic acid from NIST14 (delta mass: 123.0894 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.337,"smiles":null,"spectrum_id":"CCMSLIB00017235084","spectrum_index":14802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 164.9885 Da; putative annotation: N/A; putative formula: C7H3NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.09,"smiles":null,"spectrum_id":"CCMSLIB00017235086","spectrum_index":14803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 62.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.176,"smiles":null,"spectrum_id":"CCMSLIB00017235088","spectrum_index":14804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Formyl-2-hydroxybenzoic acid (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.06,"smiles":null,"spectrum_id":"CCMSLIB00017235090","spectrum_index":14805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufalin (delta mass: 92.0467 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.3,"smiles":null,"spectrum_id":"CCMSLIB00017235093","spectrum_index":14806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Hydroxydodecanoic acid CollisionEnergy:205060 (delta mass: 92.0987 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.279,"smiles":null,"spectrum_id":"CCMSLIB00017235094","spectrum_index":14807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 325.2984 Da; putative annotation: N/A; putative formula: C20H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.369,"smiles":null,"spectrum_id":"CCMSLIB00017235097","spectrum_index":14808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 349.2101 Da; putative annotation: N/A; putative formula: C16H31NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.281,"smiles":null,"spectrum_id":"CCMSLIB00017235098","spectrum_index":14809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzenemethanol (delta mass: 230.1414 Da; putative annotation: N/A; putative formula: C8H19N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.222,"smiles":null,"spectrum_id":"CCMSLIB00017235100","spectrum_index":14810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmaline (delta mass: 121.0509 Da; putative annotation: N/A; putative formula: C3H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.169,"smiles":null,"spectrum_id":"CCMSLIB00017235102","spectrum_index":14811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 443.1429 Da; putative annotation: N/A; putative formula: C19H25NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.203,"smiles":null,"spectrum_id":"CCMSLIB00017235103","spectrum_index":14812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 394.1038 Da; putative annotation: N/A; putative formula: C19H10N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.253,"smiles":null,"spectrum_id":"CCMSLIB00017235106","spectrum_index":14813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-amino-4-methylbenzoate (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017235107","spectrum_index":14814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLIC ACID (delta mass: 308.3074 Da; putative annotation: N/A; putative formula: C21H40O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.346,"smiles":null,"spectrum_id":"CCMSLIB00017235110","spectrum_index":14815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 58.0409 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.268,"smiles":null,"spectrum_id":"CCMSLIB00017235111","spectrum_index":14816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 140.1197 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.233,"smiles":null,"spectrum_id":"CCMSLIB00017235114","spectrum_index":14817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linalool oxide (delta mass: 85.0157 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017235115","spectrum_index":14818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 714.347 Da; putative annotation: N/A; putative formula: C28H54N6O13S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":877.407,"smiles":null,"spectrum_id":"CCMSLIB00017235118","spectrum_index":14819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310669 Soyasapogenol B base + O-HexA-Pen-dHex (delta mass: 913.3716 Da; putative annotation: N/A; putative formula: C43H59N7O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1826.89,"smiles":null,"spectrum_id":"CCMSLIB00017235119","spectrum_index":14820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzoic acid (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.04,"smiles":null,"spectrum_id":"CCMSLIB00017235122","spectrum_index":14821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 665.4145 Da; putative annotation: N/A; putative formula: C37H63NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.485,"smiles":null,"spectrum_id":"CCMSLIB00017235123","spectrum_index":14822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hederagenin (delta mass: 470.1285 Da; putative annotation: N/A; putative formula: C18H22N4O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.491,"smiles":null,"spectrum_id":"CCMSLIB00017235126","spectrum_index":14823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnan-3.alpha.,17,20.beta.,21-tetrol-11-one (delta mass: 158.0221 Da; putative annotation: N/A; putative formula: C7H10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.27,"smiles":null,"spectrum_id":"CCMSLIB00017235127","spectrum_index":14824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 180.0898 Da; putative annotation: N/A; putative formula: C9H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.171,"smiles":null,"spectrum_id":"CCMSLIB00017235130","spectrum_index":14825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 118.0784 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.29,"smiles":null,"spectrum_id":"CCMSLIB00017235131","spectrum_index":14826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 35.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017235134","spectrum_index":14827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 279.2559 Da; putative annotation: N/A; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.327,"smiles":null,"spectrum_id":"CCMSLIB00017235135","spectrum_index":14828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 594.5212 Da; putative annotation: N/A; putative formula: C34H62N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":871.737,"smiles":null,"spectrum_id":"CCMSLIB00017235136","spectrum_index":14829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 116.0629 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.311,"smiles":null,"spectrum_id":"CCMSLIB00017235139","spectrum_index":14830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 86.0536 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.281,"smiles":null,"spectrum_id":"CCMSLIB00017235140","spectrum_index":14831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-7,12-Dihydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 74.0517 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.258,"smiles":null,"spectrum_id":"CCMSLIB00017235143","spectrum_index":14832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,16-Dimethylprostaglandin D2 (delta mass: 31.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.306,"smiles":null,"spectrum_id":"CCMSLIB00017235144","spectrum_index":14833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 432.1212 Da; putative annotation: N/A; putative formula: C18H28N2O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.202,"smiles":null,"spectrum_id":"CCMSLIB00017235147","spectrum_index":14834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 43.0197 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.124,"smiles":null,"spectrum_id":"CCMSLIB00017235148","spectrum_index":14835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 227.2266 Da; putative annotation: N/A; putative formula: C14H29NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.48,"smiles":null,"spectrum_id":"CCMSLIB00017235151","spectrum_index":14836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 122.1092 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017235152","spectrum_index":14837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 73.0162 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.118,"smiles":null,"spectrum_id":"CCMSLIB00017235154","spectrum_index":14838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-((E)-2-((1R,2S,3R,5S)-3,5-Dihydroxy-2-((Z)-oct-2-enyl)cyclopentyl)vinyl)tetrahydro-2H-pyran-2-one (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.264,"smiles":null,"spectrum_id":"CCMSLIB00017235157","spectrum_index":14839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Retinoic acid (delta mass: 120.0932 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.309,"smiles":null,"spectrum_id":"CCMSLIB00017235159","spectrum_index":14840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperazinyl)acetamide (delta mass: 17.9269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.04,"smiles":null,"spectrum_id":"CCMSLIB00017235160","spectrum_index":14841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Fluorobenzoyl)-5-amino-1H-indole (delta mass: 301.1097 Da; putative annotation: N/A; putative formula: C12H19N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.203,"smiles":null,"spectrum_id":"CCMSLIB00017235163","spectrum_index":14842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 436.2586 Da; putative annotation: N/A; putative formula: C24H32N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.329,"smiles":null,"spectrum_id":"CCMSLIB00017235164","spectrum_index":14843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 75.0387 Da; putative annotation: N/A; putative formula: CH6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.302,"smiles":null,"spectrum_id":"CCMSLIB00017235167","spectrum_index":14844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 62.0171 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.265,"smiles":null,"spectrum_id":"CCMSLIB00017235168","spectrum_index":14845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.169,"smiles":null,"spectrum_id":"CCMSLIB00017235170","spectrum_index":14846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linalool oxide (delta mass: 235.142 Da; putative annotation: N/A; putative formula: C10H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.28,"smiles":null,"spectrum_id":"CCMSLIB00017235172","spectrum_index":14847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 68.0615 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.251,"smiles":null,"spectrum_id":"CCMSLIB00017235174","spectrum_index":14848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 41.9381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.17,"smiles":null,"spectrum_id":"CCMSLIB00017235176","spectrum_index":14849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 92.0625 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017235177","spectrum_index":14850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 11.0053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.144,"smiles":null,"spectrum_id":"CCMSLIB00017235180","spectrum_index":14851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 16.0407 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.118,"smiles":null,"spectrum_id":"CCMSLIB00017235181","spectrum_index":14852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 171.2043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.4,"smiles":null,"spectrum_id":"CCMSLIB00017235184","spectrum_index":14853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Atranol (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.066,"smiles":null,"spectrum_id":"CCMSLIB00017235186","spectrum_index":14854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 18.003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.126,"smiles":null,"spectrum_id":"CCMSLIB00017235188","spectrum_index":14855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetraethylene glycol monomethyl ether (delta mass: 185.214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.352,"smiles":null,"spectrum_id":"CCMSLIB00017235189","spectrum_index":14856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[(Dimethylamino)methyl]phenol (delta mass: 46.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.149,"smiles":null,"spectrum_id":"CCMSLIB00017235192","spectrum_index":14857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 176.0652 Da; putative annotation: N/A; putative formula: C3H8N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.176,"smiles":null,"spectrum_id":"CCMSLIB00017235193","spectrum_index":14858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrecyclic Acid (delta mass: 179.0796 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.228,"smiles":null,"spectrum_id":"CCMSLIB00017235196","spectrum_index":14859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-hydroxybutyl)-3,5,5-trimethylcyclohex-3-en-1-ol (delta mass: 248.0533 Da; putative annotation: N/A; putative formula: C9H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.238,"smiles":null,"spectrum_id":"CCMSLIB00017235197","spectrum_index":14860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etodolac (delta mass: 627.3564 Da; putative annotation: N/A; putative formula: C32H49N7O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.516,"smiles":null,"spectrum_id":"CCMSLIB00017235200","spectrum_index":14861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 215.0806 Da; putative annotation: N/A; putative formula: C10H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.182,"smiles":null,"spectrum_id":"CCMSLIB00017235201","spectrum_index":14862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 389.2791 Da; putative annotation: N/A; putative formula: C21H35N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.349,"smiles":null,"spectrum_id":"CCMSLIB00017235203","spectrum_index":14863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 408.1221 Da; putative annotation: N/A; putative formula: C24H16N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.203,"smiles":null,"spectrum_id":"CCMSLIB00017235205","spectrum_index":14864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lumisterol 3 (delta mass: 39.9635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.31,"smiles":null,"spectrum_id":"CCMSLIB00017235207","spectrum_index":14865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLIC ACID (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.055,"smiles":null,"spectrum_id":"CCMSLIB00017235209","spectrum_index":14866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 87.1049 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.359,"smiles":null,"spectrum_id":"CCMSLIB00017235211","spectrum_index":14867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Chlorophenyl)-1H-pyrazol-5-amine (delta mass: 60.018 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.066,"smiles":null,"spectrum_id":"CCMSLIB00017235213","spectrum_index":14868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347866-02!N-(7,8-dimethoxy-2-oxochromen-3-yl)-4a,5,8-trihydroxy-N-methyl-4,5,8,8a-tetrahydro-1,2-benzoxazine-3-carboxamide [IIN-based: Match] (delta mass: 104.0367 Da; putative annotation: N/A; putative formula: C6H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.177,"smiles":null,"spectrum_id":"CCMSLIB00017235215","spectrum_index":14869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Cyano-1,3-benzenedicarboxylic acid (delta mass: 245.0899 Da; putative annotation: N/A; putative formula: C10H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.119,"smiles":null,"spectrum_id":"CCMSLIB00017235217","spectrum_index":14870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.-Hydroxyandrosterone (delta mass: 63.9532 Da; putative annotation: N/A; putative formula: HPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.18,"smiles":null,"spectrum_id":"CCMSLIB00017235219","spectrum_index":14871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 86.0519 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.294,"smiles":null,"spectrum_id":"CCMSLIB00017235221","spectrum_index":14872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 88.0677 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.134,"smiles":null,"spectrum_id":"CCMSLIB00017235222","spectrum_index":14873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 88.0074 Da; putative annotation: N/A; putative formula: C3H5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.162,"smiles":null,"spectrum_id":"CCMSLIB00017235224","spectrum_index":14874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 223.0858 Da; putative annotation: N/A; putative formula: C12H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.161,"smiles":null,"spectrum_id":"CCMSLIB00017235226","spectrum_index":14875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 288.8461 Da; putative annotation: N/A; putative formula: C3H4N3O-1PS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.036,"smiles":null,"spectrum_id":"CCMSLIB00017235227","spectrum_index":14876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 140.1199 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.18,"smiles":null,"spectrum_id":"CCMSLIB00017235230","spectrum_index":14877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 25.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.113,"smiles":null,"spectrum_id":"CCMSLIB00017235231","spectrum_index":14878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 651.347 Da; putative annotation: N/A; putative formula: C36H45N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1002.6,"smiles":null,"spectrum_id":"CCMSLIB00017235234","spectrum_index":14879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Acetyl-1-piperazinyl)-3-methylaniline (delta mass: 163.0254 Da; putative annotation: N/A; putative formula: C2H6N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.185,"smiles":null,"spectrum_id":"CCMSLIB00017235235","spectrum_index":14880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 117.044 Da; putative annotation: N/A; putative formula: C5H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.22,"smiles":null,"spectrum_id":"CCMSLIB00017235238","spectrum_index":14881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 163.0368 Da; putative annotation: N/A; putative formula: C3HN9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.112,"smiles":null,"spectrum_id":"CCMSLIB00017235239","spectrum_index":14882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU275701 Labetalol|2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide (delta mass: 36.0108 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.197,"smiles":null,"spectrum_id":"CCMSLIB00017235242","spectrum_index":14883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 327.0534 Da; putative annotation: N/A; putative formula: C13H17N3OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.134,"smiles":null,"spectrum_id":"CCMSLIB00017235244","spectrum_index":14884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 43.9899 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.185,"smiles":null,"spectrum_id":"CCMSLIB00017235246","spectrum_index":14885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 130.136 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017235247","spectrum_index":14886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 140.9217 Da; putative annotation: N/A; putative formula: H3NP4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.999,"smiles":null,"spectrum_id":"CCMSLIB00017235250","spectrum_index":14887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 109.0733 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.347,"smiles":null,"spectrum_id":"CCMSLIB00017235251","spectrum_index":14888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 222.0735 Da; putative annotation: N/A; putative formula: C8H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.29,"smiles":null,"spectrum_id":"CCMSLIB00017235254","spectrum_index":14889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-(-)-Nopol CollisionEnergy:102040 (delta mass: 307.1996 Da; putative annotation: N/A; putative formula: C14H29NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.343,"smiles":null,"spectrum_id":"CCMSLIB00017235255","spectrum_index":14890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 113.163 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.185,"smiles":null,"spectrum_id":"CCMSLIB00017235257","spectrum_index":14891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 63.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.296,"smiles":null,"spectrum_id":"CCMSLIB00017235259","spectrum_index":14892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 160.0744 Da; putative annotation: N/A; putative formula: C8H16O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.213,"smiles":null,"spectrum_id":"CCMSLIB00017235261","spectrum_index":14893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 239.0828 Da; putative annotation: N/A; putative formula: C8H17NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.257,"smiles":null,"spectrum_id":"CCMSLIB00017235263","spectrum_index":14894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phytosphingosine from NIST14 (delta mass: 364.33 Da; putative annotation: N/A; putative formula: C20H40N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.63,"smiles":null,"spectrum_id":"CCMSLIB00017235266","spectrum_index":14895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 17.038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.362,"smiles":null,"spectrum_id":"CCMSLIB00017235267","spectrum_index":14896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 54.0089 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.189,"smiles":null,"spectrum_id":"CCMSLIB00017235270","spectrum_index":14897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic JBIR 27 (delta mass: 106.0778 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.242,"smiles":null,"spectrum_id":"CCMSLIB00017235271","spectrum_index":14898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 108.0936 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.378,"smiles":null,"spectrum_id":"CCMSLIB00017235274","spectrum_index":14899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 411.2827 Da; putative annotation: N/A; putative formula: C24H37N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.343,"smiles":null,"spectrum_id":"CCMSLIB00017235275","spectrum_index":14900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 31.9893 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.169,"smiles":null,"spectrum_id":"CCMSLIB00017235278","spectrum_index":14901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 686.9839 Da; putative annotation: N/A; putative formula: C19H21N3O17P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":909.081,"smiles":null,"spectrum_id":"CCMSLIB00017235281","spectrum_index":14902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 762.9947 Da; putative annotation: N/A; putative formula: C27H21N7O10S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":985.092,"smiles":null,"spectrum_id":"CCMSLIB00017235282","spectrum_index":14903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 46.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.123,"smiles":null,"spectrum_id":"CCMSLIB00017235283","spectrum_index":14904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYRINGIC ACID CollisionEnergy:102040 (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.071,"smiles":null,"spectrum_id":"CCMSLIB00017235286","spectrum_index":14905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 52.0294 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.142,"smiles":null,"spectrum_id":"CCMSLIB00017235287","spectrum_index":14906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jacquinelin (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017235290","spectrum_index":14907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 706.4296 Da; putative annotation: N/A; putative formula: C39H62O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":887.5,"smiles":null,"spectrum_id":"CCMSLIB00017235292","spectrum_index":14908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 737.4725 Da; putative annotation: N/A; putative formula: C41H63N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":918.543,"smiles":null,"spectrum_id":"CCMSLIB00017235294","spectrum_index":14909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monoelaidin from NIST14 (delta mass: 213.1361 Da; putative annotation: N/A; putative formula: C11H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.436,"smiles":null,"spectrum_id":"CCMSLIB00017235296","spectrum_index":14910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 450.0608 Da; putative annotation: N/A; putative formula: C25H14N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.152,"smiles":null,"spectrum_id":"CCMSLIB00017235298","spectrum_index":14911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 521.4356 Da; putative annotation: N/A; putative formula: C32H60NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.506,"smiles":null,"spectrum_id":"CCMSLIB00017235300","spectrum_index":14912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 349.2099 Da; putative annotation: N/A; putative formula: C16H31NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.426,"smiles":null,"spectrum_id":"CCMSLIB00017235302","spectrum_index":14913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 64.0271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.166,"smiles":null,"spectrum_id":"CCMSLIB00017235304","spectrum_index":14914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 29.9561 Da; putative annotation: N/A; putative formula: C15H24N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.162,"smiles":null,"spectrum_id":"CCMSLIB00017235306","spectrum_index":14915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bonactin (delta mass: 76.0665 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.32,"smiles":null,"spectrum_id":"CCMSLIB00017235309","spectrum_index":14916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxopimara-8(14),15-dien-20-oic acid (delta mass: 100.0665 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.278,"smiles":null,"spectrum_id":"CCMSLIB00017235311","spectrum_index":14917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4S,5S,6R)-2-[[7-hydroxy-4-[(Z)-5-hydroxy-3-methylpent-3-enyl]-4a,8,8-trimethyl-3-methylidene-2,4,5,6,7,8a-hexahydro-1H-naphthalen-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 102.0819 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.393,"smiles":null,"spectrum_id":"CCMSLIB00017235313","spectrum_index":14918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S-Carboxymethyl-L-cysteine CollisionEnergy:102040 (delta mass: 102.0157 Da; putative annotation: N/A; putative formula: C4H8O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.048,"smiles":null,"spectrum_id":"CCMSLIB00017235315","spectrum_index":14919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 57.0796 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.175,"smiles":null,"spectrum_id":"CCMSLIB00017235317","spectrum_index":14920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HYDROXYPHENYLLACTIC ACID (delta mass: 23.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.103,"smiles":null,"spectrum_id":"CCMSLIB00017235319","spectrum_index":14921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-CA (delta mass: 45.0596 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.386,"smiles":null,"spectrum_id":"CCMSLIB00017235322","spectrum_index":14922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Fluorobenzyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 135.056 Da; putative annotation: N/A; putative formula: C3H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.149,"smiles":null,"spectrum_id":"CCMSLIB00017235324","spectrum_index":14923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ticarcillin (delta mass: 310.0912 Da; putative annotation: N/A; putative formula: C12H14N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.143,"smiles":null,"spectrum_id":"CCMSLIB00017235326","spectrum_index":14924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-8,11,14-Eicosatrienoic acid from NIST14 (delta mass: 72.0419 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.305,"smiles":null,"spectrum_id":"CCMSLIB00017235328","spectrum_index":14925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 233.1146 Da; putative annotation: N/A; putative formula: C8H11N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.196,"smiles":null,"spectrum_id":"CCMSLIB00017235330","spectrum_index":14926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 311.1396 Da; putative annotation: N/A; putative formula: C14H22N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.221,"smiles":null,"spectrum_id":"CCMSLIB00017235332","spectrum_index":14927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 24.0352 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.111,"smiles":null,"spectrum_id":"CCMSLIB00017235334","spectrum_index":14928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 155.09 Da; putative annotation: N/A; putative formula: C4H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.223,"smiles":null,"spectrum_id":"CCMSLIB00017235336","spectrum_index":14929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.295,"smiles":null,"spectrum_id":"CCMSLIB00017235338","spectrum_index":14930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 297.289 Da; putative annotation: N/A; putative formula: C16H35N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.356,"smiles":null,"spectrum_id":"CCMSLIB00017235339","spectrum_index":14931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 43.9995 Da; putative annotation: N/A; putative formula: N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.972,"smiles":null,"spectrum_id":"CCMSLIB00017235342","spectrum_index":14932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 90.0833 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.294,"smiles":null,"spectrum_id":"CCMSLIB00017235343","spectrum_index":14933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 50.0522 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.284,"smiles":null,"spectrum_id":"CCMSLIB00017235346","spectrum_index":14934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 63.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.353,"smiles":null,"spectrum_id":"CCMSLIB00017235347","spectrum_index":14935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7-Triazacyclononane (delta mass: 145.1213 Da; putative annotation: N/A; putative formula: C6H15N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.255,"smiles":null,"spectrum_id":"CCMSLIB00017235350","spectrum_index":14936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 129.0182 Da; putative annotation: N/A; putative formula: C4H-1N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.1,"smiles":null,"spectrum_id":"CCMSLIB00017235351","spectrum_index":14937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 39.9772 Da; putative annotation: N/A; putative formula: C2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.064,"smiles":null,"spectrum_id":"CCMSLIB00017235354","spectrum_index":14938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000102 5-hydroxyculmorin|(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol (delta mass: 179.0799 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.275,"smiles":null,"spectrum_id":"CCMSLIB00017235355","spectrum_index":14939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [3-(Acetylamino)phenoxy]acetic acid (delta mass: 32.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.103,"smiles":null,"spectrum_id":"CCMSLIB00017235358","spectrum_index":14940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Tropic acid from NIST14 (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017235359","spectrum_index":14941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 191.1153 Da; putative annotation: N/A; putative formula: C8H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.149,"smiles":null,"spectrum_id":"CCMSLIB00017235362","spectrum_index":14942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 161.0434 Da; putative annotation: N/A; putative formula: C4H7N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.275,"smiles":null,"spectrum_id":"CCMSLIB00017235363","spectrum_index":14943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 198.988 Da; putative annotation: N/A; putative formula: C3H6NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.126,"smiles":null,"spectrum_id":"CCMSLIB00017235366","spectrum_index":14944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 130.1151 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.373,"smiles":null,"spectrum_id":"CCMSLIB00017235367","spectrum_index":14945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 147.065 Da; putative annotation: N/A; putative formula: C4H9N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.167,"smiles":null,"spectrum_id":"CCMSLIB00017235370","spectrum_index":14946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [3-Ethoxy-4-(ethoxycarbonyl)phenyl]acetic acid (delta mass: 14.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.159,"smiles":null,"spectrum_id":"CCMSLIB00017235371","spectrum_index":14947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthro[3,2-b]furan-9(1H)-one, 2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro-6,10a-dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl- (delta mass: 73.0891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.306,"smiles":null,"spectrum_id":"CCMSLIB00017235373","spectrum_index":14948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 437.3022 Da; putative annotation: N/A; putative formula: C20H44N3O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.388,"smiles":null,"spectrum_id":"CCMSLIB00017235375","spectrum_index":14949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.091,"smiles":null,"spectrum_id":"CCMSLIB00017235378","spectrum_index":14950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 66.0868 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.21,"smiles":null,"spectrum_id":"CCMSLIB00017235379","spectrum_index":14951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 190.0991 Da; putative annotation: N/A; putative formula: C12H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.149,"smiles":null,"spectrum_id":"CCMSLIB00017235381","spectrum_index":14952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 94.0415 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.164,"smiles":null,"spectrum_id":"CCMSLIB00017235383","spectrum_index":14953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 92.0471 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.3,"smiles":null,"spectrum_id":"CCMSLIB00017235386","spectrum_index":14954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 507.3947 Da; putative annotation: N/A; putative formula: C29H54N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.538,"smiles":null,"spectrum_id":"CCMSLIB00017235387","spectrum_index":14955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 310.2761 Da; putative annotation: N/A; putative formula: C22H34N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":903.552,"smiles":null,"spectrum_id":"CCMSLIB00017235390","spectrum_index":14956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 207.126 Da; putative annotation: N/A; putative formula: C12H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.191,"smiles":null,"spectrum_id":"CCMSLIB00017235391","spectrum_index":14957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 212.0688 Da; putative annotation: N/A; putative formula: C10H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.166,"smiles":null,"spectrum_id":"CCMSLIB00017235394","spectrum_index":14958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 64.0711 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.324,"smiles":null,"spectrum_id":"CCMSLIB00017235395","spectrum_index":14959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 235.1783 Da; putative annotation: N/A; putative formula: C6H22N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.238,"smiles":null,"spectrum_id":"CCMSLIB00017235398","spectrum_index":14960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.362,"smiles":null,"spectrum_id":"CCMSLIB00017235399","spectrum_index":14961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid (delta mass: 78.0736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.426,"smiles":null,"spectrum_id":"CCMSLIB00017235402","spectrum_index":14962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 36.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017235403","spectrum_index":14963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Camalexin (delta mass: 90.0575 Da; putative annotation: N/A; putative formula: C6H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.106,"smiles":null,"spectrum_id":"CCMSLIB00017235406","spectrum_index":14964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 71.0368 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017235407","spectrum_index":14965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (1S,4R)-p-Mentha-2,8-dien-1-ol from METLIN (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.154,"smiles":null,"spectrum_id":"CCMSLIB00017235410","spectrum_index":14966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 123.0885 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.352,"smiles":null,"spectrum_id":"CCMSLIB00017235411","spectrum_index":14967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl syringate (delta mass: 17.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.154,"smiles":null,"spectrum_id":"CCMSLIB00017235414","spectrum_index":14968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-1H-indole-5-carbonitrile (delta mass: 17.0145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.07,"smiles":null,"spectrum_id":"CCMSLIB00017235415","spectrum_index":14969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 305.2733 Da; putative annotation: N/A; putative formula: C20H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.516,"smiles":null,"spectrum_id":"CCMSLIB00017235418","spectrum_index":14970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 43.099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.179,"smiles":null,"spectrum_id":"CCMSLIB00017235419","spectrum_index":14971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidine (delta mass: 40.9724 Da; putative annotation: N/A; putative formula: C16H23N7O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.153,"smiles":null,"spectrum_id":"CCMSLIB00017235422","spectrum_index":14972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Obtusifolin (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.086,"smiles":null,"spectrum_id":"CCMSLIB00017235423","spectrum_index":14973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 227.2221 Da; putative annotation: N/A; putative formula: C10H25N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.605,"smiles":null,"spectrum_id":"CCMSLIB00017235426","spectrum_index":14974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 130.0993 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.347,"smiles":null,"spectrum_id":"CCMSLIB00017235427","spectrum_index":14975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 207.1105 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.176,"smiles":null,"spectrum_id":"CCMSLIB00017235430","spectrum_index":14976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4'-Hydroxychalcone (delta mass: 38.0155 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.107,"smiles":null,"spectrum_id":"CCMSLIB00017235431","spectrum_index":14977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-5Z,9E,11Z,14Z,17Z-eicosapentaenoic acid (delta mass: 46.0074 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.234,"smiles":null,"spectrum_id":"CCMSLIB00017235432","spectrum_index":14978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cephalotaxine (delta mass: 132.0532 Da; putative annotation: N/A; putative formula: C4H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.207,"smiles":null,"spectrum_id":"CCMSLIB00017235435","spectrum_index":14979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 76.0676 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.373,"smiles":null,"spectrum_id":"CCMSLIB00017235436","spectrum_index":14980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Bis(p-(2-hydroxyethoxycarbonyl)benzoyloxy)ethane (delta mass: 105.0755 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.204,"smiles":null,"spectrum_id":"CCMSLIB00017235439","spectrum_index":14981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 40.0321 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.082,"smiles":null,"spectrum_id":"CCMSLIB00017235440","spectrum_index":14982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 55.0559 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.154,"smiles":null,"spectrum_id":"CCMSLIB00017235442","spectrum_index":14983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 42.0203 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.128,"smiles":null,"spectrum_id":"CCMSLIB00017235444","spectrum_index":14984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 387.2314 Da; putative annotation: N/A; putative formula: C17H35N5OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.479,"smiles":null,"spectrum_id":"CCMSLIB00017235446","spectrum_index":14985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Guanidine, N-(4-fluorophenyl)-N'-hydroxy- (delta mass: 99.0156 Da; putative annotation: N/A; putative formula: C4H5NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.088,"smiles":null,"spectrum_id":"CCMSLIB00017235447","spectrum_index":14986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 79.9978 Da; putative annotation: N/A; putative formula: C3N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017235450","spectrum_index":14987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 753.7914 Da; putative annotation: N/A; putative formula: C19H30O-1S16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":963.94,"smiles":null,"spectrum_id":"CCMSLIB00017235451","spectrum_index":14988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 17.0248 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.148,"smiles":null,"spectrum_id":"CCMSLIB00017235454","spectrum_index":14989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4H-Pyrrolo[3,2-c]pyridin-4-one, 1,5,6,7-tetrahydro-2-[2-(3-quinolinyl)-4-pyridinyl]- (delta mass: 16.0031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.143,"smiles":null,"spectrum_id":"CCMSLIB00017235455","spectrum_index":14990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethylpiperazine (delta mass: 44.027 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.15,"smiles":null,"spectrum_id":"CCMSLIB00017235458","spectrum_index":14991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 45.0231 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.084,"smiles":null,"spectrum_id":"CCMSLIB00017235459","spectrum_index":14992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cephalexin (delta mass: 523.127 Da; putative annotation: N/A; putative formula: C23H29N3O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":871.228,"smiles":null,"spectrum_id":"CCMSLIB00017235462","spectrum_index":14993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 371.1931 Da; putative annotation: N/A; putative formula: C15H21N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.237,"smiles":null,"spectrum_id":"CCMSLIB00017235463","spectrum_index":14994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 56.0618 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.33,"smiles":null,"spectrum_id":"CCMSLIB00017235465","spectrum_index":14995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,19-Dihydroxy-3-oxo-12-ursen-28-oic acid (delta mass: 112.0627 Da; putative annotation: N/A; putative formula: C5H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.404,"smiles":null,"spectrum_id":"CCMSLIB00017235467","spectrum_index":14996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 278.2251 Da; putative annotation: (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.462,"smiles":null,"spectrum_id":"CCMSLIB00017235469","spectrum_index":14997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 144.0308 Da; putative annotation: 1H-Benzimidazole-2-carboxylic acid; putative formula: C8H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.081,"smiles":null,"spectrum_id":"CCMSLIB00017235471","spectrum_index":14998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(.beta.-D-Glucopyranosyloxy)-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid (delta mass: 180.0791 Da; putative annotation: Modiolide A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.228,"smiles":null,"spectrum_id":"CCMSLIB00017235473","spectrum_index":14999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 134.048 Da; putative annotation: 2-Methyl-4-nitroaniline; putative formula: C7H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.113,"smiles":null,"spectrum_id":"CCMSLIB00017235475","spectrum_index":15000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 94.041 Da; putative annotation: Hex-3-ynoic acid; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.111,"smiles":null,"spectrum_id":"CCMSLIB00017235477","spectrum_index":15001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 374.2755 Da; putative annotation: Hyodeoxycholic acid; putative formula: C24H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.565,"smiles":null,"spectrum_id":"CCMSLIB00017235478","spectrum_index":15002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 278.131 Da; putative annotation: 4-Hydroxycyclofenil; putative formula: C19H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.29,"smiles":null,"spectrum_id":"CCMSLIB00017235481","spectrum_index":15003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 286.2149 Da; putative annotation: Aleuritic acid; putative formula: C16H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.462,"smiles":null,"spectrum_id":"CCMSLIB00017235482","spectrum_index":15004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 163.0634 Da; putative annotation: DL-o-Tyrosine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.16,"smiles":null,"spectrum_id":"CCMSLIB00017235485","spectrum_index":15005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 322.0688 Da; putative annotation: ESCULIN; putative formula: C15H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.129,"smiles":null,"spectrum_id":"CCMSLIB00017235486","spectrum_index":15006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 238.193 Da; putative annotation: 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol; putative formula: C15H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.394,"smiles":null,"spectrum_id":"CCMSLIB00017235489","spectrum_index":15007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 175.0482 Da; putative annotation: S-(2-Boronoethyl)-L-cysteine; putative formula: C5H10BNO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.134,"smiles":null,"spectrum_id":"CCMSLIB00017235490","spectrum_index":15008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monoelaidin from NIST14 (delta mass: 264.2445 Da; putative annotation: Oleic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.544,"smiles":null,"spectrum_id":"CCMSLIB00017235493","spectrum_index":15009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 331.2702 Da; putative annotation: Arachidonoyl-2'-fluoroethylamide; putative formula: C22H34FN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.513,"smiles":null,"spectrum_id":"CCMSLIB00017235494","spectrum_index":15010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 311.0993 Da; putative annotation: (2Z)-((4R,5S,6S)-6-(.beta.-D-Glucopyranosyloxy)-4,5-dihydroxycyclohex-2-en-1-ylidene)acetonitrile; putative formula: C14H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.17,"smiles":null,"spectrum_id":"CCMSLIB00017235496","spectrum_index":15011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dioleoyl-sn-glycerol (delta mass: 332.2762 Da; putative annotation: 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate; putative formula: C22H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":953.821,"smiles":null,"spectrum_id":"CCMSLIB00017235498","spectrum_index":15012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 236.142 Da; putative annotation: 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel-; putative formula: C14H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.332,"smiles":null,"spectrum_id":"CCMSLIB00017235500","spectrum_index":15013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 293.2354 Da; putative annotation: Gly-C16:1; putative formula: C18H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.504,"smiles":null,"spectrum_id":"CCMSLIB00017235502","spectrum_index":15014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 244.0349 Da; putative annotation: Sorbitol-6-phosphate; putative formula: C6H13O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.121,"smiles":null,"spectrum_id":"CCMSLIB00017235504","spectrum_index":15015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 363.2597 Da; putative annotation: D-erythro-Sphinganine-1-phosphate; putative formula: C18H38NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.481,"smiles":null,"spectrum_id":"CCMSLIB00017235506","spectrum_index":15016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomopsidin (delta mass: 222.1995 Da; putative annotation: NCGC00385844-01_C15H28O2_7-(2-Hydroxy-2-propanyl)-1,4a-dimethyldecahydro-1-naphthalenol; putative formula: C15H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.426,"smiles":null,"spectrum_id":"CCMSLIB00017235508","spectrum_index":15017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 271.1419 Da; putative annotation: 3-Methylglutarylcarnitine; putative formula: C13H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.202,"smiles":null,"spectrum_id":"CCMSLIB00017235510","spectrum_index":15018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-1,4-diazepane (delta mass: 143.104 Da; putative annotation: N/A; putative formula: C2H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.222,"smiles":null,"spectrum_id":"CCMSLIB00017235512","spectrum_index":15019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 491.3975 Da; putative annotation: N/A; putative formula: C30H53NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.65,"smiles":null,"spectrum_id":"CCMSLIB00017235514","spectrum_index":15020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 598.2672 Da; putative annotation: N/A; putative formula: C27H42N4O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.354,"smiles":null,"spectrum_id":"CCMSLIB00017235516","spectrum_index":15021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017235518","spectrum_index":15022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homogentisic acid (delta mass: 120.0422 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.092,"smiles":null,"spectrum_id":"CCMSLIB00017235520","spectrum_index":15023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 68.062 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.289,"smiles":null,"spectrum_id":"CCMSLIB00017235522","spectrum_index":15024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 21.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.065,"smiles":null,"spectrum_id":"CCMSLIB00017235524","spectrum_index":15025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dexrazoxane (delta mass: 51.0477 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.172,"smiles":null,"spectrum_id":"CCMSLIB00017235526","spectrum_index":15026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 53.0487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.187,"smiles":null,"spectrum_id":"CCMSLIB00017235528","spectrum_index":15027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 154.049 Da; putative annotation: N/A; putative formula: C5H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.198,"smiles":null,"spectrum_id":"CCMSLIB00017235530","spectrum_index":15028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paprotrain (delta mass: 18.0031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.106,"smiles":null,"spectrum_id":"CCMSLIB00017235532","spectrum_index":15029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYBENZOIC ACID (delta mass: 126.0673 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.106,"smiles":null,"spectrum_id":"CCMSLIB00017235534","spectrum_index":15030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Gln (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.156,"smiles":null,"spectrum_id":"CCMSLIB00017235536","spectrum_index":15031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14(15)-Epoxy-5Z,8Z,11Z,17Z-eicosatetraenoic acid (delta mass: 48.0365 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.263,"smiles":null,"spectrum_id":"CCMSLIB00017235538","spectrum_index":15032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amoxicillin - 40.0 eV (delta mass: 102.069 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.181,"smiles":null,"spectrum_id":"CCMSLIB00017235540","spectrum_index":15033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 11.0412 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.122,"smiles":null,"spectrum_id":"CCMSLIB00017235542","spectrum_index":15034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheptanol (delta mass: 46.0051 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.117,"smiles":null,"spectrum_id":"CCMSLIB00017235544","spectrum_index":15035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 98.0346 Da; putative annotation: N/A; putative formula: CH2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.11,"smiles":null,"spectrum_id":"CCMSLIB00017235546","spectrum_index":15036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-C11:0 (delta mass: 52.0673 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.284,"smiles":null,"spectrum_id":"CCMSLIB00017235548","spectrum_index":15037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetic acid methyl ester (delta mass: 31.9878 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.35,"smiles":null,"spectrum_id":"CCMSLIB00017235550","spectrum_index":15038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 88.0527 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.264,"smiles":null,"spectrum_id":"CCMSLIB00017235553","spectrum_index":15039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7,3'-Trihydroxyflavone (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.071,"smiles":null,"spectrum_id":"CCMSLIB00017235554","spectrum_index":15040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 46.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.238,"smiles":null,"spectrum_id":"CCMSLIB00017235557","spectrum_index":15041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.07,"smiles":null,"spectrum_id":"CCMSLIB00017235558","spectrum_index":15042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one (delta mass: 23.0089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.102,"smiles":null,"spectrum_id":"CCMSLIB00017235561","spectrum_index":15043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 64.0673 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.341,"smiles":null,"spectrum_id":"CCMSLIB00017235562","spectrum_index":15044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)propanamide (delta mass: 59.0484 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.182,"smiles":null,"spectrum_id":"CCMSLIB00017235564","spectrum_index":15045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-(5-Fluoropentyl)-1H-indazole-3-carbonyl)-L-valine (delta mass: 18.0196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.207,"smiles":null,"spectrum_id":"CCMSLIB00017235566","spectrum_index":15046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyisophthalic acid (delta mass: 5.989 Da; putative annotation: N/A; putative formula: C2H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.018,"smiles":null,"spectrum_id":"CCMSLIB00017235568","spectrum_index":15047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 633.3889 Da; putative annotation: N/A; putative formula: C36H51N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.518,"smiles":null,"spectrum_id":"CCMSLIB00017235570","spectrum_index":15048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380727-01_C23H32O6_(4R,4aS,8aS)-1-Hydroxy-2-(hydroxymethyl)-5,5,8a-trimethyl-4-[(2E,4E,6E)-2,4,6-octatrienoyloxy]-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenecarboxylic acid (delta mass: 469.2495 Da; putative annotation: N/A; putative formula: C26H36N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.477,"smiles":null,"spectrum_id":"CCMSLIB00017235571","spectrum_index":15049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 298.6373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.709,"smiles":null,"spectrum_id":"CCMSLIB00017235574","spectrum_index":15050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 2.0156 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":116.107,"smiles":null,"spectrum_id":"CCMSLIB00017235575","spectrum_index":15051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 38.0153 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.268,"smiles":null,"spectrum_id":"CCMSLIB00017235578","spectrum_index":15052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 575.2027 Da; putative annotation: N/A; putative formula: C30H33N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.263,"smiles":null,"spectrum_id":"CCMSLIB00017235579","spectrum_index":15053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 386.1392 Da; putative annotation: N/A; putative formula: C23H14N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.18,"smiles":null,"spectrum_id":"CCMSLIB00017235582","spectrum_index":15054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 242.1273 Da; putative annotation: N/A; putative formula: C12H22N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.177,"smiles":null,"spectrum_id":"CCMSLIB00017235583","spectrum_index":15055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 231.1883 Da; putative annotation: N/A; putative formula: C10H25N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.41,"smiles":null,"spectrum_id":"CCMSLIB00017235586","spectrum_index":15056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-((3R)-3-((3R,5S,7R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)butanamido)ethane-1-sulfonic acid\"\" (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.31,"smiles":null,"spectrum_id":"CCMSLIB00017235587","spectrum_index":15057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 112.016 Da; putative annotation: N/A; putative formula: C5H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.123,"smiles":null,"spectrum_id":"CCMSLIB00017235588","spectrum_index":15058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 77.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.134,"smiles":null,"spectrum_id":"CCMSLIB00017235591","spectrum_index":15059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Azaspiro[4.5]decane-1,3-dione (delta mass: 257.1883 Da; putative annotation: N/A; putative formula: C16H23N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.29,"smiles":null,"spectrum_id":"CCMSLIB00017235592","spectrum_index":15060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 339.2158 Da; putative annotation: N/A; putative formula: C17H29N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.312,"smiles":null,"spectrum_id":"CCMSLIB00017235595","spectrum_index":15061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 132.0543 Da; putative annotation: N/A; putative formula: C5H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.156,"smiles":null,"spectrum_id":"CCMSLIB00017235596","spectrum_index":15062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 781.5512 Da; putative annotation: N/A; putative formula: C48H71N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1088.81,"smiles":null,"spectrum_id":"CCMSLIB00017235597","spectrum_index":15063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084606 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 115.0379 Da; putative annotation: N/A; putative formula: C3H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.092,"smiles":null,"spectrum_id":"CCMSLIB00017235600","spectrum_index":15064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 240.1476 Da; putative annotation: N/A; putative formula: C12H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.286,"smiles":null,"spectrum_id":"CCMSLIB00017235601","spectrum_index":15065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 114.083 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.11,"smiles":null,"spectrum_id":"CCMSLIB00017235604","spectrum_index":15066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[3-[3-Hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxyphenyl]-5-oxo-2H-furan-2-yl]acetic acid (delta mass: 162.0546 Da; putative annotation: N/A; putative formula: H6N10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.162,"smiles":null,"spectrum_id":"CCMSLIB00017235605","spectrum_index":15067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 243.1318 Da; putative annotation: N/A; putative formula: C11H22N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.364,"smiles":null,"spectrum_id":"CCMSLIB00017235608","spectrum_index":15068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 158.0208 Da; putative annotation: N/A; putative formula: C3H-2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.373,"smiles":null,"spectrum_id":"CCMSLIB00017235609","spectrum_index":15069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 112.1003 Da; putative annotation: N/A; putative formula: C6H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.249,"smiles":null,"spectrum_id":"CCMSLIB00017235612","spectrum_index":15070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Talatisamine (delta mass: 76.0681 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.358,"smiles":null,"spectrum_id":"CCMSLIB00017235613","spectrum_index":15071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 60.035 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.288,"smiles":null,"spectrum_id":"CCMSLIB00017235614","spectrum_index":15072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 94.0773 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.283,"smiles":null,"spectrum_id":"CCMSLIB00017235617","spectrum_index":15073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 60.9101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.012,"smiles":null,"spectrum_id":"CCMSLIB00017235618","spectrum_index":15074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 95.0365 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.138,"smiles":null,"spectrum_id":"CCMSLIB00017235621","spectrum_index":15075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 24.2545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.5,"smiles":null,"spectrum_id":"CCMSLIB00017235622","spectrum_index":15076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid; AIF: CE0; MS2Dec (delta mass: 198.1257 Da; putative annotation: N/A; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.196,"smiles":null,"spectrum_id":"CCMSLIB00017235625","spectrum_index":15077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 57.0487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.171,"smiles":null,"spectrum_id":"CCMSLIB00017235626","spectrum_index":15078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyphenylacetic acid (delta mass: 40.0098 Da; putative annotation: N/A; putative formula: CN2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.064,"smiles":null,"spectrum_id":"CCMSLIB00017235627","spectrum_index":15079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 1.9332 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.009,"smiles":null,"spectrum_id":"CCMSLIB00017235630","spectrum_index":15080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 299.137 Da; putative annotation: N/A; putative formula: C14H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.197,"smiles":null,"spectrum_id":"CCMSLIB00017235631","spectrum_index":15081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 58.0781 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.122,"smiles":null,"spectrum_id":"CCMSLIB00017235634","spectrum_index":15082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethyl L-glutamate (delta mass: 157.0853 Da; putative annotation: N/A; putative formula: C6H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.208,"smiles":null,"spectrum_id":"CCMSLIB00017235635","spectrum_index":15083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 131.0578 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.133,"smiles":null,"spectrum_id":"CCMSLIB00017235638","spectrum_index":15084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 58.0357 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.32,"smiles":null,"spectrum_id":"CCMSLIB00017235639","spectrum_index":15085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 280.1489 Da; putative annotation: N/A; putative formula: C18H21N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.283,"smiles":null,"spectrum_id":"CCMSLIB00017235642","spectrum_index":15086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 112.0634 Da; putative annotation: N/A; putative formula: C5H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.306,"smiles":null,"spectrum_id":"CCMSLIB00017235643","spectrum_index":15087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 86.028 Da; putative annotation: N/A; putative formula: C4H7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.063,"smiles":null,"spectrum_id":"CCMSLIB00017235645","spectrum_index":15088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 628.2409 Da; putative annotation: N/A; putative formula: C27H48O10S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":969.396,"smiles":null,"spectrum_id":"CCMSLIB00017235647","spectrum_index":15089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 351.1537 Da; putative annotation: N/A; putative formula: C15H29NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.255,"smiles":null,"spectrum_id":"CCMSLIB00017235648","spectrum_index":15090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corticosterone (delta mass: 35.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.258,"smiles":null,"spectrum_id":"CCMSLIB00017235651","spectrum_index":15091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 101.0473 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017235652","spectrum_index":15092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 88.0523 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.091,"smiles":null,"spectrum_id":"CCMSLIB00017235655","spectrum_index":15093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 122.0372 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.087,"smiles":null,"spectrum_id":"CCMSLIB00017235656","spectrum_index":15094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381346-01!3-(2,4-dihydroxypentyl)-8-hydroxy-6-methoxyisochromen-1-one [IIN-based: Match] (delta mass: 80.0967 Da; putative annotation: N/A; putative formula: C7H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.214,"smiles":null,"spectrum_id":"CCMSLIB00017235658","spectrum_index":15095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6S)-2-methyl-6-[(3Z)-pentadec-3-en-1-yl]piperidine (delta mass: 16.9422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.273,"smiles":null,"spectrum_id":"CCMSLIB00017235660","spectrum_index":15096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 98.0006 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.108,"smiles":null,"spectrum_id":"CCMSLIB00017235662","spectrum_index":15097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 327.1692 Da; putative annotation: N/A; putative formula: C17H29NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.266,"smiles":null,"spectrum_id":"CCMSLIB00017235664","spectrum_index":15098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 193.1284 Da; putative annotation: N/A; putative formula: C15H15NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.204,"smiles":null,"spectrum_id":"CCMSLIB00017235666","spectrum_index":15099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 59.0523 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.117,"smiles":null,"spectrum_id":"CCMSLIB00017235668","spectrum_index":15100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gummosin (delta mass: 152.0503 Da; putative annotation: N/A; putative formula: C7H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.272,"smiles":null,"spectrum_id":"CCMSLIB00017235670","spectrum_index":15101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Dehydroretinol (delta mass: 239.0988 Da; putative annotation: N/A; putative formula: C12H19NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.32,"smiles":null,"spectrum_id":"CCMSLIB00017235672","spectrum_index":15102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180305-02! [IIN-based on: CCMSLIB00000847888] (delta mass: 78.0121 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.156,"smiles":null,"spectrum_id":"CCMSLIB00017235675","spectrum_index":15103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Physodone (delta mass: 852.3953 Da; putative annotation: N/A; putative formula: C40H56N10O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1279.61,"smiles":null,"spectrum_id":"CCMSLIB00017235677","spectrum_index":15104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-[(5Z)-pentadec-5-en-1-yl]piperidine (delta mass: 101.0468 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.378,"smiles":null,"spectrum_id":"CCMSLIB00017235679","spectrum_index":15105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 265.2041 Da; putative annotation: N/A; putative formula: C16H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.488,"smiles":null,"spectrum_id":"CCMSLIB00017235681","spectrum_index":15106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(4-Chlorophenyl)-5-nitro-2-piperidinone (delta mass: 14.0151 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.068,"smiles":null,"spectrum_id":"CCMSLIB00017235683","spectrum_index":15107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 247.2786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.344,"smiles":null,"spectrum_id":"CCMSLIB00017235685","spectrum_index":15108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythine (delta mass: 135.9568 Da; putative annotation: N/A; putative formula: C3H5PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.07,"smiles":null,"spectrum_id":"CCMSLIB00017235687","spectrum_index":15109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 113.0837 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.181,"smiles":null,"spectrum_id":"CCMSLIB00017235689","spectrum_index":15110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 108.0407 Da; putative annotation: N/A; putative formula: C7H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.127,"smiles":null,"spectrum_id":"CCMSLIB00017235691","spectrum_index":15111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 290.144 Da; putative annotation: N/A; putative formula: C17H23O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.219,"smiles":null,"spectrum_id":"CCMSLIB00017235694","spectrum_index":15112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 26.0532 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.108,"smiles":null,"spectrum_id":"CCMSLIB00017235695","spectrum_index":15113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-methoxybenzoic acid (delta mass: 26.0535 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.119,"smiles":null,"spectrum_id":"CCMSLIB00017235698","spectrum_index":15114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 68.0627 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.122,"smiles":null,"spectrum_id":"CCMSLIB00017235700","spectrum_index":15115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 989.6493 Da; putative annotation: N/A; putative formula: C61H87N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1152.71,"smiles":null,"spectrum_id":"CCMSLIB00017235702","spectrum_index":15116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 491.3088 Da; putative annotation: N/A; putative formula: C29H41N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.369,"smiles":null,"spectrum_id":"CCMSLIB00017235704","spectrum_index":15117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phthalic acid (delta mass: 92.0257 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.06,"smiles":null,"spectrum_id":"CCMSLIB00017235706","spectrum_index":15118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 136.0405 Da; putative annotation: N/A; putative formula: C3H9N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.18,"smiles":null,"spectrum_id":"CCMSLIB00017235708","spectrum_index":15119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 45.8905 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.956,"smiles":null,"spectrum_id":"CCMSLIB00017235710","spectrum_index":15120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxo-4-cholestenoic acid (delta mass: 42.0093 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.33,"smiles":null,"spectrum_id":"CCMSLIB00017235713","spectrum_index":15121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 114.0829 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.367,"smiles":null,"spectrum_id":"CCMSLIB00017235714","spectrum_index":15122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE - 60.0 eV (delta mass: 41.0268 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.071,"smiles":null,"spectrum_id":"CCMSLIB00017235717","spectrum_index":15123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 324.3016 Da; putative annotation: N/A; putative formula: C21H40O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.339,"smiles":null,"spectrum_id":"CCMSLIB00017235718","spectrum_index":15124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.149,"smiles":null,"spectrum_id":"CCMSLIB00017235721","spectrum_index":15125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 7.968 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.07,"smiles":null,"spectrum_id":"CCMSLIB00017235722","spectrum_index":15126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 123.0361 Da; putative annotation: N/A; putative formula: C5H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.117,"smiles":null,"spectrum_id":"CCMSLIB00017235725","spectrum_index":15127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 201.0773 Da; putative annotation: N/A; putative formula: C12H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.123,"smiles":null,"spectrum_id":"CCMSLIB00017235726","spectrum_index":15128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 86.0729 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.149,"smiles":null,"spectrum_id":"CCMSLIB00017235729","spectrum_index":15129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 55.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.171,"smiles":null,"spectrum_id":"CCMSLIB00017235730","spectrum_index":15130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381339-01!methyl (2E,4E,8E)-7,13-dihydroxy-4,8,12-trimethyltetradeca-2,4,8-trienoate (delta mass: 60.0373 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.259,"smiles":null,"spectrum_id":"CCMSLIB00017235733","spectrum_index":15131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 519.2683 Da; putative annotation: N/A; putative formula: C24H41NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.328,"smiles":null,"spectrum_id":"CCMSLIB00017235734","spectrum_index":15132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 15.9836 Da; putative annotation: N/A; putative formula: HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.055,"smiles":null,"spectrum_id":"CCMSLIB00017235737","spectrum_index":15133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 59.0361 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.123,"smiles":null,"spectrum_id":"CCMSLIB00017235738","spectrum_index":15134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 18.0001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.042,"smiles":null,"spectrum_id":"CCMSLIB00017235741","spectrum_index":15135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl syringate (delta mass: 222.0509 Da; putative annotation: N/A; putative formula: C11H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.142,"smiles":null,"spectrum_id":"CCMSLIB00017235742","spectrum_index":15136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10E,12Z-octadecadienoic acid (delta mass: 280.2708 Da; putative annotation: N/A; putative formula: C19H37O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.518,"smiles":null,"spectrum_id":"CCMSLIB00017235745","spectrum_index":15137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1148.549 Da; putative annotation: N/A; putative formula: C67H76N10O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1311.61,"smiles":null,"spectrum_id":"CCMSLIB00017235746","spectrum_index":15138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 58.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.175,"smiles":null,"spectrum_id":"CCMSLIB00017235749","spectrum_index":15139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zinterol (delta mass: 245.9995 Da; putative annotation: N/A; putative formula: C13H10O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.168,"smiles":null,"spectrum_id":"CCMSLIB00017235750","spectrum_index":15140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Skatole - 40.0 eV (delta mass: 16.9422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.023,"smiles":null,"spectrum_id":"CCMSLIB00017235753","spectrum_index":15141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclovirobuxine D (delta mass: 53.9739 Da; putative annotation: N/A; putative formula: C2H-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.342,"smiles":null,"spectrum_id":"CCMSLIB00017235754","spectrum_index":15142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 114.0824 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.32,"smiles":null,"spectrum_id":"CCMSLIB00017235757","spectrum_index":15143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleana-1,9(11)-dien-28-oic acid, 2-cyano-3,12-dioxo- (delta mass: 142.1221 Da; putative annotation: N/A; putative formula: C6H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.433,"smiles":null,"spectrum_id":"CCMSLIB00017235758","spectrum_index":15144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 325.1083 Da; putative annotation: N/A; putative formula: C15H20NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1298.43,"smiles":null,"spectrum_id":"CCMSLIB00017235760","spectrum_index":15145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE10; CorrDec (delta mass: 175.9913 Da; putative annotation: N/A; putative formula: C3H5N4OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.057,"smiles":null,"spectrum_id":"CCMSLIB00017235762","spectrum_index":15146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Diethyl-2-aminoethanol (delta mass: 53.0267 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.149,"smiles":null,"spectrum_id":"CCMSLIB00017235763","spectrum_index":15147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 53.0278 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.13,"smiles":null,"spectrum_id":"CCMSLIB00017235766","spectrum_index":15148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 103.0588 Da; putative annotation: N/A; putative formula: C3H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.212,"smiles":null,"spectrum_id":"CCMSLIB00017235767","spectrum_index":15149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 241.2785 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.355,"smiles":null,"spectrum_id":"CCMSLIB00017235770","spectrum_index":15150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 237.1002 Da; putative annotation: N/A; putative formula: C12H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.208,"smiles":null,"spectrum_id":"CCMSLIB00017235771","spectrum_index":15151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 145.023 Da; putative annotation: N/A; putative formula: C4H8N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.109,"smiles":null,"spectrum_id":"CCMSLIB00017235774","spectrum_index":15152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 156.1147 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.155,"smiles":null,"spectrum_id":"CCMSLIB00017235775","spectrum_index":15153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic JBIR 27 (delta mass: 88.0161 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.18,"smiles":null,"spectrum_id":"CCMSLIB00017235778","spectrum_index":15154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12S-Hydroxy-5Z,8E,10E-heptadecatrienoic acid (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.217,"smiles":null,"spectrum_id":"CCMSLIB00017235779","spectrum_index":15155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 70.0413 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.101,"smiles":null,"spectrum_id":"CCMSLIB00017235782","spectrum_index":15156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 148.0584 Da; putative annotation: N/A; putative formula: C5H13N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.139,"smiles":null,"spectrum_id":"CCMSLIB00017235783","spectrum_index":15157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 366.2755 Da; putative annotation: N/A; putative formula: C26H38O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.356,"smiles":null,"spectrum_id":"CCMSLIB00017235785","spectrum_index":15158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arachidonic acid leelamide (delta mass: 72.0421 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.525,"smiles":null,"spectrum_id":"CCMSLIB00017235787","spectrum_index":15159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 61.0282 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.116,"smiles":null,"spectrum_id":"CCMSLIB00017235789","spectrum_index":15160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 154.0783 Da; putative annotation: N/A; putative formula: C12H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.138,"smiles":null,"spectrum_id":"CCMSLIB00017235791","spectrum_index":15161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-11-2-1 (delta mass: 63.0675 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.315,"smiles":null,"spectrum_id":"CCMSLIB00017235793","spectrum_index":15162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tibolone (delta mass: 308.8728 Da; putative annotation: N/A; putative formula: CN3O10PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.089,"smiles":null,"spectrum_id":"CCMSLIB00017235795","spectrum_index":15163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 939.6278 Da; putative annotation: N/A; putative formula: C64H81N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1120.7,"smiles":null,"spectrum_id":"CCMSLIB00017235797","spectrum_index":15164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 11.9998 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.07,"smiles":null,"spectrum_id":"CCMSLIB00017235799","spectrum_index":15165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 86.0116 Da; putative annotation: N/A; putative formula: C2H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.087,"smiles":null,"spectrum_id":"CCMSLIB00017235801","spectrum_index":15166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 101.0604 Da; putative annotation: N/A; putative formula: C3H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.066,"smiles":null,"spectrum_id":"CCMSLIB00017235803","spectrum_index":15167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 28.9794 Da; putative annotation: N/A; putative formula: NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.076,"smiles":null,"spectrum_id":"CCMSLIB00017235805","spectrum_index":15168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.169,"smiles":null,"spectrum_id":"CCMSLIB00017235807","spectrum_index":15169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 162.0521 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.154,"smiles":null,"spectrum_id":"CCMSLIB00017235808","spectrum_index":15170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[5-[[4-[5-[acetyl(hydroxy)amino]pentylamino]-4-oxobutanoyl]-hydroxyamino]pentylamino]-4-oxobutanoic acid (delta mass: 27.0481 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.309,"smiles":null,"spectrum_id":"CCMSLIB00017235811","spectrum_index":15171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 212.1069 Da; putative annotation: N/A; putative formula: C12H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.208,"smiles":null,"spectrum_id":"CCMSLIB00017235812","spectrum_index":15172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-methyl-9H-pyrido[3,4-b]indol-7-ol hydrochloride dihydrate (delta mass: 46.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.121,"smiles":null,"spectrum_id":"CCMSLIB00017235815","spectrum_index":15173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 89.1091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.212,"smiles":null,"spectrum_id":"CCMSLIB00017235816","spectrum_index":15174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Epioxandrolone (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.254,"smiles":null,"spectrum_id":"CCMSLIB00017235819","spectrum_index":15175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 265.2252 Da; putative annotation: N/A; putative formula: C14H27N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.473,"smiles":null,"spectrum_id":"CCMSLIB00017235820","spectrum_index":15176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 39.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.144,"smiles":null,"spectrum_id":"CCMSLIB00017235823","spectrum_index":15177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 46.0053 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.066,"smiles":null,"spectrum_id":"CCMSLIB00017235824","spectrum_index":15178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 9.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.102,"smiles":null,"spectrum_id":"CCMSLIB00017235826","spectrum_index":15179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 65.0655 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.157,"smiles":null,"spectrum_id":"CCMSLIB00017235828","spectrum_index":15180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP008102 3?-Hydroxy-12 Ketolithocholic Acid|12-Ketolithocholic acid|(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren (delta mass: 19.0005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.285,"smiles":null,"spectrum_id":"CCMSLIB00017235830","spectrum_index":15181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-3,4-dihydro-1(2H)-isoquinolinone (delta mass: 12.0188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.11,"smiles":null,"spectrum_id":"CCMSLIB00017235832","spectrum_index":15182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 46.0049 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.148,"smiles":null,"spectrum_id":"CCMSLIB00017235833","spectrum_index":15183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 44.026 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.086,"smiles":null,"spectrum_id":"CCMSLIB00017235836","spectrum_index":15184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 136.0736 Da; putative annotation: N/A; putative formula: C6H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.217,"smiles":null,"spectrum_id":"CCMSLIB00017235837","spectrum_index":15185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017235839","spectrum_index":15186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Palmitelaidic acid from NIST14 (delta mass: 123.9481 Da; putative annotation: N/A; putative formula: CH2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.18,"smiles":null,"spectrum_id":"CCMSLIB00017235841","spectrum_index":15187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 408.2859 Da; putative annotation: N/A; putative formula: C21H32N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":904.626,"smiles":null,"spectrum_id":"CCMSLIB00017235844","spectrum_index":15188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tropic acid (delta mass: 41.0622 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017235845","spectrum_index":15189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 293.1855 Da; putative annotation: N/A; putative formula: C14H23N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.261,"smiles":null,"spectrum_id":"CCMSLIB00017235848","spectrum_index":15190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dimethyl-1,3-benzenediol (delta mass: 107.0723 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.148,"smiles":null,"spectrum_id":"CCMSLIB00017235849","spectrum_index":15191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 428.1811 Da; putative annotation: N/A; putative formula: C28H28O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.231,"smiles":null,"spectrum_id":"CCMSLIB00017235852","spectrum_index":15192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gitoxigenin CollisionEnergy:205060 (delta mass: 76.0677 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.316,"smiles":null,"spectrum_id":"CCMSLIB00017235853","spectrum_index":15193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 134.1098 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.316,"smiles":null,"spectrum_id":"CCMSLIB00017235856","spectrum_index":15194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 140.0631 Da; putative annotation: N/A; putative formula: C11H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.128,"smiles":null,"spectrum_id":"CCMSLIB00017235857","spectrum_index":15195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-heptylquinolin-4(1H)-one (delta mass: 17.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.195,"smiles":null,"spectrum_id":"CCMSLIB00017235860","spectrum_index":15196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 56.0607 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.251,"smiles":null,"spectrum_id":"CCMSLIB00017235861","spectrum_index":15197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 66.0468 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017235863","spectrum_index":15198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 172.0854 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.172,"smiles":null,"spectrum_id":"CCMSLIB00017235865","spectrum_index":15199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 18.0089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.062,"smiles":null,"spectrum_id":"CCMSLIB00017235867","spectrum_index":15200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethylbenzoic acid (delta mass: 30.0074 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.083,"smiles":null,"spectrum_id":"CCMSLIB00017235869","spectrum_index":15201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 150.1043 Da; putative annotation: N/A; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017235871","spectrum_index":15202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-O-((2.alpha.,3.beta.,5.Xi.,9.Xi.,18.Xi.,19.alpha.)-2,3,19-Trihydroxy-28-oxoolean-12-en-28-yl)-.beta.-D-glucopyranose (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.441,"smiles":null,"spectrum_id":"CCMSLIB00017235873","spectrum_index":15203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 426.2256 Da; putative annotation: N/A; putative formula: C25H35N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.484,"smiles":null,"spectrum_id":"CCMSLIB00017235875","spectrum_index":15204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 76.9768 Da; putative annotation: N/A; putative formula: CH3NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.079,"smiles":null,"spectrum_id":"CCMSLIB00017235878","spectrum_index":15205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 167.0951 Da; putative annotation: N/A; putative formula: C9H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.166,"smiles":null,"spectrum_id":"CCMSLIB00017235880","spectrum_index":15206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 125.0842 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.16,"smiles":null,"spectrum_id":"CCMSLIB00017235882","spectrum_index":15207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avermitilol (delta mass: 46.0393 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.245,"smiles":null,"spectrum_id":"CCMSLIB00017235884","spectrum_index":15208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 174.0533 Da; putative annotation: N/A; putative formula: C8H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.202,"smiles":null,"spectrum_id":"CCMSLIB00017235886","spectrum_index":15209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rosiridol (delta mass: 68.0632 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.201,"smiles":null,"spectrum_id":"CCMSLIB00017235887","spectrum_index":15210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-L-HISTIDINE (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.103,"smiles":null,"spectrum_id":"CCMSLIB00017235890","spectrum_index":15211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 294.4269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.498,"smiles":null,"spectrum_id":"CCMSLIB00017235891","spectrum_index":15212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 71.0514 Da; putative annotation: N/A; putative formula: C2H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017235894","spectrum_index":15213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 132.0205 Da; putative annotation: N/A; putative formula: C2H5N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.102,"smiles":null,"spectrum_id":"CCMSLIB00017235895","spectrum_index":15214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 182.0941 Da; putative annotation: N/A; putative formula: C10H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.223,"smiles":null,"spectrum_id":"CCMSLIB00017235898","spectrum_index":15215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 223.157 Da; putative annotation: N/A; putative formula: C13H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.222,"smiles":null,"spectrum_id":"CCMSLIB00017235899","spectrum_index":15216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alisol B acetate (delta mass: 88.0674 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.44,"smiles":null,"spectrum_id":"CCMSLIB00017235901","spectrum_index":15217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mitraphylline (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.207,"smiles":null,"spectrum_id":"CCMSLIB00017235903","spectrum_index":15218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenol (delta mass: 28.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.138,"smiles":null,"spectrum_id":"CCMSLIB00017235904","spectrum_index":15219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 58.0487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.161,"smiles":null,"spectrum_id":"CCMSLIB00017235907","spectrum_index":15220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethylpiperazine (delta mass: 232.1205 Da; putative annotation: N/A; putative formula: C13H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.243,"smiles":null,"spectrum_id":"CCMSLIB00017235908","spectrum_index":15221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 78.0139 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.272,"smiles":null,"spectrum_id":"CCMSLIB00017235911","spectrum_index":15222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxy-4,5-dimethylphenyl)ethanone (delta mass: 170.1049 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.196,"smiles":null,"spectrum_id":"CCMSLIB00017235912","spectrum_index":15223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 388.2617 Da; putative annotation: N/A; putative formula: C24H36O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.327,"smiles":null,"spectrum_id":"CCMSLIB00017235914","spectrum_index":15224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3aR,4R,5aS,6S,9aR,9bS)-4,6-Dihydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one (delta mass: 162.0523 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.196,"smiles":null,"spectrum_id":"CCMSLIB00017235916","spectrum_index":15225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 162.0529 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.145,"smiles":null,"spectrum_id":"CCMSLIB00017235918","spectrum_index":15226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 40.9902 Da; putative annotation: N/A; putative formula: CH-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.045,"smiles":null,"spectrum_id":"CCMSLIB00017235920","spectrum_index":15227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 326.1367 Da; putative annotation: N/A; putative formula: C16H22O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.196,"smiles":null,"spectrum_id":"CCMSLIB00017235922","spectrum_index":15228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 14.0633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.139,"smiles":null,"spectrum_id":"CCMSLIB00017235924","spectrum_index":15229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 89.8775 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.094,"smiles":null,"spectrum_id":"CCMSLIB00017235926","spectrum_index":15230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine (delta mass: 86.0156 Da; putative annotation: N/A; putative formula: C7H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.128,"smiles":null,"spectrum_id":"CCMSLIB00017235928","spectrum_index":15231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.-Prostaglandin E1 (delta mass: 78.0474 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.295,"smiles":null,"spectrum_id":"CCMSLIB00017235931","spectrum_index":15232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Androsten-11.beta.-ol-3,17-dione (delta mass: 180.9605 Da; putative annotation: N/A; putative formula: C4H8NO-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.156,"smiles":null,"spectrum_id":"CCMSLIB00017235932","spectrum_index":15233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.134,"smiles":null,"spectrum_id":"CCMSLIB00017235935","spectrum_index":15234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 88.0161 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.06,"smiles":null,"spectrum_id":"CCMSLIB00017235936","spectrum_index":15235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S(-)-Cathinone (delta mass: 201.9924 Da; putative annotation: N/A; putative formula: C7H6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.084,"smiles":null,"spectrum_id":"CCMSLIB00017235939","spectrum_index":15236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 317.2042 Da; putative annotation: N/A; putative formula: C17H27N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.467,"smiles":null,"spectrum_id":"CCMSLIB00017235940","spectrum_index":15237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 228.038 Da; putative annotation: N/A; putative formula: C8H8N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.249,"smiles":null,"spectrum_id":"CCMSLIB00017235943","spectrum_index":15238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-undecylpiperidine (delta mass: 29.0058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.29,"smiles":null,"spectrum_id":"CCMSLIB00017235944","spectrum_index":15239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 50.0721 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.288,"smiles":null,"spectrum_id":"CCMSLIB00017235946","spectrum_index":15240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017235948","spectrum_index":15241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminobenzoic acid - 40.0 eV (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.066,"smiles":null,"spectrum_id":"CCMSLIB00017235949","spectrum_index":15242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-6-Octadecenoic acid (delta mass: 74.092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.355,"smiles":null,"spectrum_id":"CCMSLIB00017235952","spectrum_index":15243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 24.0364 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.179,"smiles":null,"spectrum_id":"CCMSLIB00017235953","spectrum_index":15244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 144.1303 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.227,"smiles":null,"spectrum_id":"CCMSLIB00017235956","spectrum_index":15245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 96.0577 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.336,"smiles":null,"spectrum_id":"CCMSLIB00017235957","spectrum_index":15246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 4-O-hexopyranosylhexopyranoside (delta mass: 104.0266 Da; putative annotation: N/A; putative formula: H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.182,"smiles":null,"spectrum_id":"CCMSLIB00017235958","spectrum_index":15247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 795.4781 Da; putative annotation: N/A; putative formula: C43H65N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":976.549,"smiles":null,"spectrum_id":"CCMSLIB00017235961","spectrum_index":15248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 259.303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.34,"smiles":null,"spectrum_id":"CCMSLIB00017235962","spectrum_index":15249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 226.1635 Da; putative annotation: N/A; putative formula: C11H22N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.313,"smiles":null,"spectrum_id":"CCMSLIB00017235965","spectrum_index":15250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 175.0447 Da; putative annotation: N/A; putative formula: C4H10N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.115,"smiles":null,"spectrum_id":"CCMSLIB00017235966","spectrum_index":15251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 176.0319 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.29,"smiles":null,"spectrum_id":"CCMSLIB00017235967","spectrum_index":15252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 136.0887 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.315,"smiles":null,"spectrum_id":"CCMSLIB00017235970","spectrum_index":15253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vitexin (delta mass: 308.1087 Da; putative annotation: N/A; putative formula: C17H24O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.222,"smiles":null,"spectrum_id":"CCMSLIB00017235971","spectrum_index":15254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 62.0514 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.299,"smiles":null,"spectrum_id":"CCMSLIB00017235974","spectrum_index":15255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 154.1204 Da; putative annotation: N/A; putative formula: C7H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.379,"smiles":null,"spectrum_id":"CCMSLIB00017235975","spectrum_index":15256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl syringate (delta mass: 196.073 Da; putative annotation: N/A; putative formula: C4H13N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.164,"smiles":null,"spectrum_id":"CCMSLIB00017235976","spectrum_index":15257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 78.0103 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.07,"smiles":null,"spectrum_id":"CCMSLIB00017235979","spectrum_index":15258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 78.0103 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.06,"smiles":null,"spectrum_id":"CCMSLIB00017235980","spectrum_index":15259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzaldehyde (delta mass: 134.0206 Da; putative annotation: N/A; putative formula: CH-2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.06,"smiles":null,"spectrum_id":"CCMSLIB00017235983","spectrum_index":15260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 301.1626 Da; putative annotation: N/A; putative formula: C15H28NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.245,"smiles":null,"spectrum_id":"CCMSLIB00017235984","spectrum_index":15261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 40.9094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.98,"smiles":null,"spectrum_id":"CCMSLIB00017235987","spectrum_index":15262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 341.1319 Da; putative annotation: N/A; putative formula: C25H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.296,"smiles":null,"spectrum_id":"CCMSLIB00017235988","spectrum_index":15263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 199.3233 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.63,"smiles":null,"spectrum_id":"CCMSLIB00017235989","spectrum_index":15264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xysmalogenin (delta mass: 172.1246 Da; putative annotation: N/A; putative formula: C7H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.362,"smiles":null,"spectrum_id":"CCMSLIB00017235992","spectrum_index":15265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 45.9822 Da; putative annotation: N/A; putative formula: C4H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.115,"smiles":null,"spectrum_id":"CCMSLIB00017235993","spectrum_index":15266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 81.0055 Da; putative annotation: N/A; putative formula: C4H3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.113,"smiles":null,"spectrum_id":"CCMSLIB00017235994","spectrum_index":15267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidinol (delta mass: 284.1648 Da; putative annotation: N/A; putative formula: C14H25N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.345,"smiles":null,"spectrum_id":"CCMSLIB00017235997","spectrum_index":15268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.124,"smiles":null,"spectrum_id":"CCMSLIB00017235998","spectrum_index":15269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 64.0676 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017236001","spectrum_index":15270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androstane-3.alpha.,17.beta.-diol (delta mass: 94.0785 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.326,"smiles":null,"spectrum_id":"CCMSLIB00017236002","spectrum_index":15271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 60.0195 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.124,"smiles":null,"spectrum_id":"CCMSLIB00017236005","spectrum_index":15272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140301 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 172.1818 Da; putative annotation: N/A; putative formula: C7H20N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.278,"smiles":null,"spectrum_id":"CCMSLIB00017236006","spectrum_index":15273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 66.0106 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.097,"smiles":null,"spectrum_id":"CCMSLIB00017236007","spectrum_index":15274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Hydroxytestosterone (delta mass: 193.8789 Da; putative annotation: N/A; putative formula: C4H2O-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.09,"smiles":null,"spectrum_id":"CCMSLIB00017236010","spectrum_index":15275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 458.2673 Da; putative annotation: N/A; putative formula: C20H38N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.333,"smiles":null,"spectrum_id":"CCMSLIB00017236011","spectrum_index":15276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 174.1407 Da; putative annotation: N/A; putative formula: C13H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.237,"smiles":null,"spectrum_id":"CCMSLIB00017236013","spectrum_index":15277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-hydroxybenzoic acid CollisionEnergy:102040 (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.066,"smiles":null,"spectrum_id":"CCMSLIB00017236015","spectrum_index":15278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloylputrescine (delta mass: 74.0732 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.228,"smiles":null,"spectrum_id":"CCMSLIB00017236016","spectrum_index":15279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 26.9884 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.055,"smiles":null,"spectrum_id":"CCMSLIB00017236019","spectrum_index":15280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zizanoic acid (delta mass: 74.0352 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.204,"smiles":null,"spectrum_id":"CCMSLIB00017236020","spectrum_index":15281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 129.0734 Da; putative annotation: N/A; putative formula: C5H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.133,"smiles":null,"spectrum_id":"CCMSLIB00017236021","spectrum_index":15282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 166.0351 Da; putative annotation: N/A; putative formula: C3H2N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.111,"smiles":null,"spectrum_id":"CCMSLIB00017236024","spectrum_index":15283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 76.0319 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017236025","spectrum_index":15284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 41.0269 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017236028","spectrum_index":15285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.186,"smiles":null,"spectrum_id":"CCMSLIB00017236029","spectrum_index":15286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 239.0464 Da; putative annotation: N/A; putative formula: C7H13NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.148,"smiles":null,"spectrum_id":"CCMSLIB00017236030","spectrum_index":15287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU252006 2-(Piperazin-1-yl)ethanamine|1-Piperazineethanamine|2-piperazin-1-ylethanamine (delta mass: 75.0966 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.23,"smiles":null,"spectrum_id":"CCMSLIB00017236033","spectrum_index":15288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 354.1183 Da; putative annotation: N/A; putative formula: C15H22N4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.2,"smiles":null,"spectrum_id":"CCMSLIB00017236034","spectrum_index":15289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sericic acid (delta mass: 62.0616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.414,"smiles":null,"spectrum_id":"CCMSLIB00017236037","spectrum_index":15290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19,20-Dihydroxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 114.067 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.32,"smiles":null,"spectrum_id":"CCMSLIB00017236038","spectrum_index":15291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 45.0217 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017236041","spectrum_index":15292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Lys (delta mass: 115.0268 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.192,"smiles":null,"spectrum_id":"CCMSLIB00017236042","spectrum_index":15293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 227.2617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.568,"smiles":null,"spectrum_id":"CCMSLIB00017236043","spectrum_index":15294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-oxo-5beta-cholanic acid (delta mass: 22.0206 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017236046","spectrum_index":15295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-hydroxy-3-(hydroxymethyl)pentyl]-8a-(hydroxymethyl)-5,6-dimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.274,"smiles":null,"spectrum_id":"CCMSLIB00017236047","spectrum_index":15296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 171.1845 Da; putative annotation: N/A; putative formula: C8H21N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.38,"smiles":null,"spectrum_id":"CCMSLIB00017236048","spectrum_index":15297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 70.0136 Da; putative annotation: N/A; putative formula: C2H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.152,"smiles":null,"spectrum_id":"CCMSLIB00017236051","spectrum_index":15298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 57.0577 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.112,"smiles":null,"spectrum_id":"CCMSLIB00017236052","spectrum_index":15299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Colchiceine (delta mass: 43.9843 Da; putative annotation: N/A; putative formula: N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.144,"smiles":null,"spectrum_id":"CCMSLIB00017236055","spectrum_index":15300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11-Eicosenoic acid (delta mass: 50.0477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.342,"smiles":null,"spectrum_id":"CCMSLIB00017236056","spectrum_index":15301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholine (delta mass: 165.0497 Da; putative annotation: N/A; putative formula: C2H7N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.421,"smiles":null,"spectrum_id":"CCMSLIB00017236057","spectrum_index":15302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Pyrrolidinylcarbonyl)piperidine (delta mass: 45.0214 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.171,"smiles":null,"spectrum_id":"CCMSLIB00017236060","spectrum_index":15303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 210.2097 Da; putative annotation: N/A; putative formula: C13H26N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.489,"smiles":null,"spectrum_id":"CCMSLIB00017236061","spectrum_index":15304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 231.1107 Da; putative annotation: N/A; putative formula: C10H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.229,"smiles":null,"spectrum_id":"CCMSLIB00017236064","spectrum_index":15305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 47.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017236065","spectrum_index":15306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 661.4989 Da; putative annotation: N/A; putative formula: C34H63N9O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":954.71,"smiles":null,"spectrum_id":"CCMSLIB00017236066","spectrum_index":15307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-C18:1 (delta mass: 447.315 Da; putative annotation: N/A; putative formula: C23H41N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":859.621,"smiles":null,"spectrum_id":"CCMSLIB00017236069","spectrum_index":15308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Syringic acid (delta mass: 188.4399 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.5,"smiles":null,"spectrum_id":"CCMSLIB00017236070","spectrum_index":15309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyperanic acid (delta mass: 89.0609 Da; putative annotation: N/A; putative formula: C2H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.22,"smiles":null,"spectrum_id":"CCMSLIB00017236073","spectrum_index":15310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 104.026 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.128,"smiles":null,"spectrum_id":"CCMSLIB00017236074","spectrum_index":15311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 13.9406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.157,"smiles":null,"spectrum_id":"CCMSLIB00017236077","spectrum_index":15312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 868.0679 Da; putative annotation: N/A; putative formula: C73H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.18,"smiles":null,"spectrum_id":"CCMSLIB00017236078","spectrum_index":15313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 904.5838 Da; putative annotation: N/A; putative formula: C62H82OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1214.7,"smiles":null,"spectrum_id":"CCMSLIB00017236079","spectrum_index":15314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 48.0383 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.26,"smiles":null,"spectrum_id":"CCMSLIB00017236082","spectrum_index":15315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 64.0678 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.3,"smiles":null,"spectrum_id":"CCMSLIB00017236083","spectrum_index":15316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,13.alpha.,14.beta.,17.alpha.,20S,24E)-21-Hydroxy-3-oxolanosta-8,24-dien-26-oic acid (delta mass: 112.0637 Da; putative annotation: N/A; putative formula: C5H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.411,"smiles":null,"spectrum_id":"CCMSLIB00017236086","spectrum_index":15317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 267.0742 Da; putative annotation: N/A; putative formula: C12H13NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.134,"smiles":null,"spectrum_id":"CCMSLIB00017236087","spectrum_index":15318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 197.1779 Da; putative annotation: N/A; putative formula: C12H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.28,"smiles":null,"spectrum_id":"CCMSLIB00017236088","spectrum_index":15319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 126.085 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.33,"smiles":null,"spectrum_id":"CCMSLIB00017236091","spectrum_index":15320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 62.9866 Da; putative annotation: N/A; putative formula: H2NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.042,"smiles":null,"spectrum_id":"CCMSLIB00017236092","spectrum_index":15321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lauroyl Lysine (delta mass: 295.2506 Da; putative annotation: N/A; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.531,"smiles":null,"spectrum_id":"CCMSLIB00017236095","spectrum_index":15322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380158-01!2-[2-[2-[[2-[2-(2-hydroxypropanoylamino)-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoyl]oxypropanoylamino]-3-methylbutanoic acid (delta mass: 217.1313 Da; putative annotation: N/A; putative formula: C10H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":777.449,"smiles":null,"spectrum_id":"CCMSLIB00017236096","spectrum_index":15323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 174.0929 Da; putative annotation: N/A; putative formula: C7H15N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.211,"smiles":null,"spectrum_id":"CCMSLIB00017236097","spectrum_index":15324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 210.0888 Da; putative annotation: N/A; putative formula: C11H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.17,"smiles":null,"spectrum_id":"CCMSLIB00017236100","spectrum_index":15325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S-Hydroxy-4Z,6E,10Z-hexadecatrienoic acid (delta mass: 38.0146 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.21,"smiles":null,"spectrum_id":"CCMSLIB00017236101","spectrum_index":15326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androst-1-en-17.beta.-ol-3-one (delta mass: 50.0522 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.268,"smiles":null,"spectrum_id":"CCMSLIB00017236104","spectrum_index":15327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 32.0049 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.128,"smiles":null,"spectrum_id":"CCMSLIB00017236105","spectrum_index":15328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 107.0739 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.171,"smiles":null,"spectrum_id":"CCMSLIB00017236106","spectrum_index":15329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 27.0359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017236109","spectrum_index":15330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 151.0627 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.154,"smiles":null,"spectrum_id":"CCMSLIB00017236110","spectrum_index":15331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 123.0786 Da; putative annotation: N/A; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.196,"smiles":null,"spectrum_id":"CCMSLIB00017236113","spectrum_index":15332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 165.079 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.181,"smiles":null,"spectrum_id":"CCMSLIB00017236114","spectrum_index":15333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Norepinephrine from NIST14 (delta mass: 57.105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.186,"smiles":null,"spectrum_id":"CCMSLIB00017236115","spectrum_index":15334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017236118","spectrum_index":15335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 112.933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.056,"smiles":null,"spectrum_id":"CCMSLIB00017236119","spectrum_index":15336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Hydroxyphenyl)ethanol (delta mass: 9.9845 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.06,"smiles":null,"spectrum_id":"CCMSLIB00017236122","spectrum_index":15337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00179861-02_C15H26O2_1,8-Azulenediol, 1,2,3,3a,4,7,8,8a-octahydro-3a,6-dimethyl-1-(1-methylethyl)-, (1R,3aR,8S,8aS)- (delta mass: 193.0589 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.259,"smiles":null,"spectrum_id":"CCMSLIB00017236123","spectrum_index":15338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 161.0327 Da; putative annotation: N/A; putative formula: C5H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.124,"smiles":null,"spectrum_id":"CCMSLIB00017236126","spectrum_index":15339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 120.0421 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.139,"smiles":null,"spectrum_id":"CCMSLIB00017236127","spectrum_index":15340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2-1-glyceryl ester (delta mass: 102.0818 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.351,"smiles":null,"spectrum_id":"CCMSLIB00017236128","spectrum_index":15341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 10.9871 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.042,"smiles":null,"spectrum_id":"CCMSLIB00017236131","spectrum_index":15342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 865.5675 Da; putative annotation: N/A; putative formula: C47H75N7O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.64,"smiles":null,"spectrum_id":"CCMSLIB00017236132","spectrum_index":15343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Dec-9-enylpentanedioic acid (delta mass: 48.0365 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.227,"smiles":null,"spectrum_id":"CCMSLIB00017236135","spectrum_index":15344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 160.0734 Da; putative annotation: N/A; putative formula: C7H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.16,"smiles":null,"spectrum_id":"CCMSLIB00017236136","spectrum_index":15345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydodecanoic acid (delta mass: 84.0947 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.275,"smiles":null,"spectrum_id":"CCMSLIB00017236139","spectrum_index":15346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylsulfonyl)piperidin-4-amine (delta mass: 55.0484 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.133,"smiles":null,"spectrum_id":"CCMSLIB00017236140","spectrum_index":15347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Altenuene (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.149,"smiles":null,"spectrum_id":"CCMSLIB00017236143","spectrum_index":15348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 62.0529 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.332,"smiles":null,"spectrum_id":"CCMSLIB00017236144","spectrum_index":15349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bergenin (delta mass: 84.0533 Da; putative annotation: N/A; putative formula: CH4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.14,"smiles":null,"spectrum_id":"CCMSLIB00017236147","spectrum_index":15350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 62.0523 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.3,"smiles":null,"spectrum_id":"CCMSLIB00017236148","spectrum_index":15351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl vanillate (delta mass: 169.9748 Da; putative annotation: N/A; putative formula: C2H9N2O-1P3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.04,"smiles":null,"spectrum_id":"CCMSLIB00017236150","spectrum_index":15352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7-Triazacyclononane (delta mass: 131.1053 Da; putative annotation: N/A; putative formula: C5H13N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.239,"smiles":null,"spectrum_id":"CCMSLIB00017236152","spectrum_index":15353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 24.0002 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.092,"smiles":null,"spectrum_id":"CCMSLIB00017236154","spectrum_index":15354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 133.0766 Da; putative annotation: N/A; putative formula: C4H12N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.136,"smiles":null,"spectrum_id":"CCMSLIB00017236156","spectrum_index":15355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 254.0953 Da; putative annotation: N/A; putative formula: C17H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.166,"smiles":null,"spectrum_id":"CCMSLIB00017236158","spectrum_index":15356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 442.1597 Da; putative annotation: N/A; putative formula: C20H30N2O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.235,"smiles":null,"spectrum_id":"CCMSLIB00017236160","spectrum_index":15357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,17-Dihydroxy-7-kauranone (delta mass: 110.0731 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.315,"smiles":null,"spectrum_id":"CCMSLIB00017236162","spectrum_index":15358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 273.1675 Da; putative annotation: N/A; putative formula: C14H28NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.254,"smiles":null,"spectrum_id":"CCMSLIB00017236164","spectrum_index":15359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 129.0435 Da; putative annotation: N/A; putative formula: C6H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.13,"smiles":null,"spectrum_id":"CCMSLIB00017236167","spectrum_index":15360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 62.06 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.23,"smiles":null,"spectrum_id":"CCMSLIB00017236169","spectrum_index":15361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(8-Hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)prop-2-enoic acid (delta mass: 116.0989 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.279,"smiles":null,"spectrum_id":"CCMSLIB00017236170","spectrum_index":15362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipalmitolein (9c) (delta mass: 255.2547 Da; putative annotation: N/A; putative formula: C12H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":820.737,"smiles":null,"spectrum_id":"CCMSLIB00017236173","spectrum_index":15363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 116.1447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.232,"smiles":null,"spectrum_id":"CCMSLIB00017236174","spectrum_index":15364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 695.268 Da; putative annotation: N/A; putative formula: C48H41NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1039.45,"smiles":null,"spectrum_id":"CCMSLIB00017236177","spectrum_index":15365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(1H-Indol-3-yl)-1-butanone (delta mass: 75.0318 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017236178","spectrum_index":15366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 31.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017236180","spectrum_index":15367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE0; CorrDec (delta mass: 162.0369 Da; putative annotation: N/A; putative formula: C7H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.134,"smiles":null,"spectrum_id":"CCMSLIB00017236182","spectrum_index":15368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cys-Glu (delta mass: 129.0423 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.112,"smiles":null,"spectrum_id":"CCMSLIB00017236184","spectrum_index":15369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,9-Dideoxyforskolin (delta mass: 80.0624 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.31,"smiles":null,"spectrum_id":"CCMSLIB00017236186","spectrum_index":15370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 186.0679 Da; putative annotation: N/A; putative formula: C12H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.117,"smiles":null,"spectrum_id":"CCMSLIB00017236188","spectrum_index":15371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 47.0256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.085,"smiles":null,"spectrum_id":"CCMSLIB00017236190","spectrum_index":15372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 56.9334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.998,"smiles":null,"spectrum_id":"CCMSLIB00017236193","spectrum_index":15373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 52.0327 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.254,"smiles":null,"spectrum_id":"CCMSLIB00017236195","spectrum_index":15374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 375.3347 Da; putative annotation: N/A; putative formula: C22H41N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.551,"smiles":null,"spectrum_id":"CCMSLIB00017236197","spectrum_index":15375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.064,"smiles":null,"spectrum_id":"CCMSLIB00017236199","spectrum_index":15376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 80.0622 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017236202","spectrum_index":15377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 8.0052 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.123,"smiles":null,"spectrum_id":"CCMSLIB00017236203","spectrum_index":15378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Butenoic acid, 2-ethyl-, (Z)- (delta mass: 192.1357 Da; putative annotation: N/A; putative formula: C10H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.211,"smiles":null,"spectrum_id":"CCMSLIB00017236205","spectrum_index":15379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 250.2654 Da; putative annotation: N/A; putative formula: C18H34)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.383,"smiles":null,"spectrum_id":"CCMSLIB00017236207","spectrum_index":15380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(6-methyl-6-azabicyclo[4.4.0]dec-2-yl)methyl 3-aminopropanoate, iodide CollisionEnergy:205060\"\" (delta mass: 158.1033 Da; putative annotation: N/A; putative formula: C7H14N2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.31,"smiles":null,"spectrum_id":"CCMSLIB00017236209","spectrum_index":15381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Oxononanoic acid (delta mass: 64.0308 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017236211","spectrum_index":15382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-ethyl-2,4-dihydroxy-6-methoxyphenyl)butan-1-one (delta mass: 197.0901 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.218,"smiles":null,"spectrum_id":"CCMSLIB00017236213","spectrum_index":15383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CHOLIC ACID (delta mass: 200.1561 Da; putative annotation: N/A; putative formula: C15H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.451,"smiles":null,"spectrum_id":"CCMSLIB00017236216","spectrum_index":15384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Echinocystic acid (delta mass: 27.0485 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.411,"smiles":null,"spectrum_id":"CCMSLIB00017236217","spectrum_index":15385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 102.0844 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.348,"smiles":null,"spectrum_id":"CCMSLIB00017236220","spectrum_index":15386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 75.0474 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.144,"smiles":null,"spectrum_id":"CCMSLIB00017236221","spectrum_index":15387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 171.1294 Da; putative annotation: N/A; putative formula: C8H18N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.235,"smiles":null,"spectrum_id":"CCMSLIB00017236224","spectrum_index":15388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HYDROXYPHENYLLACTIC ACID (delta mass: 13.0314 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017236225","spectrum_index":15389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyethoxy)phenol (delta mass: 40.0142 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.085,"smiles":null,"spectrum_id":"CCMSLIB00017236228","spectrum_index":15390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 127.0627 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.149,"smiles":null,"spectrum_id":"CCMSLIB00017236229","spectrum_index":15391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 163.0151 Da; putative annotation: N/A; putative formula: C3H6N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.101,"smiles":null,"spectrum_id":"CCMSLIB00017236232","spectrum_index":15392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-20-one (delta mass: 72.0377 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.296,"smiles":null,"spectrum_id":"CCMSLIB00017236233","spectrum_index":15393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 208.0947 Da; putative annotation: N/A; putative formula: C8H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.186,"smiles":null,"spectrum_id":"CCMSLIB00017236235","spectrum_index":15394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 252.1036 Da; putative annotation: N/A; putative formula: C10H20O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.174,"smiles":null,"spectrum_id":"CCMSLIB00017236237","spectrum_index":15395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 176.4505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.5,"smiles":null,"spectrum_id":"CCMSLIB00017236239","spectrum_index":15396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylcatechol (delta mass: 10.03 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.09,"smiles":null,"spectrum_id":"CCMSLIB00017236241","spectrum_index":15397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017236242","spectrum_index":15398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 64.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.279,"smiles":null,"spectrum_id":"CCMSLIB00017236245","spectrum_index":15399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 332.1985 Da; putative annotation: N/A; putative formula: C20H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.294,"smiles":null,"spectrum_id":"CCMSLIB00017236246","spectrum_index":15400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 58.0286 Da; putative annotation: N/A; putative formula: H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.087,"smiles":null,"spectrum_id":"CCMSLIB00017236249","spectrum_index":15401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetisaric acid (delta mass: 60.0376 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.28,"smiles":null,"spectrum_id":"CCMSLIB00017236250","spectrum_index":15402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 755.6452 Da; putative annotation: N/A; putative formula: C45H89NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.788,"smiles":null,"spectrum_id":"CCMSLIB00017236253","spectrum_index":15403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 138.0527 Da; putative annotation: N/A; putative formula: CH2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017236254","spectrum_index":15404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4aR,5S)-9-Hydroxy-3,4a,5-trimethyl-4,5,6,7,8,8a,9,9a-octahydrobenzo[f][1]benzofuran-2-one (delta mass: 28.0317 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.196,"smiles":null,"spectrum_id":"CCMSLIB00017236257","spectrum_index":15405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Aminophenylsulfonyl)ethanol (delta mass: 64.0424 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.096,"smiles":null,"spectrum_id":"CCMSLIB00017236258","spectrum_index":15406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,19-Dihydroxy-3-oxo-12-ursen-28-oic acid (delta mass: 142.1139 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.456,"smiles":null,"spectrum_id":"CCMSLIB00017236260","spectrum_index":15407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Carboxy-3-methylbutyl)-5,6,8a-trimethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalene-1-carboxylic acid (delta mass: 180.0639 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.281,"smiles":null,"spectrum_id":"CCMSLIB00017236262","spectrum_index":15408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 64.0678 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017236264","spectrum_index":15409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 115.1128 Da; putative annotation: N/A; putative formula: C5H13N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.168,"smiles":null,"spectrum_id":"CCMSLIB00017236266","spectrum_index":15410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myrtucommulone B (delta mass: 112.1026 Da; putative annotation: N/A; putative formula: C6H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.314,"smiles":null,"spectrum_id":"CCMSLIB00017236268","spectrum_index":15411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 27.0176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.14,"smiles":null,"spectrum_id":"CCMSLIB00017236270","spectrum_index":15412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017236272","spectrum_index":15413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 124.0888 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.201,"smiles":null,"spectrum_id":"CCMSLIB00017236274","spectrum_index":15414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 27.0108 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017236276","spectrum_index":15415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydroxy-2,6-farnesadien-1-oic acid (delta mass: 193.0587 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.249,"smiles":null,"spectrum_id":"CCMSLIB00017236278","spectrum_index":15416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 348.9826 Da; putative annotation: N/A; putative formula: C13H7N3O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.063,"smiles":null,"spectrum_id":"CCMSLIB00017236281","spectrum_index":15417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 264.1109 Da; putative annotation: N/A; putative formula: C13H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.28,"smiles":null,"spectrum_id":"CCMSLIB00017236283","spectrum_index":15418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 9.994 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.096,"smiles":null,"spectrum_id":"CCMSLIB00017236285","spectrum_index":15419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 174.0529 Da; putative annotation: (-)-Quinic acid; putative formula: C7H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.181,"smiles":null,"spectrum_id":"CCMSLIB00017236287","spectrum_index":15420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-C12:0 (delta mass: 129.0422 Da; putative annotation: Massbank:PB000462 Glutamic acid|2-aminopentanedioic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.27,"smiles":null,"spectrum_id":"CCMSLIB00017236288","spectrum_index":15421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 107.0379 Da; putative annotation: 4-Hydroxy-3-methoxypyridine; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.167,"smiles":null,"spectrum_id":"CCMSLIB00017236291","spectrum_index":15422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Thr (delta mass: 97.0525 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.171,"smiles":null,"spectrum_id":"CCMSLIB00017236292","spectrum_index":15423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Asp (delta mass: 128.096 Da; putative annotation: DL-Lysine CollisionEnergy:102040; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.236,"smiles":null,"spectrum_id":"CCMSLIB00017236295","spectrum_index":15424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,6-Dimethylpyridazin-4-amine (delta mass: 123.0794 Da; putative annotation: Spectral Match to L-Histidinol from NIST14; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.166,"smiles":null,"spectrum_id":"CCMSLIB00017236296","spectrum_index":15425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Bis(2-hydroxyethyl)glycine (delta mass: 99.0681 Da; putative annotation: 5-AMINOPENTANOATE; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.16,"smiles":null,"spectrum_id":"CCMSLIB00017236299","spectrum_index":15426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 316.2416 Da; putative annotation: 5.beta.-Pregnane-3.alpha.,17-diol-20-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.468,"smiles":null,"spectrum_id":"CCMSLIB00017236300","spectrum_index":15427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-(3-Methoxybenzyl)-4-piperidinylamine (delta mass: 120.0671 Da; putative annotation: 4(1H)-Pyrimidinone, 6-(1-methylethyl)-; putative formula: C7H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.232,"smiles":null,"spectrum_id":"CCMSLIB00017236301","spectrum_index":15428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 232.1456 Da; putative annotation: (4aR,5S)-9-Hydroxy-3,4a,5-trimethyl-4,5,6,7,8,8a,9,9a-octahydrobenzo[f][1]benzofuran-2-one; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.346,"smiles":null,"spectrum_id":"CCMSLIB00017236304","spectrum_index":15429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 14(15)-EpETE from NIST14 (delta mass: 318.2189 Da; putative annotation: Prostaglandin F2.alpha. 1,11-lactone; putative formula: C20H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.446,"smiles":null,"spectrum_id":"CCMSLIB00017236305","spectrum_index":15430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 292.2017 Da; putative annotation: (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one; putative formula: C18H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.413,"smiles":null,"spectrum_id":"CCMSLIB00017236308","spectrum_index":15431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 338.2098 Da; putative annotation: (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid; putative formula: C19H30O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.421,"smiles":null,"spectrum_id":"CCMSLIB00017236309","spectrum_index":15432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 940.5024 Da; putative annotation: Massbank:PR304315 Soyasaponin Ba; putative formula: C48H76O18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1121.57,"smiles":null,"spectrum_id":"CCMSLIB00017236312","spectrum_index":15433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 232.143 Da; putative annotation: Hydroxyvalerenic acid; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.218,"smiles":null,"spectrum_id":"CCMSLIB00017236313","spectrum_index":15434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 198.1044 Da; putative annotation: (1R,6R)-6-Benzylcyclohex-3-enecarboxylic acid; putative formula: C14H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.18,"smiles":null,"spectrum_id":"CCMSLIB00017236316","spectrum_index":15435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 222.1982 Da; putative annotation: NCGC00385844-01_C15H28O2_7-(2-Hydroxy-2-propanyl)-1,4a-dimethyldecahydro-1-naphthalenol; putative formula: C15H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.466,"smiles":null,"spectrum_id":"CCMSLIB00017236317","spectrum_index":15436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 284.2123 Da; putative annotation: 10-Thiastearic acid; putative formula: C17H32OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.726,"smiles":null,"spectrum_id":"CCMSLIB00017236319","spectrum_index":15437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 238.2259 Da; putative annotation: 2-Hexyldecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.27,"smiles":null,"spectrum_id":"CCMSLIB00017236321","spectrum_index":15438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid (delta mass: 84.0615 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.201,"smiles":null,"spectrum_id":"CCMSLIB00017236322","spectrum_index":15439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Decen-1-ol, (E)- (delta mass: 113.0475 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.206,"smiles":null,"spectrum_id":"CCMSLIB00017236325","spectrum_index":15440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 41.0695 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.165,"smiles":null,"spectrum_id":"CCMSLIB00017236327","spectrum_index":15441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 71.073 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.149,"smiles":null,"spectrum_id":"CCMSLIB00017236329","spectrum_index":15442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 93.0416 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.409,"smiles":null,"spectrum_id":"CCMSLIB00017236331","spectrum_index":15443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lanosterol (delta mass: 191.1868 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.58,"smiles":null,"spectrum_id":"CCMSLIB00017236333","spectrum_index":15444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 363.3139 Da; putative annotation: N/A; putative formula: C23H41NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.567,"smiles":null,"spectrum_id":"CCMSLIB00017236334","spectrum_index":15445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 142.0395 Da; putative annotation: N/A; putative formula: C6H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.073,"smiles":null,"spectrum_id":"CCMSLIB00017236337","spectrum_index":15446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Glu (delta mass: 97.0528 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.166,"smiles":null,"spectrum_id":"CCMSLIB00017236338","spectrum_index":15447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 62.0513 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.304,"smiles":null,"spectrum_id":"CCMSLIB00017236341","spectrum_index":15448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palatinose (delta mass: 227.0946 Da; putative annotation: N/A; putative formula: C14H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.218,"smiles":null,"spectrum_id":"CCMSLIB00017236342","spectrum_index":15449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylbuphedrone (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.154,"smiles":null,"spectrum_id":"CCMSLIB00017236345","spectrum_index":15450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 82.0032 Da; putative annotation: N/A; putative formula: H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.079,"smiles":null,"spectrum_id":"CCMSLIB00017236346","spectrum_index":15451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 17.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.08,"smiles":null,"spectrum_id":"CCMSLIB00017236349","spectrum_index":15452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phytomonic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.289,"smiles":null,"spectrum_id":"CCMSLIB00017236350","spectrum_index":15453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E,8E)-9-[3a-hydroxy-6,7-dimethyl-1-(2-methylpropyl)-3-oxo-2,4,7,7a-tetrahydro-1H-isoindol-4-yl]-4,5-dihydroxy-8-methylnona-2,8-dienoate (delta mass: 136.0742 Da; putative annotation: N/A; putative formula: C6H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.359,"smiles":null,"spectrum_id":"CCMSLIB00017236352","spectrum_index":15454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 91.0358 Da; putative annotation: N/A; putative formula: CH5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.122,"smiles":null,"spectrum_id":"CCMSLIB00017236354","spectrum_index":15455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 671.2992 Da; putative annotation: N/A; putative formula: C41H41N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":852.37,"smiles":null,"spectrum_id":"CCMSLIB00017236356","spectrum_index":15456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 325.1644 Da; putative annotation: N/A; putative formula: C16H27N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.303,"smiles":null,"spectrum_id":"CCMSLIB00017236358","spectrum_index":15457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 11.0045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.101,"smiles":null,"spectrum_id":"CCMSLIB00017236360","spectrum_index":15458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 317.0786 Da; putative annotation: N/A; putative formula: C12H20N3OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.31,"smiles":null,"spectrum_id":"CCMSLIB00017236362","spectrum_index":15459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Abietic Acid (delta mass: 725.4841 Da; putative annotation: N/A; putative formula: C47H67NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1028.72,"smiles":null,"spectrum_id":"CCMSLIB00017236365","spectrum_index":15460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-serine (delta mass: 66.9916 Da; putative annotation: N/A; putative formula: C3HNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.057,"smiles":null,"spectrum_id":"CCMSLIB00017236366","spectrum_index":15461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 575.5283 Da; putative annotation: N/A; putative formula: C37H69NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.755,"smiles":null,"spectrum_id":"CCMSLIB00017236368","spectrum_index":15462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Castanospermine (delta mass: 95.071 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.178,"smiles":null,"spectrum_id":"CCMSLIB00017236371","spectrum_index":15463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 441.3091 Da; putative annotation: N/A; putative formula: C24H43NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.593,"smiles":null,"spectrum_id":"CCMSLIB00017236373","spectrum_index":15464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 126.0833 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.143,"smiles":null,"spectrum_id":"CCMSLIB00017236375","spectrum_index":15465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 96.9836 Da; putative annotation: N/A; putative formula: C2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.101,"smiles":null,"spectrum_id":"CCMSLIB00017236376","spectrum_index":15466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 275.1354 Da; putative annotation: N/A; putative formula: C16H23NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.227,"smiles":null,"spectrum_id":"CCMSLIB00017236379","spectrum_index":15467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 72.021 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.076,"smiles":null,"spectrum_id":"CCMSLIB00017236380","spectrum_index":15468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvaol (delta mass: 94.0379 Da; putative annotation: N/A; putative formula: C2H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.426,"smiles":null,"spectrum_id":"CCMSLIB00017236381","spectrum_index":15469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 86.0373 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.135,"smiles":null,"spectrum_id":"CCMSLIB00017236384","spectrum_index":15470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 82.0508 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.142,"smiles":null,"spectrum_id":"CCMSLIB00017236385","spectrum_index":15471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385369-01_C32H48O9_Card-20(22)-enolide, 16-(acetyloxy)-3-[(2,6-dideoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxy-, (3beta,5beta,8xi,9xi,16beta)- (delta mass: 78.0159 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.353,"smiles":null,"spectrum_id":"CCMSLIB00017236388","spectrum_index":15472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrotachysterol (delta mass: 82.0776 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.44,"smiles":null,"spectrum_id":"CCMSLIB00017236389","spectrum_index":15473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 309.3029 Da; putative annotation: N/A; putative formula: C20H39NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.399,"smiles":null,"spectrum_id":"CCMSLIB00017236392","spectrum_index":15474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 108.0937 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.289,"smiles":null,"spectrum_id":"CCMSLIB00017236393","spectrum_index":15475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to trans-EKODE-(E)-Ib from NIST14 (delta mass: 56.0256 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.247,"smiles":null,"spectrum_id":"CCMSLIB00017236396","spectrum_index":15476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 66.0434 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.124,"smiles":null,"spectrum_id":"CCMSLIB00017236397","spectrum_index":15477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 260.1172 Da; putative annotation: N/A; putative formula: C15H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.167,"smiles":null,"spectrum_id":"CCMSLIB00017236399","spectrum_index":15478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 256.1059 Da; putative annotation: N/A; putative formula: C11H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.208,"smiles":null,"spectrum_id":"CCMSLIB00017236402","spectrum_index":15479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 245.1376 Da; putative annotation: N/A; putative formula: C10H19N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.219,"smiles":null,"spectrum_id":"CCMSLIB00017236403","spectrum_index":15480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 17.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.092,"smiles":null,"spectrum_id":"CCMSLIB00017236406","spectrum_index":15481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.238,"smiles":null,"spectrum_id":"CCMSLIB00017236407","spectrum_index":15482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 114.0685 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017236410","spectrum_index":15483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 127.1216 Da; putative annotation: N/A; putative formula: C5H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.333,"smiles":null,"spectrum_id":"CCMSLIB00017236411","spectrum_index":15484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 135.0202 Da; putative annotation: N/A; putative formula: C2H6N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.236,"smiles":null,"spectrum_id":"CCMSLIB00017236413","spectrum_index":15485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 154.1569 Da; putative annotation: N/A; putative formula: C8H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.233,"smiles":null,"spectrum_id":"CCMSLIB00017236415","spectrum_index":15486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 239.102 Da; putative annotation: N/A; putative formula: C9H13N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.349,"smiles":null,"spectrum_id":"CCMSLIB00017236416","spectrum_index":15487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 79.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.123,"smiles":null,"spectrum_id":"CCMSLIB00017236419","spectrum_index":15488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 85.0779 Da; putative annotation: N/A; putative formula: C2H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.185,"smiles":null,"spectrum_id":"CCMSLIB00017236420","spectrum_index":15489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 88.0161 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017236423","spectrum_index":15490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonoylglycerol (delta mass: 90.0834 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.368,"smiles":null,"spectrum_id":"CCMSLIB00017236424","spectrum_index":15491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4,6-difluoro-1H-indole-2-carboxylate (delta mass: 14.0555 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017236427","spectrum_index":15492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desferrioxamine H (delta mass: 172.1211 Da; putative annotation: N/A; putative formula: C8H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.382,"smiles":null,"spectrum_id":"CCMSLIB00017236428","spectrum_index":15493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 150.0171 Da; putative annotation: N/A; putative formula: C5H10OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.082,"smiles":null,"spectrum_id":"CCMSLIB00017236431","spectrum_index":15494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLAMIDE (delta mass: 290.1991 Da; putative annotation: N/A; putative formula: C17H26N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.254,"smiles":null,"spectrum_id":"CCMSLIB00017236432","spectrum_index":15495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 369.2889 Da; putative annotation: N/A; putative formula: C22H43NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.5,"smiles":null,"spectrum_id":"CCMSLIB00017236434","spectrum_index":15496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 134.0768 Da; putative annotation: N/A; putative formula: C2H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.283,"smiles":null,"spectrum_id":"CCMSLIB00017236436","spectrum_index":15497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Strophantidin (delta mass: 140.0888 Da; putative annotation: N/A; putative formula: C7H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.316,"smiles":null,"spectrum_id":"CCMSLIB00017236439","spectrum_index":15498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 4.9999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.081,"smiles":null,"spectrum_id":"CCMSLIB00017236441","spectrum_index":15499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ADENOSINE 5'-MONOPHOSPHATE - 20.00 eV (delta mass: 304.0895 Da; putative annotation: N/A; putative formula: C16H12N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.16,"smiles":null,"spectrum_id":"CCMSLIB00017236443","spectrum_index":15500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 651.5433 Da; putative annotation: N/A; putative formula: C39H73NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":962.765,"smiles":null,"spectrum_id":"CCMSLIB00017236445","spectrum_index":15501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 12.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.113,"smiles":null,"spectrum_id":"CCMSLIB00017236447","spectrum_index":15502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Atranol (delta mass: 77.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017236448","spectrum_index":15503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 61.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.118,"smiles":null,"spectrum_id":"CCMSLIB00017236451","spectrum_index":15504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 53.0262 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.113,"smiles":null,"spectrum_id":"CCMSLIB00017236452","spectrum_index":15505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 117.0446 Da; putative annotation: N/A; putative formula: C5H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.12,"smiles":null,"spectrum_id":"CCMSLIB00017236455","spectrum_index":15506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-3,4-(methylenedioxy)benzylamine (delta mass: 34.9873 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.074,"smiles":null,"spectrum_id":"CCMSLIB00017236456","spectrum_index":15507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mangiferin (delta mass: 162.0527 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.145,"smiles":null,"spectrum_id":"CCMSLIB00017236459","spectrum_index":15508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 751.2681 Da; putative annotation: N/A; putative formula: C48H37N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.349,"smiles":null,"spectrum_id":"CCMSLIB00017236460","spectrum_index":15509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-acetyloxy-8-(3-oxo-2-pent-2-enylcyclopenten-1-yl)octanoic acid (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.227,"smiles":null,"spectrum_id":"CCMSLIB00017236463","spectrum_index":15510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 60.0416 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.284,"smiles":null,"spectrum_id":"CCMSLIB00017236464","spectrum_index":15511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 106.0533 Da; putative annotation: N/A; putative formula: C6H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.113,"smiles":null,"spectrum_id":"CCMSLIB00017236467","spectrum_index":15512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 17.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.082,"smiles":null,"spectrum_id":"CCMSLIB00017236468","spectrum_index":15513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 121.0195 Da; putative annotation: N/A; putative formula: C5H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.174,"smiles":null,"spectrum_id":"CCMSLIB00017236471","spectrum_index":15514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 90.0498 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017236472","spectrum_index":15515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 50.0518 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.31,"smiles":null,"spectrum_id":"CCMSLIB00017236475","spectrum_index":15516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 197.1409 Da; putative annotation: N/A; putative formula: C11H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.259,"smiles":null,"spectrum_id":"CCMSLIB00017236476","spectrum_index":15517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Lauroyl-D-erythro-sphinganine (delta mass: 80.0623 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.535,"smiles":null,"spectrum_id":"CCMSLIB00017236479","spectrum_index":15518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 414.3138 Da; putative annotation: N/A; putative formula: C20H42N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.437,"smiles":null,"spectrum_id":"CCMSLIB00017236480","spectrum_index":15519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 193.167 Da; putative annotation: N/A; putative formula: C10H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.383,"smiles":null,"spectrum_id":"CCMSLIB00017236483","spectrum_index":15520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 80.0633 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.379,"smiles":null,"spectrum_id":"CCMSLIB00017236484","spectrum_index":15521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 177.0635 Da; putative annotation: N/A; putative formula: C6H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.129,"smiles":null,"spectrum_id":"CCMSLIB00017236486","spectrum_index":15522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Acetyl-L-serine (delta mass: 69.0218 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.082,"smiles":null,"spectrum_id":"CCMSLIB00017236488","spectrum_index":15523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 517.1645 Da; putative annotation: N/A; putative formula: C24H23N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.235,"smiles":null,"spectrum_id":"CCMSLIB00017236491","spectrum_index":15524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 165.0731 Da; putative annotation: N/A; putative formula: C8H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.17,"smiles":null,"spectrum_id":"CCMSLIB00017236492","spectrum_index":15525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 66.0219 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.119,"smiles":null,"spectrum_id":"CCMSLIB00017236494","spectrum_index":15526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Barpisoflavone A (delta mass: 160.0742 Da; putative annotation: N/A; putative formula: C8H16O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.145,"smiles":null,"spectrum_id":"CCMSLIB00017236496","spectrum_index":15527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385654-01!7-hydroxy-6-methoxy-8-(3-methylbut-2-enyl)chromen-2-one (delta mass: 136.1289 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.241,"smiles":null,"spectrum_id":"CCMSLIB00017236499","spectrum_index":15528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spiculisporic acid (delta mass: 345.2108 Da; putative annotation: N/A; putative formula: C17H27N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.407,"smiles":null,"spectrum_id":"CCMSLIB00017236501","spectrum_index":15529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic LL-D253.alpha. (delta mass: 356.0929 Da; putative annotation: N/A; putative formula: C16H20O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.2,"smiles":null,"spectrum_id":"CCMSLIB00017236503","spectrum_index":15530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxybenzoic acid (delta mass: 462.2253 Da; putative annotation: N/A; putative formula: C25H34O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.291,"smiles":null,"spectrum_id":"CCMSLIB00017236505","spectrum_index":15531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 231.1097 Da; putative annotation: N/A; putative formula: C14H17NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.206,"smiles":null,"spectrum_id":"CCMSLIB00017236507","spectrum_index":15532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 17.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.112,"smiles":null,"spectrum_id":"CCMSLIB00017236509","spectrum_index":15533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Difluoromethoxy)benzoic acid (delta mass: 47.0378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.074,"smiles":null,"spectrum_id":"CCMSLIB00017236511","spectrum_index":15534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diaminopropane-N,N,N',N'-tetraacetic acid (delta mass: 173.0694 Da; putative annotation: N/A; putative formula: C8H15NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.183,"smiles":null,"spectrum_id":"CCMSLIB00017236513","spectrum_index":15535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 32.0348 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.168,"smiles":null,"spectrum_id":"CCMSLIB00017236515","spectrum_index":15536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 26.025 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.148,"smiles":null,"spectrum_id":"CCMSLIB00017236518","spectrum_index":15537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 18.0096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.278,"smiles":null,"spectrum_id":"CCMSLIB00017236520","spectrum_index":15538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3-(2-Hydroxyethyl)indole from NIST14 (delta mass: 92.0819 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.173,"smiles":null,"spectrum_id":"CCMSLIB00017236522","spectrum_index":15539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 311.1258 Da; putative annotation: N/A; putative formula: C19H22NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.29,"smiles":null,"spectrum_id":"CCMSLIB00017236524","spectrum_index":15540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 44.9831 Da; putative annotation: N/A; putative formula: H-1NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.033,"smiles":null,"spectrum_id":"CCMSLIB00017236526","spectrum_index":15541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid [M+H-H2O]+; AIF: CE0; MS2Dec (delta mass: 301.1058 Da; putative annotation: N/A; putative formula: C7H19N5O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.176,"smiles":null,"spectrum_id":"CCMSLIB00017236528","spectrum_index":15542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Phenylpropyl)piperidine (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.186,"smiles":null,"spectrum_id":"CCMSLIB00017236531","spectrum_index":15543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 141.0755 Da; putative annotation: N/A; putative formula: C3H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.202,"smiles":null,"spectrum_id":"CCMSLIB00017236532","spectrum_index":15544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manoalide (delta mass: 112.0775 Da; putative annotation: N/A; putative formula: C4H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.341,"smiles":null,"spectrum_id":"CCMSLIB00017236535","spectrum_index":15545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017236536","spectrum_index":15546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 46.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.3,"smiles":null,"spectrum_id":"CCMSLIB00017236539","spectrum_index":15547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylputrescine; AIF; CE0; CorrDec (delta mass: 134.0365 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.154,"smiles":null,"spectrum_id":"CCMSLIB00017236540","spectrum_index":15548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 43.0128 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.13,"smiles":null,"spectrum_id":"CCMSLIB00017236543","spectrum_index":15549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 103.0859 Da; putative annotation: N/A; putative formula: C2H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.339,"smiles":null,"spectrum_id":"CCMSLIB00017236544","spectrum_index":15550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 117.043 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.161,"smiles":null,"spectrum_id":"CCMSLIB00017236547","spectrum_index":15551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 147.0533 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017236548","spectrum_index":15552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 55.0312 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.191,"smiles":null,"spectrum_id":"CCMSLIB00017236551","spectrum_index":15553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 40.9984 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.085,"smiles":null,"spectrum_id":"CCMSLIB00017236552","spectrum_index":15554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 267.1838 Da; putative annotation: N/A; putative formula: C15H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.364,"smiles":null,"spectrum_id":"CCMSLIB00017236555","spectrum_index":15555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 23.014 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017236556","spectrum_index":15556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4a-Dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 25.0322 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.238,"smiles":null,"spectrum_id":"CCMSLIB00017236559","spectrum_index":15557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anemosapogenin (delta mass: 23.0157 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.378,"smiles":null,"spectrum_id":"CCMSLIB00017236560","spectrum_index":15558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 213.0839 Da; putative annotation: N/A; putative formula: C10H17NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.269,"smiles":null,"spectrum_id":"CCMSLIB00017236563","spectrum_index":15559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 132.0795 Da; putative annotation: N/A; putative formula: C7H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.186,"smiles":null,"spectrum_id":"CCMSLIB00017236564","spectrum_index":15560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 92.0717 Da; putative annotation: N/A; putative formula: C6H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.346,"smiles":null,"spectrum_id":"CCMSLIB00017236567","spectrum_index":15561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 221.1316 Da; putative annotation: N/A; putative formula: C15H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.212,"smiles":null,"spectrum_id":"CCMSLIB00017236568","spectrum_index":15562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 504.1696 Da; putative annotation: N/A; putative formula: C21H33N2O8PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.23,"smiles":null,"spectrum_id":"CCMSLIB00017236570","spectrum_index":15563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 1074.5362 Da; putative annotation: N/A; putative formula: C56H80N6O11P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1255.61,"smiles":null,"spectrum_id":"CCMSLIB00017236572","spectrum_index":15564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,18.Xi.)-3-Oxolup-20(29)-ene-27,28-dioic acid (delta mass: 36.0192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.345,"smiles":null,"spectrum_id":"CCMSLIB00017236575","spectrum_index":15565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3,4-Dimethylbenzoic acid from NIST14 (delta mass: 52.0674 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.143,"smiles":null,"spectrum_id":"CCMSLIB00017236576","spectrum_index":15566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S-Hydroxy-9E,11Z,14Z-eicosatrienoic acid (delta mass: 45.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.315,"smiles":null,"spectrum_id":"CCMSLIB00017236579","spectrum_index":15567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 218.0205 Da; putative annotation: N/A; putative formula: C5H7N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.112,"smiles":null,"spectrum_id":"CCMSLIB00017236580","spectrum_index":15568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 202.0299 Da; putative annotation: N/A; putative formula: C8H10O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.126,"smiles":null,"spectrum_id":"CCMSLIB00017236583","spectrum_index":15569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 130.1509 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.231,"smiles":null,"spectrum_id":"CCMSLIB00017236584","spectrum_index":15570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 332.2066 Da; putative annotation: N/A; putative formula: C15H32N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.33,"smiles":null,"spectrum_id":"CCMSLIB00017236586","spectrum_index":15571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 59.1075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.179,"smiles":null,"spectrum_id":"CCMSLIB00017236588","spectrum_index":15572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 29.9932 Da; putative annotation: N/A; putative formula: CH2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.194,"smiles":null,"spectrum_id":"CCMSLIB00017236589","spectrum_index":15573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 518.3464 Da; putative annotation: N/A; putative formula: C28H54O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.552,"smiles":null,"spectrum_id":"CCMSLIB00017236592","spectrum_index":15574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 434.3039 Da; putative annotation: N/A; putative formula: C27H46S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.364,"smiles":null,"spectrum_id":"CCMSLIB00017236593","spectrum_index":15575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,16.Xi.)-17-Hydroxykauran-19-oic acid (delta mass: 160.1276 Da; putative annotation: N/A; putative formula: C12H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.37,"smiles":null,"spectrum_id":"CCMSLIB00017236596","spectrum_index":15576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheptanol (delta mass: 186.0528 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.164,"smiles":null,"spectrum_id":"CCMSLIB00017236597","spectrum_index":15577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 14.9365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.997,"smiles":null,"spectrum_id":"CCMSLIB00017236599","spectrum_index":15578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Pyrrolidinylcarbonyl)piperidine (delta mass: 5.0308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.18,"smiles":null,"spectrum_id":"CCMSLIB00017236601","spectrum_index":15579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 182.1622 Da; putative annotation: N/A; putative formula: C8H18N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.285,"smiles":null,"spectrum_id":"CCMSLIB00017236603","spectrum_index":15580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 172.1653 Da; putative annotation: N/A; putative formula: C8H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.241,"smiles":null,"spectrum_id":"CCMSLIB00017236605","spectrum_index":15581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 529.2789 Da; putative annotation: N/A; putative formula: C28H39N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1025.62,"smiles":null,"spectrum_id":"CCMSLIB00017236607","spectrum_index":15582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 69.02 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017236609","spectrum_index":15583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 92.083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.169,"smiles":null,"spectrum_id":"CCMSLIB00017236612","spectrum_index":15584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 76.1116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.192,"smiles":null,"spectrum_id":"CCMSLIB00017236613","spectrum_index":15585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11-Eicosenoic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.305,"smiles":null,"spectrum_id":"CCMSLIB00017236616","spectrum_index":15586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linalool oxide (delta mass: 294.0954 Da; putative annotation: N/A; putative formula: C14H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.233,"smiles":null,"spectrum_id":"CCMSLIB00017236617","spectrum_index":15587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 193.1472 Da; putative annotation: N/A; putative formula: C12H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.41,"smiles":null,"spectrum_id":"CCMSLIB00017236620","spectrum_index":15588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-11-(3-pentyl-2-oxiranyl)-10E-undecenoic acid (delta mass: 46.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.263,"smiles":null,"spectrum_id":"CCMSLIB00017236621","spectrum_index":15589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-2-methylpropiophenone (delta mass: 185.1056 Da; putative annotation: N/A; putative formula: C9H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.197,"smiles":null,"spectrum_id":"CCMSLIB00017236624","spectrum_index":15590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumigaclavine A (delta mass: 17.0352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.211,"smiles":null,"spectrum_id":"CCMSLIB00017236625","spectrum_index":15591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:TUE00651 Sotalol (delta mass: 5.015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.142,"smiles":null,"spectrum_id":"CCMSLIB00017236628","spectrum_index":15592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 230.159 Da; putative annotation: N/A; putative formula: C16H23O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.303,"smiles":null,"spectrum_id":"CCMSLIB00017236629","spectrum_index":15593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-7,12-Dihydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 116.0623 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.269,"smiles":null,"spectrum_id":"CCMSLIB00017236631","spectrum_index":15594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,14-Trihydroxypregn-7-ene-6,20-dione (delta mass: 31.079 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.296,"smiles":null,"spectrum_id":"CCMSLIB00017236633","spectrum_index":15595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinamine (delta mass: 38.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.155,"smiles":null,"spectrum_id":"CCMSLIB00017236635","spectrum_index":15596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxy-3-(trifluoromethyl)benzoic acid (delta mass: 52.0396 Da; putative annotation: N/A; putative formula: C3H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.082,"smiles":null,"spectrum_id":"CCMSLIB00017236637","spectrum_index":15597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Aminobenzoic acid (delta mass: 51.0391 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.094,"smiles":null,"spectrum_id":"CCMSLIB00017236638","spectrum_index":15598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 50.988 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.09,"smiles":null,"spectrum_id":"CCMSLIB00017236641","spectrum_index":15599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 28.9915 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.051,"smiles":null,"spectrum_id":"CCMSLIB00017236642","spectrum_index":15600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 68.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.118,"smiles":null,"spectrum_id":"CCMSLIB00017236645","spectrum_index":15601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 130.0814 Da; putative annotation: N/A; putative formula: C7H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.287,"smiles":null,"spectrum_id":"CCMSLIB00017236646","spectrum_index":15602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 143.0781 Da; putative annotation: N/A; putative formula: H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.143,"smiles":null,"spectrum_id":"CCMSLIB00017236649","spectrum_index":15603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 56.0138 Da; putative annotation: N/A; putative formula: N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.074,"smiles":null,"spectrum_id":"CCMSLIB00017236650","spectrum_index":15604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 580.4821 Da; putative annotation: N/A; putative formula: C35H68N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.74,"smiles":null,"spectrum_id":"CCMSLIB00017236652","spectrum_index":15605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 15.0111 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.102,"smiles":null,"spectrum_id":"CCMSLIB00017236654","spectrum_index":15606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 156.1152 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.18,"smiles":null,"spectrum_id":"CCMSLIB00017236656","spectrum_index":15607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 87.0679 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.149,"smiles":null,"spectrum_id":"CCMSLIB00017236658","spectrum_index":15608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 47.045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.143,"smiles":null,"spectrum_id":"CCMSLIB00017236659","spectrum_index":15609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 159.0346 Da; putative annotation: N/A; putative formula: C6H9NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.121,"smiles":null,"spectrum_id":"CCMSLIB00017236662","spectrum_index":15610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 397.2685 Da; putative annotation: N/A; putative formula: C19H35N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.344,"smiles":null,"spectrum_id":"CCMSLIB00017236663","spectrum_index":15611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-1-piperazinyl)acetic acid (delta mass: 16.9772 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.09,"smiles":null,"spectrum_id":"CCMSLIB00017236666","spectrum_index":15612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380617-01_C16H26O4_1-Oxaspiro[2.5]octan-6-ol, 5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methyl-2-buten-1-yl)oxiranyl]-, (3R,4S,5S,6R)- (delta mass: 18.0118 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.202,"smiles":null,"spectrum_id":"CCMSLIB00017236667","spectrum_index":15613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 38.0547 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.183,"smiles":null,"spectrum_id":"CCMSLIB00017236670","spectrum_index":15614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 245.1622 Da; putative annotation: N/A; putative formula: C12H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.384,"smiles":null,"spectrum_id":"CCMSLIB00017236671","spectrum_index":15615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid (delta mass: 65.0282 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.094,"smiles":null,"spectrum_id":"CCMSLIB00017236673","spectrum_index":15616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Minoxidil (delta mass: 17.0033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.138,"smiles":null,"spectrum_id":"CCMSLIB00017236675","spectrum_index":15617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 48.0237 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.1,"smiles":null,"spectrum_id":"CCMSLIB00017236677","spectrum_index":15618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 82.0417 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.263,"smiles":null,"spectrum_id":"CCMSLIB00017236679","spectrum_index":15619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 24.0127 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.088,"smiles":null,"spectrum_id":"CCMSLIB00017236682","spectrum_index":15620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-5-carboxamide (delta mass: 72.0349 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.106,"smiles":null,"spectrum_id":"CCMSLIB00017236684","spectrum_index":15621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Wilforlide A (delta mass: 114.0901 Da; putative annotation: N/A; putative formula: C4H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.442,"smiles":null,"spectrum_id":"CCMSLIB00017236686","spectrum_index":15622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 71.012 Da; putative annotation: N/A; putative formula: CHN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.062,"smiles":null,"spectrum_id":"CCMSLIB00017236688","spectrum_index":15623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 62.0447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.536,"smiles":null,"spectrum_id":"CCMSLIB00017236690","spectrum_index":15624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoerucin (delta mass: 36.0348 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.397,"smiles":null,"spectrum_id":"CCMSLIB00017236692","spectrum_index":15625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 120.0408 Da; putative annotation: N/A; putative formula: C8H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.21,"smiles":null,"spectrum_id":"CCMSLIB00017236694","spectrum_index":15626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 289.1878 Da; putative annotation: N/A; putative formula: C11H19N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.399,"smiles":null,"spectrum_id":"CCMSLIB00017236696","spectrum_index":15627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipalmitolein (9c) (delta mass: 56.0633 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.546,"smiles":null,"spectrum_id":"CCMSLIB00017236699","spectrum_index":15628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 86.0373 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.129,"smiles":null,"spectrum_id":"CCMSLIB00017236701","spectrum_index":15629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 168.1214 Da; putative annotation: N/A; putative formula: C5H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.233,"smiles":null,"spectrum_id":"CCMSLIB00017236703","spectrum_index":15630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid ethyl ester (delta mass: 102.0469 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.117,"smiles":null,"spectrum_id":"CCMSLIB00017236705","spectrum_index":15631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 517.1647 Da; putative annotation: N/A; putative formula: C21H32N3O8PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.288,"smiles":null,"spectrum_id":"CCMSLIB00017236707","spectrum_index":15632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 9H-carbazole-3-carboxylate (delta mass: 16.9981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.1,"smiles":null,"spectrum_id":"CCMSLIB00017236709","spectrum_index":15633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 222.7712 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.873,"smiles":null,"spectrum_id":"CCMSLIB00017236711","spectrum_index":15634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 30.0 eV (delta mass: 517.3373 Da; putative annotation: N/A; putative formula: C26H51N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.461,"smiles":null,"spectrum_id":"CCMSLIB00017236714","spectrum_index":15635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 13.0317 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.264,"smiles":null,"spectrum_id":"CCMSLIB00017236715","spectrum_index":15636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 84.0207 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.149,"smiles":null,"spectrum_id":"CCMSLIB00017236718","spectrum_index":15637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 42.8927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017236719","spectrum_index":15638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 633.5331 Da; putative annotation: N/A; putative formula: C39H71NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":928.76,"smiles":null,"spectrum_id":"CCMSLIB00017236721","spectrum_index":15639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 298.271 Da; putative annotation: N/A; putative formula: C12H30N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.448,"smiles":null,"spectrum_id":"CCMSLIB00017236723","spectrum_index":15640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N''-(4,6-Dimethyl-2-pyrimidinyl)-N-[2-(4-methoxyphenyl)ethyl]guanidine (delta mass: 63.0667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.249,"smiles":null,"spectrum_id":"CCMSLIB00017236724","spectrum_index":15641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 239.5984 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.696,"smiles":null,"spectrum_id":"CCMSLIB00017236727","spectrum_index":15642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 166.1206 Da; putative annotation: N/A; putative formula: C8H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.207,"smiles":null,"spectrum_id":"CCMSLIB00017236728","spectrum_index":15643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 653.5587 Da; putative annotation: N/A; putative formula: C39H75NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":948.786,"smiles":null,"spectrum_id":"CCMSLIB00017236730","spectrum_index":15644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 120.0938 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017236732","spectrum_index":15645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-N-stearoylsphingosine (delta mass: 331.2752 Da; putative annotation: N/A; putative formula: C19H33N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.565,"smiles":null,"spectrum_id":"CCMSLIB00017236735","spectrum_index":15646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 59.0191 Da; putative annotation: N/A; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.079,"smiles":null,"spectrum_id":"CCMSLIB00017236736","spectrum_index":15647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE (delta mass: 155.07 Da; putative annotation: N/A; putative formula: C6H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.157,"smiles":null,"spectrum_id":"CCMSLIB00017236738","spectrum_index":15648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dextrorphan (delta mass: 196.1162 Da; putative annotation: N/A; putative formula: C9H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.301,"smiles":null,"spectrum_id":"CCMSLIB00017236740","spectrum_index":15649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 59.9848 Da; putative annotation: N/A; putative formula: CO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.06,"smiles":null,"spectrum_id":"CCMSLIB00017236742","spectrum_index":15650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 36.0363 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017236744","spectrum_index":15651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 291.0283 Da; putative annotation: N/A; putative formula: C8H13N5OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.078,"smiles":null,"spectrum_id":"CCMSLIB00017236746","spectrum_index":15652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 130.0992 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.217,"smiles":null,"spectrum_id":"CCMSLIB00017236749","spectrum_index":15653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 351.2049 Da; putative annotation: N/A; putative formula: C19H29NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.276,"smiles":null,"spectrum_id":"CCMSLIB00017236751","spectrum_index":15654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 376.1726 Da; putative annotation: N/A; putative formula: C22H24N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.233,"smiles":null,"spectrum_id":"CCMSLIB00017236753","spectrum_index":15655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 342.1172 Da; putative annotation: N/A; putative formula: C13H26O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.209,"smiles":null,"spectrum_id":"CCMSLIB00017236755","spectrum_index":15656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 45.0296 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.152,"smiles":null,"spectrum_id":"CCMSLIB00017236757","spectrum_index":15657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 72.0356 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.206,"smiles":null,"spectrum_id":"CCMSLIB00017236758","spectrum_index":15658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Aminobenzoic acid (delta mass: 243.0996 Da; putative annotation: N/A; putative formula: C13H13N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.155,"smiles":null,"spectrum_id":"CCMSLIB00017236761","spectrum_index":15659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 200.2133 Da; putative annotation: N/A; putative formula: C9H24N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.305,"smiles":null,"spectrum_id":"CCMSLIB00017236762","spectrum_index":15660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 129.3427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.57,"smiles":null,"spectrum_id":"CCMSLIB00017236765","spectrum_index":15661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.227,"smiles":null,"spectrum_id":"CCMSLIB00017236766","spectrum_index":15662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 730.4301 Da; putative annotation: N/A; putative formula: C52H59OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.501,"smiles":null,"spectrum_id":"CCMSLIB00017236768","spectrum_index":15663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 129.0575 Da; putative annotation: N/A; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.144,"smiles":null,"spectrum_id":"CCMSLIB00017236770","spectrum_index":15664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380997-01_C27H39NO3_(3beta,9xi,22S,23R)-3-Hydroxy-17,23-epoxyveratraman-11-one (delta mass: 71.0587 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.359,"smiles":null,"spectrum_id":"CCMSLIB00017236772","spectrum_index":15665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3r,5r,7r)-Adamantan-1-yl)piperidine (delta mass: 17.0156 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.222,"smiles":null,"spectrum_id":"CCMSLIB00017236774","spectrum_index":15666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 138.0932 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.232,"smiles":null,"spectrum_id":"CCMSLIB00017236776","spectrum_index":15667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 130.0783 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.306,"smiles":null,"spectrum_id":"CCMSLIB00017236778","spectrum_index":15668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 47.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.093,"smiles":null,"spectrum_id":"CCMSLIB00017236781","spectrum_index":15669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 303.1292 Da; putative annotation: N/A; putative formula: C17H21NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.351,"smiles":null,"spectrum_id":"CCMSLIB00017236782","spectrum_index":15670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 62.0516 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.284,"smiles":null,"spectrum_id":"CCMSLIB00017236785","spectrum_index":15671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 482.0737 Da; putative annotation: N/A; putative formula: C23H14N8OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.165,"smiles":null,"spectrum_id":"CCMSLIB00017236788","spectrum_index":15672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.284,"smiles":null,"spectrum_id":"CCMSLIB00017236790","spectrum_index":15673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.102,"smiles":null,"spectrum_id":"CCMSLIB00017236792","spectrum_index":15674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-OxoOTrE from NIST14 (delta mass: 54.0505 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.262,"smiles":null,"spectrum_id":"CCMSLIB00017236794","spectrum_index":15675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 345.178 Da; putative annotation: N/A; putative formula: C13H19N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.238,"smiles":null,"spectrum_id":"CCMSLIB00017236796","spectrum_index":15676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 18.0182 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.088,"smiles":null,"spectrum_id":"CCMSLIB00017236797","spectrum_index":15677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-(3-Hydroxy-2,3-dimethyl-2-bicyclo[2.2.1]heptanyl)-2-methylpent-2-enoic acid (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.206,"smiles":null,"spectrum_id":"CCMSLIB00017236800","spectrum_index":15678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxy-4Z,7Z,10Z,13Z,16Z,18E-docosahexaenoic acid (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.253,"smiles":null,"spectrum_id":"CCMSLIB00017236801","spectrum_index":15679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLAMIDE (delta mass: 147.085 Da; putative annotation: N/A; putative formula: C2H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.14,"smiles":null,"spectrum_id":"CCMSLIB00017236804","spectrum_index":15680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Methyl-6-oxopyran-3-yl)butanoic acid (delta mass: 24.0362 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017236805","spectrum_index":15681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 341.2026 Da; putative annotation: N/A; putative formula: C18H31NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.357,"smiles":null,"spectrum_id":"CCMSLIB00017236807","spectrum_index":15682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 85.9958 Da; putative annotation: N/A; putative formula: C2H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.071,"smiles":null,"spectrum_id":"CCMSLIB00017236809","spectrum_index":15683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxynicotinic acid (delta mass: 112.0884 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017236811","spectrum_index":15684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 83.07 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.145,"smiles":null,"spectrum_id":"CCMSLIB00017236813","spectrum_index":15685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.3,"smiles":null,"spectrum_id":"CCMSLIB00017236814","spectrum_index":15686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 64.0309 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.211,"smiles":null,"spectrum_id":"CCMSLIB00017236817","spectrum_index":15687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 316.2615 Da; putative annotation: N/A; putative formula: C18H36O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.327,"smiles":null,"spectrum_id":"CCMSLIB00017236818","spectrum_index":15688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 869.2867 Da; putative annotation: N/A; putative formula: C63H39N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1536.52,"smiles":null,"spectrum_id":"CCMSLIB00017236821","spectrum_index":15689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 27.9953 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.034,"smiles":null,"spectrum_id":"CCMSLIB00017236822","spectrum_index":15690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 99.1137 Da; putative annotation: N/A; putative formula: C5H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017236825","spectrum_index":15691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,16-Dimethylprostaglandin A1 (delta mass: 38.0518 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017236826","spectrum_index":15692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 72.0671 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.164,"smiles":null,"spectrum_id":"CCMSLIB00017236829","spectrum_index":15693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 193.0371 Da; putative annotation: N/A; putative formula: C10H5F2NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.108,"smiles":null,"spectrum_id":"CCMSLIB00017236830","spectrum_index":15694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 146.0368 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.102,"smiles":null,"spectrum_id":"CCMSLIB00017236833","spectrum_index":15695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 149.0842 Da; putative annotation: N/A; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.332,"smiles":null,"spectrum_id":"CCMSLIB00017236834","spectrum_index":15696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 328.1612 Da; putative annotation: N/A; putative formula: C6H17N16O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.202,"smiles":null,"spectrum_id":"CCMSLIB00017236837","spectrum_index":15697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Salicylic acid (delta mass: 77.084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017236838","spectrum_index":15698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,8-Difluoro-3-azabicyclo[3.2.1]octane (delta mass: 64.0247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.118,"smiles":null,"spectrum_id":"CCMSLIB00017236841","spectrum_index":15699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 112.1016 Da; putative annotation: N/A; putative formula: C6H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.24,"smiles":null,"spectrum_id":"CCMSLIB00017236842","spectrum_index":15700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 98.0004 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.045,"smiles":null,"spectrum_id":"CCMSLIB00017236844","spectrum_index":15701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 87.0682 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.154,"smiles":null,"spectrum_id":"CCMSLIB00017236846","spectrum_index":15702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 101.0947 Da; putative annotation: N/A; putative formula: C4H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.15,"smiles":null,"spectrum_id":"CCMSLIB00017236847","spectrum_index":15703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 395.1791 Da; putative annotation: N/A; putative formula: C16H29NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.25,"smiles":null,"spectrum_id":"CCMSLIB00017236850","spectrum_index":15704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PETROSELINIC ACID (delta mass: 60.0564 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.32,"smiles":null,"spectrum_id":"CCMSLIB00017236851","spectrum_index":15705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 74.047 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.3,"smiles":null,"spectrum_id":"CCMSLIB00017236854","spectrum_index":15706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 90.0875 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.346,"smiles":null,"spectrum_id":"CCMSLIB00017236855","spectrum_index":15707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 126.0901 Da; putative annotation: N/A; putative formula: C5H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.353,"smiles":null,"spectrum_id":"CCMSLIB00017236858","spectrum_index":15708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 132.094 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017236859","spectrum_index":15709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 43.9903 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.077,"smiles":null,"spectrum_id":"CCMSLIB00017236862","spectrum_index":15710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperazinyl)acetamide (delta mass: 74.016 Da; putative annotation: N/A; putative formula: C6H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.129,"smiles":null,"spectrum_id":"CCMSLIB00017236863","spectrum_index":15711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.091,"smiles":null,"spectrum_id":"CCMSLIB00017236866","spectrum_index":15712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 339.2763 Da; putative annotation: N/A; putative formula: C20H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.363,"smiles":null,"spectrum_id":"CCMSLIB00017236867","spectrum_index":15713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 503.1737 Da; putative annotation: N/A; putative formula: C25H33N3O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.214,"smiles":null,"spectrum_id":"CCMSLIB00017236870","spectrum_index":15714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xysmalogenin (delta mass: 103.0994 Da; putative annotation: N/A; putative formula: CH9N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.337,"smiles":null,"spectrum_id":"CCMSLIB00017236871","spectrum_index":15715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 250.1167 Da; putative annotation: N/A; putative formula: C9H18N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.297,"smiles":null,"spectrum_id":"CCMSLIB00017236872","spectrum_index":15716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-4(Z),7(Z),10(Z),13(Z),15(E),19(Z)-docosahexaenoic acid (delta mass: 71.0135 Da; putative annotation: N/A; putative formula: CHN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.24,"smiles":null,"spectrum_id":"CCMSLIB00017236875","spectrum_index":15717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 84.0939 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.17,"smiles":null,"spectrum_id":"CCMSLIB00017236876","spectrum_index":15718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 273.1301 Da; putative annotation: N/A; putative formula: C15H19N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.171,"smiles":null,"spectrum_id":"CCMSLIB00017236879","spectrum_index":15719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 173.0944 Da; putative annotation: N/A; putative formula: C10H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017236880","spectrum_index":15720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 69.0538 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.197,"smiles":null,"spectrum_id":"CCMSLIB00017236883","spectrum_index":15721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 361.2806 Da; putative annotation: N/A; putative formula: C23H39NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.502,"smiles":null,"spectrum_id":"CCMSLIB00017236884","spectrum_index":15722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grindelic acid (delta mass: 78.0828 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.325,"smiles":null,"spectrum_id":"CCMSLIB00017236887","spectrum_index":15723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumenol (delta mass: 126.0081 Da; putative annotation: N/A; putative formula: C5H-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.177,"smiles":null,"spectrum_id":"CCMSLIB00017236888","spectrum_index":15724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Eicosenoic acid (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.316,"smiles":null,"spectrum_id":"CCMSLIB00017236891","spectrum_index":15725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of VANILLIN (delta mass: 128.0478 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017236892","spectrum_index":15726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(2-Chlorophenyl)sulfonyl]piperazine (delta mass: 38.0241 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.07,"smiles":null,"spectrum_id":"CCMSLIB00017236895","spectrum_index":15727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bonactin (delta mass: 212.1411 Da; putative annotation: N/A; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.394,"smiles":null,"spectrum_id":"CCMSLIB00017236896","spectrum_index":15728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 46.8969 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.967,"smiles":null,"spectrum_id":"CCMSLIB00017236899","spectrum_index":15729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 701.5153 Da; putative annotation: N/A; putative formula: C33H67N9O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1054.78,"smiles":null,"spectrum_id":"CCMSLIB00017236900","spectrum_index":15730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(6-Aminohexanamido)hexanoic acid (delta mass: 127.0633 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.249,"smiles":null,"spectrum_id":"CCMSLIB00017236903","spectrum_index":15731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301780 Chelidonin|(+)-Chelidonine|[1,3]Benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridin-6-ol, 5b,6,7,12b,13,14-hexahydro-13-methyl-, (5bR,6S,12bS)- (delta mass: 28.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.202,"smiles":null,"spectrum_id":"CCMSLIB00017236904","spectrum_index":15732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 45.021 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.216,"smiles":null,"spectrum_id":"CCMSLIB00017236907","spectrum_index":15733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 154.1064 Da; putative annotation: N/A; putative formula: C4H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.26,"smiles":null,"spectrum_id":"CCMSLIB00017236908","spectrum_index":15734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.259,"smiles":null,"spectrum_id":"CCMSLIB00017236911","spectrum_index":15735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Testosterone (delta mass: 124.0887 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017236912","spectrum_index":15736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 146.1103 Da; putative annotation: N/A; putative formula: C11H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.337,"smiles":null,"spectrum_id":"CCMSLIB00017236915","spectrum_index":15737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Hydroperoxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 28.031 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.253,"smiles":null,"spectrum_id":"CCMSLIB00017236916","spectrum_index":15738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 341.1257 Da; putative annotation: N/A; putative formula: C11H23N3O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":954.608,"smiles":null,"spectrum_id":"CCMSLIB00017236919","spectrum_index":15739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 168.0859 Da; putative annotation: N/A; putative formula: C4H8N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.13,"smiles":null,"spectrum_id":"CCMSLIB00017236920","spectrum_index":15740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 176.0623 Da; putative annotation: N/A; putative formula: C14H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.149,"smiles":null,"spectrum_id":"CCMSLIB00017236921","spectrum_index":15741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 93.0578 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.144,"smiles":null,"spectrum_id":"CCMSLIB00017236924","spectrum_index":15742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 871.4938 Da; putative annotation: N/A; putative formula: C58H61N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1052.56,"smiles":null,"spectrum_id":"CCMSLIB00017236925","spectrum_index":15743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 145.0703 Da; putative annotation: N/A; putative formula: C2H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.224,"smiles":null,"spectrum_id":"CCMSLIB00017236928","spectrum_index":15744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N''-(4,6-Dimethyl-2-pyrimidinyl)-N-[2-(4-methoxyphenyl)ethyl]guanidine (delta mass: 18.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.202,"smiles":null,"spectrum_id":"CCMSLIB00017236929","spectrum_index":15745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 91.1 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.16,"smiles":null,"spectrum_id":"CCMSLIB00017236932","spectrum_index":15746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bis(2-hydroxyethyl) phthalate (delta mass: 199.0088 Da; putative annotation: N/A; putative formula: C3HN7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.095,"smiles":null,"spectrum_id":"CCMSLIB00017236933","spectrum_index":15747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Hydroxytestosterone (delta mass: 112.0659 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.277,"smiles":null,"spectrum_id":"CCMSLIB00017236936","spectrum_index":15748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,11E,13E)-18-(2,6-Dioxopiperidin-4-yl)-9-hydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11,13-tetraenoic acid (delta mass: 74.0578 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.338,"smiles":null,"spectrum_id":"CCMSLIB00017236937","spectrum_index":15749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 98.0508 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.174,"smiles":null,"spectrum_id":"CCMSLIB00017236940","spectrum_index":15750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 359.3037 Da; putative annotation: N/A; putative formula: C20H41NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.531,"smiles":null,"spectrum_id":"CCMSLIB00017236941","spectrum_index":15751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 130.1362 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.222,"smiles":null,"spectrum_id":"CCMSLIB00017236943","spectrum_index":15752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 159.0473 Da; putative annotation: N/A; putative formula: C13H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.112,"smiles":null,"spectrum_id":"CCMSLIB00017236945","spectrum_index":15753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 1165.7968 Da; putative annotation: N/A; putative formula: C63H111N3O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1303.89,"smiles":null,"spectrum_id":"CCMSLIB00017236947","spectrum_index":15754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 300.016 Da; putative annotation: N/A; putative formula: C9H16O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.295,"smiles":null,"spectrum_id":"CCMSLIB00017236949","spectrum_index":15755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 106.0423 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.092,"smiles":null,"spectrum_id":"CCMSLIB00017236951","spectrum_index":15756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Aminobenzoic acid (delta mass: 137.084 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017236953","spectrum_index":15757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde (delta mass: 166.0027 Da; putative annotation: N/A; putative formula: C7H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.047,"smiles":null,"spectrum_id":"CCMSLIB00017236956","spectrum_index":15758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 616.2199 Da; putative annotation: N/A; putative formula: C31H33N6O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.28,"smiles":null,"spectrum_id":"CCMSLIB00017236957","spectrum_index":15759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 92.0625 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.268,"smiles":null,"spectrum_id":"CCMSLIB00017236959","spectrum_index":15760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7-Triazacyclononane (delta mass: 102.0791 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.213,"smiles":null,"spectrum_id":"CCMSLIB00017236961","spectrum_index":15761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 90.0302 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.111,"smiles":null,"spectrum_id":"CCMSLIB00017236963","spectrum_index":15762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 77.9411 Da; putative annotation: N/A; putative formula: H-2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.011,"smiles":null,"spectrum_id":"CCMSLIB00017236965","spectrum_index":15763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2-1-glyceryl ester (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.321,"smiles":null,"spectrum_id":"CCMSLIB00017236967","spectrum_index":15764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetradecanedioic acid (delta mass: 72.0336 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.224,"smiles":null,"spectrum_id":"CCMSLIB00017236969","spectrum_index":15765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reserpine (delta mass: 277.3048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.586,"smiles":null,"spectrum_id":"CCMSLIB00017236971","spectrum_index":15766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 70.0427 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.291,"smiles":null,"spectrum_id":"CCMSLIB00017236974","spectrum_index":15767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 327.2782 Da; putative annotation: N/A; putative formula: C20H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.505,"smiles":null,"spectrum_id":"CCMSLIB00017236975","spectrum_index":15768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 102.1049 Da; putative annotation: N/A; putative formula: C2H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.165,"smiles":null,"spectrum_id":"CCMSLIB00017236977","spectrum_index":15769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopentylacetic acid (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017236980","spectrum_index":15770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 85.0892 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.149,"smiles":null,"spectrum_id":"CCMSLIB00017236982","spectrum_index":15771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 501.9399 Da; putative annotation: N/A; putative formula: C24H10N2OS5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.0,"smiles":null,"spectrum_id":"CCMSLIB00017236984","spectrum_index":15772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy-4(15),11(13)-eudesmadien-12,6-olide (delta mass: 27.9953 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.144,"smiles":null,"spectrum_id":"CCMSLIB00017236986","spectrum_index":15773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aureonitol (delta mass: 35.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.175,"smiles":null,"spectrum_id":"CCMSLIB00017236988","spectrum_index":15774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 60.0362 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.273,"smiles":null,"spectrum_id":"CCMSLIB00017236990","spectrum_index":15775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)acetamide (delta mass: 41.9953 Da; putative annotation: N/A; putative formula: C2H2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.113,"smiles":null,"spectrum_id":"CCMSLIB00017236992","spectrum_index":15776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 23.0159 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017236994","spectrum_index":15777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyacetophenone (delta mass: 204.0782 Da; putative annotation: N/A; putative formula: C12H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017236997","spectrum_index":15778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 176.0324 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.217,"smiles":null,"spectrum_id":"CCMSLIB00017236998","spectrum_index":15779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 348.3018 Da; putative annotation: N/A; putative formula: C23H40O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.378,"smiles":null,"spectrum_id":"CCMSLIB00017237001","spectrum_index":15780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 77.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.269,"smiles":null,"spectrum_id":"CCMSLIB00017237003","spectrum_index":15781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 147.5723 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.644,"smiles":null,"spectrum_id":"CCMSLIB00017237005","spectrum_index":15782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 32.9456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.946,"smiles":null,"spectrum_id":"CCMSLIB00017237006","spectrum_index":15783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naratriptan N-oxide (delta mass: 60.0796 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.249,"smiles":null,"spectrum_id":"CCMSLIB00017237009","spectrum_index":15784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of thymidine (delta mass: 176.0325 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.13,"smiles":null,"spectrum_id":"CCMSLIB00017237010","spectrum_index":15785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 116.0473 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017237013","spectrum_index":15786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperazinyl)acetamide (delta mass: 26.0396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017237014","spectrum_index":15787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 41.0499 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.152,"smiles":null,"spectrum_id":"CCMSLIB00017237017","spectrum_index":15788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 48.0451 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.204,"smiles":null,"spectrum_id":"CCMSLIB00017237018","spectrum_index":15789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 122.1096 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.352,"smiles":null,"spectrum_id":"CCMSLIB00017237020","spectrum_index":15790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 108.0939 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.148,"smiles":null,"spectrum_id":"CCMSLIB00017237022","spectrum_index":15791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ionomycin (delta mass: 62.0487 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.574,"smiles":null,"spectrum_id":"CCMSLIB00017237024","spectrum_index":15792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 243.1263 Da; putative annotation: N/A; putative formula: C15H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.207,"smiles":null,"spectrum_id":"CCMSLIB00017237026","spectrum_index":15793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 132.9906 Da; putative annotation: N/A; putative formula: C5H-1N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.134,"smiles":null,"spectrum_id":"CCMSLIB00017237029","spectrum_index":15794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 25.9606 Da; putative annotation: N/A; putative formula: C6H10N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.13,"smiles":null,"spectrum_id":"CCMSLIB00017237030","spectrum_index":15795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 122.0585 Da; putative annotation: N/A; putative formula: C5H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017237033","spectrum_index":15796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 199.8665 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.927,"smiles":null,"spectrum_id":"CCMSLIB00017237034","spectrum_index":15797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 147.0688 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.192,"smiles":null,"spectrum_id":"CCMSLIB00017237036","spectrum_index":15798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 57.0197 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.122,"smiles":null,"spectrum_id":"CCMSLIB00017237038","spectrum_index":15799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,15-Dihydroxy-9-methyl-10-oxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-11-one (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.17,"smiles":null,"spectrum_id":"CCMSLIB00017237041","spectrum_index":15800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,9-Dihydroxy-5Z,11Z,14Z-eicosatrienoic acid (delta mass: 88.0703 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.323,"smiles":null,"spectrum_id":"CCMSLIB00017237042","spectrum_index":15801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-C13:0 (delta mass: 83.0409 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.3,"smiles":null,"spectrum_id":"CCMSLIB00017237045","spectrum_index":15802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 15.0151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.128,"smiles":null,"spectrum_id":"CCMSLIB00017237046","spectrum_index":15803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11(12)-Epoxy-5Z,8Z,14Z,17Z- eicosatetraenoic acid (delta mass: 53.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017237049","spectrum_index":15804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 110.0583 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.118,"smiles":null,"spectrum_id":"CCMSLIB00017237050","spectrum_index":15805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 75.031 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.122,"smiles":null,"spectrum_id":"CCMSLIB00017237053","spectrum_index":15806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Arachidonoylglycerol (delta mass: 54.0475 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017237054","spectrum_index":15807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 108.0946 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.327,"smiles":null,"spectrum_id":"CCMSLIB00017237057","spectrum_index":15808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid, 4-(aminomethyl)-, ethyl ester (delta mass: 72.0366 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.139,"smiles":null,"spectrum_id":"CCMSLIB00017237058","spectrum_index":15809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Bis(p-(2-hydroxyethoxycarbonyl)benzoyloxy)ethane (delta mass: 119.0549 Da; putative annotation: N/A; putative formula: C3H9N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.183,"smiles":null,"spectrum_id":"CCMSLIB00017237061","spectrum_index":15810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 104.0621 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.31,"smiles":null,"spectrum_id":"CCMSLIB00017237062","spectrum_index":15811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 220.2214 Da; putative annotation: N/A; putative formula: C16H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.355,"smiles":null,"spectrum_id":"CCMSLIB00017237065","spectrum_index":15812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 27.05 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.11,"smiles":null,"spectrum_id":"CCMSLIB00017237066","spectrum_index":15813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 130.0524 Da; putative annotation: N/A; putative formula: C8H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.155,"smiles":null,"spectrum_id":"CCMSLIB00017237069","spectrum_index":15814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 72.0424 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.295,"smiles":null,"spectrum_id":"CCMSLIB00017237070","spectrum_index":15815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9Z,11E,13E-Octadecatrienoic acid (delta mass: 82.0087 Da; putative annotation: N/A; putative formula: C3H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.241,"smiles":null,"spectrum_id":"CCMSLIB00017237073","spectrum_index":15816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 313.1868 Da; putative annotation: N/A; putative formula: C20H27NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.283,"smiles":null,"spectrum_id":"CCMSLIB00017237074","spectrum_index":15817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 92.0474 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017237077","spectrum_index":15818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 126.0317 Da; putative annotation: 3-(Methoxycarbonyl)but-3-enoic acid; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.107,"smiles":null,"spectrum_id":"CCMSLIB00017237078","spectrum_index":15819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 229.0951 Da; putative annotation: Linamarin; putative formula: C10H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.166,"smiles":null,"spectrum_id":"CCMSLIB00017237081","spectrum_index":15820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 206.1665 Da; putative annotation: 5-Tetradecynoic acid; putative formula: C14H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.326,"smiles":null,"spectrum_id":"CCMSLIB00017237082","spectrum_index":15821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 170.0939 Da; putative annotation: Azelaic acid; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.321,"smiles":null,"spectrum_id":"CCMSLIB00017237085","spectrum_index":15822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 144.0423 Da; putative annotation: 3-Hydroxy-3-methylglutaric acid; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.113,"smiles":null,"spectrum_id":"CCMSLIB00017237086","spectrum_index":15823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 333.2289 Da; putative annotation: N-3-Oxohexadec-11Z-enoyl-L-homoserine lactone; putative formula: C20H31NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.44,"smiles":null,"spectrum_id":"CCMSLIB00017237088","spectrum_index":15824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 264.21 Da; putative annotation: Spectral Match to 12(S)-Hydroxy-16-heptadecynoic acid from NIST14; putative formula: C17H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.416,"smiles":null,"spectrum_id":"CCMSLIB00017237090","spectrum_index":15825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 293.2347 Da; putative annotation: Gly-C16:1; putative formula: C18H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.749,"smiles":null,"spectrum_id":"CCMSLIB00017237092","spectrum_index":15826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonoylglycerol (delta mass: 281.2716 Da; putative annotation: Palmitoyl Ethanolamide; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.556,"smiles":null,"spectrum_id":"CCMSLIB00017237094","spectrum_index":15827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycerol (delta mass: 281.2732 Da; putative annotation: Massbank:RP014703 D-sphingosine|sphingosine|(E,2S,3R)-2-aminooctadec-4-ene-1,3-diol; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.818,"smiles":null,"spectrum_id":"CCMSLIB00017237096","spectrum_index":15828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylpyrrolidine (delta mass: 99.0683 Da; putative annotation: 5-Aminovaleric acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.165,"smiles":null,"spectrum_id":"CCMSLIB00017237098","spectrum_index":15829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 294.2196 Da; putative annotation: (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid; putative formula: C18H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.264,"smiles":null,"spectrum_id":"CCMSLIB00017237100","spectrum_index":15830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300024 Voacristine (delta mass: 384.1942 Da; putative annotation: Prednisolone 21-acetate; putative formula: C23H28O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.406,"smiles":null,"spectrum_id":"CCMSLIB00017237103","spectrum_index":15831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 214.0995 Da; putative annotation: Asp-Val; putative formula: C9H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017237104","spectrum_index":15832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 748.4746 Da; putative annotation: (2S,3R,4R,5R,6S)-2-{[(2R,3R,4S,5S,6R)-2-{[(2R,5S,7R,8S,10R,11R,14S,15R,16R)-5,16-dihydroxy-2,6,6,10,11-pentamethyl-14-(6-methylhepta-2,5-dien-2-yl)tetracyclo[8.7.0.0,?.0,?]heptadecan-8-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol; putative formula: C42H68O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.535,"smiles":null,"spectrum_id":"CCMSLIB00017237107","spectrum_index":15833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 132.1503 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.21,"smiles":null,"spectrum_id":"CCMSLIB00017237108","spectrum_index":15834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-ylmethyl)-1,2-dihydropyridin-2-one (delta mass: 53.0367 Da; putative annotation: N/A; putative formula: C2H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017237111","spectrum_index":15835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Phenylpropyl)piperidine (delta mass: 111.0204 Da; putative annotation: N/A; putative formula: C7HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.195,"smiles":null,"spectrum_id":"CCMSLIB00017237112","spectrum_index":15836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLAMIDE (delta mass: 216.145 Da; putative annotation: N/A; putative formula: C6H16N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.2,"smiles":null,"spectrum_id":"CCMSLIB00017237115","spectrum_index":15837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 67.0261 Da; putative annotation: N/A; putative formula: CHN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.378,"smiles":null,"spectrum_id":"CCMSLIB00017237116","spectrum_index":15838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 156.1151 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017237119","spectrum_index":15839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 106.0776 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.31,"smiles":null,"spectrum_id":"CCMSLIB00017237120","spectrum_index":15840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 146.0944 Da; putative annotation: N/A; putative formula: C7H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017237123","spectrum_index":15841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 1174.5018 Da; putative annotation: N/A; putative formula: C78H58N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1468.62,"smiles":null,"spectrum_id":"CCMSLIB00017237124","spectrum_index":15842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 943.487 Da; putative annotation: N/A; putative formula: C55H57N15O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1237.61,"smiles":null,"spectrum_id":"CCMSLIB00017237127","spectrum_index":15843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1338.5486 Da; putative annotation: N/A; putative formula: C71H66N22O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1560.65,"smiles":null,"spectrum_id":"CCMSLIB00017237128","spectrum_index":15844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 102.0319 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017237131","spectrum_index":15845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 121.0522 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.195,"smiles":null,"spectrum_id":"CCMSLIB00017237132","spectrum_index":15846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 279.2398 Da; putative annotation: N/A; putative formula: C18H33NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.425,"smiles":null,"spectrum_id":"CCMSLIB00017237135","spectrum_index":15847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 160.2067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.267,"smiles":null,"spectrum_id":"CCMSLIB00017237136","spectrum_index":15848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 1.7899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.975,"smiles":null,"spectrum_id":"CCMSLIB00017237139","spectrum_index":15849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 36.3879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.5,"smiles":null,"spectrum_id":"CCMSLIB00017237140","spectrum_index":15850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycoursodeoxycholic acid (delta mass: 100.0692 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.391,"smiles":null,"spectrum_id":"CCMSLIB00017237143","spectrum_index":15851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-11Z,13E-eicosadienoic acid (delta mass: 198.074 Da; putative annotation: N/A; putative formula: C9H15N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.348,"smiles":null,"spectrum_id":"CCMSLIB00017237144","spectrum_index":15852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethoxyethoxyethanol (delta mass: 133.1103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.212,"smiles":null,"spectrum_id":"CCMSLIB00017237147","spectrum_index":15853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 144.0424 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.139,"smiles":null,"spectrum_id":"CCMSLIB00017237148","spectrum_index":15854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10-2 (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.285,"smiles":null,"spectrum_id":"CCMSLIB00017237151","spectrum_index":15855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 322.1878 Da; putative annotation: N/A; putative formula: C19H31PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.279,"smiles":null,"spectrum_id":"CCMSLIB00017237152","spectrum_index":15856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vanillic acid (delta mass: 18.0036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.053,"smiles":null,"spectrum_id":"CCMSLIB00017237154","spectrum_index":15857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 248.2475 Da; putative annotation: N/A; putative formula: C18H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.36,"smiles":null,"spectrum_id":"CCMSLIB00017237156","spectrum_index":15858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 44.0084 Da; putative annotation: N/A; putative formula: C2H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.079,"smiles":null,"spectrum_id":"CCMSLIB00017237157","spectrum_index":15859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 58.0628 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017237160","spectrum_index":15860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-Isopropoxy-5-(trifluoromethyl)phenyl]amine (delta mass: 18.0456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.14,"smiles":null,"spectrum_id":"CCMSLIB00017237161","spectrum_index":15861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 61.9679 Da; putative annotation: N/A; putative formula: CH2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.06,"smiles":null,"spectrum_id":"CCMSLIB00017237164","spectrum_index":15862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 122.083 Da; putative annotation: N/A; putative formula: C7H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.149,"smiles":null,"spectrum_id":"CCMSLIB00017237165","spectrum_index":15863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 723.3312 Da; putative annotation: N/A; putative formula: C32H53NO17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":904.402,"smiles":null,"spectrum_id":"CCMSLIB00017237168","spectrum_index":15864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-8-Methyl-6-nonenoic acid (delta mass: 52.0316 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.17,"smiles":null,"spectrum_id":"CCMSLIB00017237169","spectrum_index":15865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-aminovaleric acid betaine (delta mass: 48.9581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.091,"smiles":null,"spectrum_id":"CCMSLIB00017237172","spectrum_index":15866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 175.028 Da; putative annotation: N/A; putative formula: C10HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.088,"smiles":null,"spectrum_id":"CCMSLIB00017237175","spectrum_index":15867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM836501 Morpholine|Morpholin (delta mass: 46.005 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.081,"smiles":null,"spectrum_id":"CCMSLIB00017237177","spectrum_index":15868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINOSALICYLIC ACID (delta mass: 9.9269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.977,"smiles":null,"spectrum_id":"CCMSLIB00017237179","spectrum_index":15869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Khayanolide A (delta mass: 78.0149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.222,"smiles":null,"spectrum_id":"CCMSLIB00017237181","spectrum_index":15870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 708.3841 Da; putative annotation: N/A; putative formula: C37H60N2O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1035.51,"smiles":null,"spectrum_id":"CCMSLIB00017237183","spectrum_index":15871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 510.3911 Da; putative annotation: N/A; putative formula: C34H56O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.462,"smiles":null,"spectrum_id":"CCMSLIB00017237186","spectrum_index":15872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 130.0625 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.113,"smiles":null,"spectrum_id":"CCMSLIB00017237187","spectrum_index":15873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 140.07 Da; putative annotation: N/A; putative formula: C5H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.173,"smiles":null,"spectrum_id":"CCMSLIB00017237190","spectrum_index":15874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 70.0423 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.185,"smiles":null,"spectrum_id":"CCMSLIB00017237191","spectrum_index":15875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 17.878 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.141,"smiles":null,"spectrum_id":"CCMSLIB00017237194","spectrum_index":15876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 63.9984 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.111,"smiles":null,"spectrum_id":"CCMSLIB00017237195","spectrum_index":15877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 323.2471 Da; putative annotation: N/A; putative formula: C20H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.49,"smiles":null,"spectrum_id":"CCMSLIB00017237198","spectrum_index":15878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-(1,2,4a,5-Tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoic acid (delta mass: 88.0633 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.29,"smiles":null,"spectrum_id":"CCMSLIB00017237199","spectrum_index":15879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 160.1435 Da; putative annotation: N/A; putative formula: C5H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.261,"smiles":null,"spectrum_id":"CCMSLIB00017237202","spectrum_index":15880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pristanic acid (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.342,"smiles":null,"spectrum_id":"CCMSLIB00017237203","spectrum_index":15881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 131.004 Da; putative annotation: N/A; putative formula: C4H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.09,"smiles":null,"spectrum_id":"CCMSLIB00017237205","spectrum_index":15882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 162.1005 Da; putative annotation: N/A; putative formula: C6H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.181,"smiles":null,"spectrum_id":"CCMSLIB00017237207","spectrum_index":15883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 19.0098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.06,"smiles":null,"spectrum_id":"CCMSLIB00017237210","spectrum_index":15884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Norepiandrosterone (delta mass: 693.4864 Da; putative annotation: N/A; putative formula: C37H67N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":970.703,"smiles":null,"spectrum_id":"CCMSLIB00017237211","spectrum_index":15885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E,9E)-5,6-Dihydroxy-9,12,13-trimethyl-14-(2-methylpropyl)-6,7,8,10a,13,13a,14,15-octahydro-2H-oxacyclododecino[2,3-d]isoindole-2,16(5H)-dione (delta mass: 62.0535 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.312,"smiles":null,"spectrum_id":"CCMSLIB00017237214","spectrum_index":15886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15(R)-Methylprostaglandin A2 (delta mass: 109.0477 Da; putative annotation: N/A; putative formula: C2H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.285,"smiles":null,"spectrum_id":"CCMSLIB00017237216","spectrum_index":15887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380376-01_C22H40O3_1-Naphthalenepentanol, decahydro-2-hydroxy-gamma,2,5,5,8a-pentamethyl-, alpha-acetate (delta mass: 17.025 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.33,"smiles":null,"spectrum_id":"CCMSLIB00017237218","spectrum_index":15888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 310.2498 Da; putative annotation: N/A; putative formula: C19H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.555,"smiles":null,"spectrum_id":"CCMSLIB00017237219","spectrum_index":15889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 72.0212 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.071,"smiles":null,"spectrum_id":"CCMSLIB00017237222","spectrum_index":15890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 100.8686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.933,"smiles":null,"spectrum_id":"CCMSLIB00017237223","spectrum_index":15891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 32.0602 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.157,"smiles":null,"spectrum_id":"CCMSLIB00017237226","spectrum_index":15892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 677.633 Da; putative annotation: N/A; putative formula: C44H79N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.896,"smiles":null,"spectrum_id":"CCMSLIB00017237227","spectrum_index":15893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 220.1451 Da; putative annotation: N/A; putative formula: C8H21N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.33,"smiles":null,"spectrum_id":"CCMSLIB00017237230","spectrum_index":15894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 64.0158 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.122,"smiles":null,"spectrum_id":"CCMSLIB00017237231","spectrum_index":15895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 36.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.32,"smiles":null,"spectrum_id":"CCMSLIB00017237232","spectrum_index":15896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 16.0298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":99.0902,"smiles":null,"spectrum_id":"CCMSLIB00017237235","spectrum_index":15897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 125.035 Da; putative annotation: N/A; putative formula: C3H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.106,"smiles":null,"spectrum_id":"CCMSLIB00017237236","spectrum_index":15898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 121.0225 Da; putative annotation: N/A; putative formula: C2H8N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.27,"smiles":null,"spectrum_id":"CCMSLIB00017237239","spectrum_index":15899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 48.0347 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.089,"smiles":null,"spectrum_id":"CCMSLIB00017237240","spectrum_index":15900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swertisin (delta mass: 162.0526 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.181,"smiles":null,"spectrum_id":"CCMSLIB00017237243","spectrum_index":15901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 126.928 Da; putative annotation: N/A; putative formula: H2NOPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.16,"smiles":null,"spectrum_id":"CCMSLIB00017237244","spectrum_index":15902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-oxo-5beta-cholanic acid (delta mass: 15.9196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.209,"smiles":null,"spectrum_id":"CCMSLIB00017237247","spectrum_index":15903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxyandrosta-5,15-dien-17-one (delta mass: 119.0947 Da; putative annotation: N/A; putative formula: CH9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.295,"smiles":null,"spectrum_id":"CCMSLIB00017237248","spectrum_index":15904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nitro-2,4-quinolinediol (delta mass: 300.0775 Da; putative annotation: N/A; putative formula: C14H13N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.117,"smiles":null,"spectrum_id":"CCMSLIB00017237251","spectrum_index":15905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 268.0702 Da; putative annotation: N/A; putative formula: C12H16N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.152,"smiles":null,"spectrum_id":"CCMSLIB00017237252","spectrum_index":15906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 160.0881 Da; putative annotation: N/A; putative formula: C5H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017237255","spectrum_index":15907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(2E,6E,10E)-9,12-Dihydroxy-6,10-dimethyldodeca-2,6,10-trien-2-yl]-5-methyl-2,3-dihydropyran-6-one (delta mass: 64.0304 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.252,"smiles":null,"spectrum_id":"CCMSLIB00017237256","spectrum_index":15908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 349.2147 Da; putative annotation: N/A; putative formula: C14H31N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.316,"smiles":null,"spectrum_id":"CCMSLIB00017237259","spectrum_index":15909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thymol (delta mass: 175.1207 Da; putative annotation: N/A; putative formula: C8H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.232,"smiles":null,"spectrum_id":"CCMSLIB00017237260","spectrum_index":15910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 73.0417 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017237263","spectrum_index":15911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tridecanoic acid (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.263,"smiles":null,"spectrum_id":"CCMSLIB00017237264","spectrum_index":15912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 42.8986 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.99,"smiles":null,"spectrum_id":"CCMSLIB00017237267","spectrum_index":15913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 612.3144 Da; putative annotation: N/A; putative formula: C31H48O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":775.375,"smiles":null,"spectrum_id":"CCMSLIB00017237268","spectrum_index":15914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of E-N-Deoxyfructosyllysine (delta mass: 162.0523 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.218,"smiles":null,"spectrum_id":"CCMSLIB00017237271","spectrum_index":15915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 287.2181 Da; putative annotation: N/A; putative formula: C10H25N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.32,"smiles":null,"spectrum_id":"CCMSLIB00017237272","spectrum_index":15916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 179.0886 Da; putative annotation: N/A; putative formula: C9H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.123,"smiles":null,"spectrum_id":"CCMSLIB00017237275","spectrum_index":15917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 40.0312 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.284,"smiles":null,"spectrum_id":"CCMSLIB00017237276","spectrum_index":15918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cys-Lys (delta mass: 83.0699 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.192,"smiles":null,"spectrum_id":"CCMSLIB00017237279","spectrum_index":15919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 174.016 Da; putative annotation: N/A; putative formula: C6H6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.149,"smiles":null,"spectrum_id":"CCMSLIB00017237280","spectrum_index":15920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid (delta mass: 53.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.079,"smiles":null,"spectrum_id":"CCMSLIB00017237283","spectrum_index":15921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 193.1287 Da; putative annotation: N/A; putative formula: C12H19NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.183,"smiles":null,"spectrum_id":"CCMSLIB00017237284","spectrum_index":15922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 434.1416 Da; putative annotation: N/A; putative formula: C31H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.212,"smiles":null,"spectrum_id":"CCMSLIB00017237286","spectrum_index":15923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-aminovaleric acid betaine (delta mass: 69.944 Da; putative annotation: N/A; putative formula: C2H-1O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.077,"smiles":null,"spectrum_id":"CCMSLIB00017237288","spectrum_index":15924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 46.0469 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.126,"smiles":null,"spectrum_id":"CCMSLIB00017237290","spectrum_index":15925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 74.0342 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.131,"smiles":null,"spectrum_id":"CCMSLIB00017237292","spectrum_index":15926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 154.0273 Da; putative annotation: N/A; putative formula: C8H10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.092,"smiles":null,"spectrum_id":"CCMSLIB00017237294","spectrum_index":15927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eicosapentaenoyl ethanolamide (delta mass: 66.0101 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.284,"smiles":null,"spectrum_id":"CCMSLIB00017237297","spectrum_index":15928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 54.0468 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.242,"smiles":null,"spectrum_id":"CCMSLIB00017237298","spectrum_index":15929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-ethanamine, .alpha.-methyl-5-(2-thienylmethoxy)- (delta mass: 27.0179 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.139,"smiles":null,"spectrum_id":"CCMSLIB00017237301","spectrum_index":15930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3S)-3-Hydroxyleucine (delta mass: 159.0323 Da; putative annotation: N/A; putative formula: C6H9NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.129,"smiles":null,"spectrum_id":"CCMSLIB00017237302","spectrum_index":15931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 156.01 Da; putative annotation: N/A; putative formula: C4H4N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.107,"smiles":null,"spectrum_id":"CCMSLIB00017237305","spectrum_index":15932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 113.0837 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.224,"smiles":null,"spectrum_id":"CCMSLIB00017237306","spectrum_index":15933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 338.0814 Da; putative annotation: N/A; putative formula: C13H10N10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.21,"smiles":null,"spectrum_id":"CCMSLIB00017237309","spectrum_index":15934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxydodecanoic acid (delta mass: 56.0302 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.21,"smiles":null,"spectrum_id":"CCMSLIB00017237310","spectrum_index":15935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Misoprostol (free acid) (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.274,"smiles":null,"spectrum_id":"CCMSLIB00017237312","spectrum_index":15936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Syringaldehyde from NIST14 (delta mass: 286.0681 Da; putative annotation: N/A; putative formula: C17H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.133,"smiles":null,"spectrum_id":"CCMSLIB00017237314","spectrum_index":15937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 226.0941 Da; putative annotation: N/A; putative formula: C4H15N6O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.181,"smiles":null,"spectrum_id":"CCMSLIB00017237316","spectrum_index":15938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 112.0635 Da; putative annotation: N/A; putative formula: C5H8N2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.124,"smiles":null,"spectrum_id":"CCMSLIB00017237318","spectrum_index":15939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 106.0632 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.237,"smiles":null,"spectrum_id":"CCMSLIB00017237321","spectrum_index":15940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxybenzoic acid (delta mass: 203.2265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.302,"smiles":null,"spectrum_id":"CCMSLIB00017237322","spectrum_index":15941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 263.137 Da; putative annotation: N/A; putative formula: C11H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.327,"smiles":null,"spectrum_id":"CCMSLIB00017237325","spectrum_index":15942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 104.0109 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.16,"smiles":null,"spectrum_id":"CCMSLIB00017237326","spectrum_index":15943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 224.0681 Da; putative annotation: N/A; putative formula: C11H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.149,"smiles":null,"spectrum_id":"CCMSLIB00017237329","spectrum_index":15944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 108.573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.701,"smiles":null,"spectrum_id":"CCMSLIB00017237330","spectrum_index":15945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 354.2417 Da; putative annotation: N/A; putative formula: C21H38S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.302,"smiles":null,"spectrum_id":"CCMSLIB00017237333","spectrum_index":15946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 175.9957 Da; putative annotation: N/A; putative formula: C5H4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.076,"smiles":null,"spectrum_id":"CCMSLIB00017237334","spectrum_index":15947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 35.0032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.068,"smiles":null,"spectrum_id":"CCMSLIB00017237336","spectrum_index":15948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 74.0531 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.406,"smiles":null,"spectrum_id":"CCMSLIB00017237338","spectrum_index":15949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,9(11),12,24-tetraen-26-oic acid (delta mass: 140.0995 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.42,"smiles":null,"spectrum_id":"CCMSLIB00017237340","spectrum_index":15950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 64.0678 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.316,"smiles":null,"spectrum_id":"CCMSLIB00017237343","spectrum_index":15951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 92.0619 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.346,"smiles":null,"spectrum_id":"CCMSLIB00017237345","spectrum_index":15952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Myristoleic acid from NIST14 (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.247,"smiles":null,"spectrum_id":"CCMSLIB00017237347","spectrum_index":15953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 511.3716 Da; putative annotation: N/A; putative formula: C30H49N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.411,"smiles":null,"spectrum_id":"CCMSLIB00017237349","spectrum_index":15954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Tyr from NIST14 (delta mass: 294.1587 Da; putative annotation: N/A; putative formula: C16H26N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.308,"smiles":null,"spectrum_id":"CCMSLIB00017237351","spectrum_index":15955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 444.293 Da; putative annotation: N/A; putative formula: C18H40N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.427,"smiles":null,"spectrum_id":"CCMSLIB00017237353","spectrum_index":15956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINOSALICYLIC ACID (delta mass: 147.0681 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017237355","spectrum_index":15957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 190.0735 Da; putative annotation: N/A; putative formula: C10H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.139,"smiles":null,"spectrum_id":"CCMSLIB00017237357","spectrum_index":15958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethoxycarbonyl)-3-phenylindole (delta mass: 147.0887 Da; putative annotation: N/A; putative formula: C6H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.206,"smiles":null,"spectrum_id":"CCMSLIB00017237360","spectrum_index":15959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 397.1959 Da; putative annotation: N/A; putative formula: C27H28NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.277,"smiles":null,"spectrum_id":"CCMSLIB00017237361","spectrum_index":15960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylthioguanine (delta mass: 84.0489 Da; putative annotation: N/A; putative formula: C5H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.098,"smiles":null,"spectrum_id":"CCMSLIB00017237364","spectrum_index":15961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 154.1366 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.265,"smiles":null,"spectrum_id":"CCMSLIB00017237365","spectrum_index":15962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(N-Methylacetamido)benzoic acid (delta mass: 17.9715 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.053,"smiles":null,"spectrum_id":"CCMSLIB00017237368","spectrum_index":15963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 239.1102 Da; putative annotation: N/A; putative formula: C4H9N13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.197,"smiles":null,"spectrum_id":"CCMSLIB00017237369","spectrum_index":15964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 271.1622 Da; putative annotation: N/A; putative formula: C14H27NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.269,"smiles":null,"spectrum_id":"CCMSLIB00017237372","spectrum_index":15965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 15.0189 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.124,"smiles":null,"spectrum_id":"CCMSLIB00017237373","spectrum_index":15966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-[(Z)-oct-2-enyl]pentanedioic acid (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017237376","spectrum_index":15967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 43.0007 Da; putative annotation: N/A; putative formula: CH2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.103,"smiles":null,"spectrum_id":"CCMSLIB00017237377","spectrum_index":15968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 63.0316 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017237380","spectrum_index":15969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 72.5018 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.552,"smiles":null,"spectrum_id":"CCMSLIB00017237381","spectrum_index":15970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 581.5399 Da; putative annotation: N/A; putative formula: C37H67N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.803,"smiles":null,"spectrum_id":"CCMSLIB00017237384","spectrum_index":15971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 403.1524 Da; putative annotation: N/A; putative formula: C25H26NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.25,"smiles":null,"spectrum_id":"CCMSLIB00017237385","spectrum_index":15972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 47.0191 Da; putative annotation: N/A; putative formula: C4HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.267,"smiles":null,"spectrum_id":"CCMSLIB00017237388","spectrum_index":15973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sebacic acid monomethyl ester from NIST14 (delta mass: 127.1359 Da; putative annotation: N/A; putative formula: C8H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.279,"smiles":null,"spectrum_id":"CCMSLIB00017237391","spectrum_index":15974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 164.1563 Da; putative annotation: N/A; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017237392","spectrum_index":15975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxycinnamic acid (delta mass: 86.0841 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.149,"smiles":null,"spectrum_id":"CCMSLIB00017237395","spectrum_index":15976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 217.0588 Da; putative annotation: N/A; putative formula: C8H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.192,"smiles":null,"spectrum_id":"CCMSLIB00017237397","spectrum_index":15977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 191.0446 Da; putative annotation: N/A; putative formula: C7H5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.115,"smiles":null,"spectrum_id":"CCMSLIB00017237399","spectrum_index":15978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 63.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017237402","spectrum_index":15979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Trp (delta mass: 99.0682 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.187,"smiles":null,"spectrum_id":"CCMSLIB00017237403","spectrum_index":15980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 32.0244 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.13,"smiles":null,"spectrum_id":"CCMSLIB00017237406","spectrum_index":15981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 54.0322 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017237409","spectrum_index":15982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 138.0284 Da; putative annotation: N/A; putative formula: C3H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.04,"smiles":null,"spectrum_id":"CCMSLIB00017237410","spectrum_index":15983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 337.2588 Da; putative annotation: N/A; putative formula: C16H31N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.324,"smiles":null,"spectrum_id":"CCMSLIB00017237413","spectrum_index":15984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 99.0687 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.203,"smiles":null,"spectrum_id":"CCMSLIB00017237414","spectrum_index":15985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.242,"smiles":null,"spectrum_id":"CCMSLIB00017237417","spectrum_index":15986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 187.0029 Da; putative annotation: N/A; putative formula: C6H6NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.063,"smiles":null,"spectrum_id":"CCMSLIB00017237418","spectrum_index":15987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 34.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.145,"smiles":null,"spectrum_id":"CCMSLIB00017237421","spectrum_index":15988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Nitrophenyl N-acetyl-alpha-galactosaminide CollisionEnergy:102040 (delta mass: 525.2279 Da; putative annotation: N/A; putative formula: C29H36NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.341,"smiles":null,"spectrum_id":"CCMSLIB00017237423","spectrum_index":15989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 14.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.144,"smiles":null,"spectrum_id":"CCMSLIB00017237425","spectrum_index":15990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 13.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.138,"smiles":null,"spectrum_id":"CCMSLIB00017237428","spectrum_index":15991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 43.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.087,"smiles":null,"spectrum_id":"CCMSLIB00017237431","spectrum_index":15992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 130.029 Da; putative annotation: N/A; putative formula: C4H7N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.094,"smiles":null,"spectrum_id":"CCMSLIB00017237432","spectrum_index":15993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 93.1924 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.257,"smiles":null,"spectrum_id":"CCMSLIB00017237435","spectrum_index":15994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 122.0413 Da; putative annotation: N/A; putative formula: C6H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.117,"smiles":null,"spectrum_id":"CCMSLIB00017237436","spectrum_index":15995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholest-5-ene-3.beta.,4.beta.-diol (delta mass: 23.0153 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.372,"smiles":null,"spectrum_id":"CCMSLIB00017237439","spectrum_index":15996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 299.675 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.75,"smiles":null,"spectrum_id":"CCMSLIB00017237440","spectrum_index":15997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylazepane (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.164,"smiles":null,"spectrum_id":"CCMSLIB00017237443","spectrum_index":15998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 281.2714 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.358,"smiles":null,"spectrum_id":"CCMSLIB00017237444","spectrum_index":15999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Lys (delta mass: 57.0217 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.177,"smiles":null,"spectrum_id":"CCMSLIB00017237447","spectrum_index":16000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 132.0887 Da; putative annotation: N/A; putative formula: C5H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.191,"smiles":null,"spectrum_id":"CCMSLIB00017237450","spectrum_index":16001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 41.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.164,"smiles":null,"spectrum_id":"CCMSLIB00017237451","spectrum_index":16002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Morpholinyl)-1-phenylethanol (delta mass: 27.8631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.996,"smiles":null,"spectrum_id":"CCMSLIB00017237453","spectrum_index":16003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 118.515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.606,"smiles":null,"spectrum_id":"CCMSLIB00017237455","spectrum_index":16004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E,11Z,13E)-6-Hydroxy-16-methyloxacyclohexadeca-3,11,13-trien-2-one (delta mass: 76.0681 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.248,"smiles":null,"spectrum_id":"CCMSLIB00017237457","spectrum_index":16005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 478.1797 Da; putative annotation: N/A; putative formula: C19H30N2O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.287,"smiles":null,"spectrum_id":"CCMSLIB00017237459","spectrum_index":16006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Arg from NIST14 (delta mass: 115.0271 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.23,"smiles":null,"spectrum_id":"CCMSLIB00017237462","spectrum_index":16007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 122.0842 Da; putative annotation: N/A; putative formula: C7H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.187,"smiles":null,"spectrum_id":"CCMSLIB00017237463","spectrum_index":16008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 88.0398 Da; putative annotation: N/A; putative formula: CH4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.105,"smiles":null,"spectrum_id":"CCMSLIB00017237466","spectrum_index":16009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,7,10,13,16,19-Docosahexaenoic acid (delta mass: 91.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.311,"smiles":null,"spectrum_id":"CCMSLIB00017237467","spectrum_index":16010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 207.1114 Da; putative annotation: N/A; putative formula: C9H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.172,"smiles":null,"spectrum_id":"CCMSLIB00017237468","spectrum_index":16011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 202.0543 Da; putative annotation: N/A; putative formula: C12H11OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.209,"smiles":null,"spectrum_id":"CCMSLIB00017237471","spectrum_index":16012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 455.2001 Da; putative annotation: N/A; putative formula: C18H33NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.237,"smiles":null,"spectrum_id":"CCMSLIB00017237472","spectrum_index":16013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 64.0316 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.097,"smiles":null,"spectrum_id":"CCMSLIB00017237475","spectrum_index":16014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,1-Dioxidothiomorpholin-4-yl)ethanamine (delta mass: 67.0855 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017237476","spectrum_index":16015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 113.0844 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.176,"smiles":null,"spectrum_id":"CCMSLIB00017237479","spectrum_index":16016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.102,"smiles":null,"spectrum_id":"CCMSLIB00017237480","spectrum_index":16017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Adamantyl)pyrrolidine (delta mass: 91.0871 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.277,"smiles":null,"spectrum_id":"CCMSLIB00017237483","spectrum_index":16018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 30.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.117,"smiles":null,"spectrum_id":"CCMSLIB00017237484","spectrum_index":16019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocolumbamine (delta mass: 264.1477 Da; putative annotation: N/A; putative formula: C14H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.318,"smiles":null,"spectrum_id":"CCMSLIB00017237487","spectrum_index":16020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 213.7068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.902,"smiles":null,"spectrum_id":"CCMSLIB00017237488","spectrum_index":16021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-3-Methyl-5-(1,2,5,5-tetramethyl-7-oxo-3,4,4a,6-tetrahydro-2H-naphthalen-1-yl)pent-2-enoic acid (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.237,"smiles":null,"spectrum_id":"CCMSLIB00017237491","spectrum_index":16022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 50.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.102,"smiles":null,"spectrum_id":"CCMSLIB00017237492","spectrum_index":16023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 118.0395 Da; putative annotation: N/A; putative formula: C4H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.084,"smiles":null,"spectrum_id":"CCMSLIB00017237495","spectrum_index":16024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 124.0776 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.217,"smiles":null,"spectrum_id":"CCMSLIB00017237496","spectrum_index":16025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amoxicillin (delta mass: 143.0919 Da; putative annotation: N/A; putative formula: C3H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.204,"smiles":null,"spectrum_id":"CCMSLIB00017237499","spectrum_index":16026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-TRIHYDROXYBENZOIC ACID\"\" (delta mass: 194.0201 Da; putative annotation: N/A; putative formula: C6H-2N10O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.049,"smiles":null,"spectrum_id":"CCMSLIB00017237500","spectrum_index":16027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE0; CorrDec (delta mass: 278.2615 Da; putative annotation: N/A; putative formula: C19H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.359,"smiles":null,"spectrum_id":"CCMSLIB00017237503","spectrum_index":16028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 109.0525 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017237504","spectrum_index":16029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 100.088 Da; putative annotation: N/A; putative formula: C6H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.159,"smiles":null,"spectrum_id":"CCMSLIB00017237507","spectrum_index":16030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 143.1171 Da; putative annotation: N/A; putative formula: C5H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.235,"smiles":null,"spectrum_id":"CCMSLIB00017237508","spectrum_index":16031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxycatechol (delta mass: 27.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.07,"smiles":null,"spectrum_id":"CCMSLIB00017237511","spectrum_index":16032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 254.1371 Da; putative annotation: N/A; putative formula: C13H23N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.353,"smiles":null,"spectrum_id":"CCMSLIB00017237512","spectrum_index":16033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 112.0742 Da; putative annotation: N/A; putative formula: C4H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.353,"smiles":null,"spectrum_id":"CCMSLIB00017237515","spectrum_index":16034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 90.0317 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.076,"smiles":null,"spectrum_id":"CCMSLIB00017237516","spectrum_index":16035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methoxybenzoic acid (delta mass: 12.0001 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.05,"smiles":null,"spectrum_id":"CCMSLIB00017237519","spectrum_index":16036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 176.047 Da; putative annotation: N/A; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.185,"smiles":null,"spectrum_id":"CCMSLIB00017237520","spectrum_index":16037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017237523","spectrum_index":16038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 168.0416 Da; putative annotation: N/A; putative formula: C2H9N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.208,"smiles":null,"spectrum_id":"CCMSLIB00017237524","spectrum_index":16039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 19.9632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.998,"smiles":null,"spectrum_id":"CCMSLIB00017237527","spectrum_index":16040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (delta mass: 60.0393 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.128,"smiles":null,"spectrum_id":"CCMSLIB00017237528","spectrum_index":16041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 102.0829 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.294,"smiles":null,"spectrum_id":"CCMSLIB00017237531","spectrum_index":16042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 50.0512 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.262,"smiles":null,"spectrum_id":"CCMSLIB00017237532","spectrum_index":16043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heptadecasphinganine (delta mass: 377.232 Da; putative annotation: N/A; putative formula: C21H35N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.522,"smiles":null,"spectrum_id":"CCMSLIB00017237535","spectrum_index":16044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 114.0838 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017237536","spectrum_index":16045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 19.0238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.11,"smiles":null,"spectrum_id":"CCMSLIB00017237539","spectrum_index":16046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 80.0141 Da; putative annotation: N/A; putative formula: C2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.091,"smiles":null,"spectrum_id":"CCMSLIB00017237540","spectrum_index":16047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 18.0836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.144,"smiles":null,"spectrum_id":"CCMSLIB00017237543","spectrum_index":16048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 130.0783 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.31,"smiles":null,"spectrum_id":"CCMSLIB00017237544","spectrum_index":16049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxytestosterone (delta mass: 36.0005 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.212,"smiles":null,"spectrum_id":"CCMSLIB00017237547","spectrum_index":16050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 144.125 Da; putative annotation: N/A; putative formula: C7H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.176,"smiles":null,"spectrum_id":"CCMSLIB00017237548","spectrum_index":16051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid (delta mass: 60.0615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.201,"smiles":null,"spectrum_id":"CCMSLIB00017237551","spectrum_index":16052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 42.0179 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.13,"smiles":null,"spectrum_id":"CCMSLIB00017237552","spectrum_index":16053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one (delta mass: 204.0639 Da; putative annotation: N/A; putative formula: C9H16OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.23,"smiles":null,"spectrum_id":"CCMSLIB00017237555","spectrum_index":16054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 435.2717 Da; putative annotation: N/A; putative formula: C25H42NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.519,"smiles":null,"spectrum_id":"CCMSLIB00017237556","spectrum_index":16055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 59.9849 Da; putative annotation: N/A; putative formula: CO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017237559","spectrum_index":16056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-myo-Inositol-4-phosphate (delta mass: 74.0358 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.073,"smiles":null,"spectrum_id":"CCMSLIB00017237560","spectrum_index":16057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 355.2204 Da; putative annotation: N/A; putative formula: C18H34N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.286,"smiles":null,"spectrum_id":"CCMSLIB00017237563","spectrum_index":16058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 612.5532 Da; putative annotation: N/A; putative formula: C38H76O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":907.78,"smiles":null,"spectrum_id":"CCMSLIB00017237564","spectrum_index":16059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol oxide A (delta mass: 80.0618 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.262,"smiles":null,"spectrum_id":"CCMSLIB00017237567","spectrum_index":16060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5S-Hydroxy-6E,8Z,11Z-eicosatrienoic acid (delta mass: 94.0776 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017237568","spectrum_index":16061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 104.0989 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.378,"smiles":null,"spectrum_id":"CCMSLIB00017237571","spectrum_index":16062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hexadec-15-en-7-ynyl-4-hydroxy-5-methyloxolan-2-one (delta mass: 102.0857 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.344,"smiles":null,"spectrum_id":"CCMSLIB00017237572","spectrum_index":16063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 366.2616 Da; putative annotation: N/A; putative formula: C22H40P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.483,"smiles":null,"spectrum_id":"CCMSLIB00017237575","spectrum_index":16064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxylimaprost (delta mass: 80.0619 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.352,"smiles":null,"spectrum_id":"CCMSLIB00017237576","spectrum_index":16065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Altamisic acid (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.175,"smiles":null,"spectrum_id":"CCMSLIB00017237579","spectrum_index":16066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 64.0307 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.263,"smiles":null,"spectrum_id":"CCMSLIB00017237580","spectrum_index":16067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 110.073 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.227,"smiles":null,"spectrum_id":"CCMSLIB00017237583","spectrum_index":16068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-carboxypropanoylamino)hexanoic acid CollisionEnergy:102040 (delta mass: 144.0421 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.16,"smiles":null,"spectrum_id":"CCMSLIB00017237584","spectrum_index":16069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 349.124 Da; putative annotation: N/A; putative formula: C14H20N7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.263,"smiles":null,"spectrum_id":"CCMSLIB00017237587","spectrum_index":16070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 73.0525 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.154,"smiles":null,"spectrum_id":"CCMSLIB00017237588","spectrum_index":16071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 957.739 Da; putative annotation: N/A; putative formula: C54H104NO10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1632.98,"smiles":null,"spectrum_id":"CCMSLIB00017237589","spectrum_index":16072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 394.157 Da; putative annotation: N/A; putative formula: C20H30N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.281,"smiles":null,"spectrum_id":"CCMSLIB00017237592","spectrum_index":16073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLAMIDE (delta mass: 310.145 Da; putative annotation: N/A; putative formula: C13H26O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.2,"smiles":null,"spectrum_id":"CCMSLIB00017237594","spectrum_index":16074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetic acid methyl ester (delta mass: 112.0675 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.43,"smiles":null,"spectrum_id":"CCMSLIB00017237596","spectrum_index":16075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Erythrodiol (delta mass: 742.4865 Da; putative annotation: N/A; putative formula: C40H70O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1185.87,"smiles":null,"spectrum_id":"CCMSLIB00017237599","spectrum_index":16076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidinol (delta mass: 172.0732 Da; putative annotation: N/A; putative formula: C8H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.253,"smiles":null,"spectrum_id":"CCMSLIB00017237600","spectrum_index":16077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 100.0487 Da; putative annotation: N/A; putative formula: CH4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.124,"smiles":null,"spectrum_id":"CCMSLIB00017237603","spectrum_index":16078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 87.0574 Da; putative annotation: N/A; putative formula: C4H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017237604","spectrum_index":16079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 524.1369 Da; putative annotation: N/A; putative formula: C33H20N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.208,"smiles":null,"spectrum_id":"CCMSLIB00017237607","spectrum_index":16080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 192.1511 Da; putative annotation: N/A; putative formula: C13H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017237608","spectrum_index":16081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 90.0852 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.338,"smiles":null,"spectrum_id":"CCMSLIB00017237611","spectrum_index":16082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 707.2615 Da; putative annotation: N/A; putative formula: C37H46N3O5PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1212.44,"smiles":null,"spectrum_id":"CCMSLIB00017237612","spectrum_index":16083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Succinyladenosine; AIF; CE10; CorrDec (delta mass: 515.385 Da; putative annotation: N/A; putative formula: C30H45N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.5,"smiles":null,"spectrum_id":"CCMSLIB00017237615","spectrum_index":16084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Hydroxy-4Z,7Z,9E,13Z,16Z,19Z-docosahexaenoic acid (delta mass: 134.0576 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.3,"smiles":null,"spectrum_id":"CCMSLIB00017237616","spectrum_index":16085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 161.0317 Da; putative annotation: N/A; putative formula: C5H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.134,"smiles":null,"spectrum_id":"CCMSLIB00017237619","spectrum_index":16086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 42.0469 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017237620","spectrum_index":16087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU287201 Icaridin|butan-2-yl 2-(2-hydroxyethyl)piperidine-1-carboxylate (delta mass: 332.1663 Da; putative annotation: N/A; putative formula: C16H28O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.341,"smiles":null,"spectrum_id":"CCMSLIB00017237623","spectrum_index":16088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C16:1 (delta mass: 240.2093 Da; putative annotation: N/A; putative formula: C15H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.463,"smiles":null,"spectrum_id":"CCMSLIB00017237624","spectrum_index":16089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 263.1731 Da; putative annotation: N/A; putative formula: C12H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.316,"smiles":null,"spectrum_id":"CCMSLIB00017237627","spectrum_index":16090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 150.0674 Da; putative annotation: N/A; putative formula: C3H11N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017237628","spectrum_index":16091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 117.0849 Da; putative annotation: N/A; putative formula: H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.162,"smiles":null,"spectrum_id":"CCMSLIB00017237631","spectrum_index":16092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one (delta mass: 280.2404 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.317,"smiles":null,"spectrum_id":"CCMSLIB00017237632","spectrum_index":16093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 16.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.12,"smiles":null,"spectrum_id":"CCMSLIB00017237635","spectrum_index":16094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 88.0525 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017237636","spectrum_index":16095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLIC ACID (delta mass: 96.0578 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.097,"smiles":null,"spectrum_id":"CCMSLIB00017237639","spectrum_index":16096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 208.0879 Da; putative annotation: N/A; putative formula: C9H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.19,"smiles":null,"spectrum_id":"CCMSLIB00017237640","spectrum_index":16097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetinic acid (delta mass: 36.023 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.37,"smiles":null,"spectrum_id":"CCMSLIB00017237643","spectrum_index":16098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 188.1119 Da; putative annotation: N/A; putative formula: C13H17O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.37,"smiles":null,"spectrum_id":"CCMSLIB00017237644","spectrum_index":16099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 151.0832 Da; putative annotation: N/A; putative formula: C9H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.143,"smiles":null,"spectrum_id":"CCMSLIB00017237647","spectrum_index":16100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 86.0361 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.122,"smiles":null,"spectrum_id":"CCMSLIB00017237648","spectrum_index":16101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 38.027 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.129,"smiles":null,"spectrum_id":"CCMSLIB00017237651","spectrum_index":16102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 329.1317 Da; putative annotation: N/A; putative formula: C24H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.228,"smiles":null,"spectrum_id":"CCMSLIB00017237652","spectrum_index":16103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 265.0793 Da; putative annotation: N/A; putative formula: C9H15NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.249,"smiles":null,"spectrum_id":"CCMSLIB00017237655","spectrum_index":16104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flindersine CollisionEnergy:205060 (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.113,"smiles":null,"spectrum_id":"CCMSLIB00017237656","spectrum_index":16105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 139.074 Da; putative annotation: N/A; putative formula: C6H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.28,"smiles":null,"spectrum_id":"CCMSLIB00017237659","spectrum_index":16106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 35.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.071,"smiles":null,"spectrum_id":"CCMSLIB00017237660","spectrum_index":16107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-palmitoyl-rac-glycerol (delta mass: 18.0275 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.557,"smiles":null,"spectrum_id":"CCMSLIB00017237663","spectrum_index":16108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.07,"smiles":null,"spectrum_id":"CCMSLIB00017237664","spectrum_index":16109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 266.7553 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.842,"smiles":null,"spectrum_id":"CCMSLIB00017237667","spectrum_index":16110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 266.2247 Da; putative annotation: N/A; putative formula: C17H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.311,"smiles":null,"spectrum_id":"CCMSLIB00017237668","spectrum_index":16111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00160256-01!Sparteine-15-carboxylic acid (delta mass: 112.1346 Da; putative annotation: N/A; putative formula: C7H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.341,"smiles":null,"spectrum_id":"CCMSLIB00017237671","spectrum_index":16112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 362.0714 Da; putative annotation: N/A; putative formula: C22H19O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.351,"smiles":null,"spectrum_id":"CCMSLIB00017237672","spectrum_index":16113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 139.0363 Da; putative annotation: N/A; putative formula: CHN9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.143,"smiles":null,"spectrum_id":"CCMSLIB00017237674","spectrum_index":16114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 105.0536 Da; putative annotation: N/A; putative formula: C2H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.124,"smiles":null,"spectrum_id":"CCMSLIB00017237676","spectrum_index":16115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-4-pyrimidinamine (delta mass: 42.0221 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.109,"smiles":null,"spectrum_id":"CCMSLIB00017237677","spectrum_index":16116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 956.494 Da; putative annotation: N/A; putative formula: C43H76N2O21)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1119.55,"smiles":null,"spectrum_id":"CCMSLIB00017237680","spectrum_index":16117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Linolenoyl ethanolamide (delta mass: 414.2271 Da; putative annotation: N/A; putative formula: C23H34N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.501,"smiles":null,"spectrum_id":"CCMSLIB00017237681","spectrum_index":16118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 401.2886 Da; putative annotation: N/A; putative formula: C20H39N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.494,"smiles":null,"spectrum_id":"CCMSLIB00017237684","spectrum_index":16119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 48.0352 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.272,"smiles":null,"spectrum_id":"CCMSLIB00017237686","spectrum_index":16120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 44.0266 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.254,"smiles":null,"spectrum_id":"CCMSLIB00017237688","spectrum_index":16121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 66.0479 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.275,"smiles":null,"spectrum_id":"CCMSLIB00017237690","spectrum_index":16122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 155.0947 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.17,"smiles":null,"spectrum_id":"CCMSLIB00017237692","spectrum_index":16123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510508 Tyramine|4-(2-aminoethyl)phenol (delta mass: 104.0697 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.161,"smiles":null,"spectrum_id":"CCMSLIB00017237694","spectrum_index":16124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Succinyl-L-homoserine (delta mass: 111.0315 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.113,"smiles":null,"spectrum_id":"CCMSLIB00017237696","spectrum_index":16125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 144.0399 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.077,"smiles":null,"spectrum_id":"CCMSLIB00017237699","spectrum_index":16126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tri(ethylene glycol) monoethyl ether (delta mass: 104.0422 Da; putative annotation: N/A; putative formula: C3H8N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.17,"smiles":null,"spectrum_id":"CCMSLIB00017237700","spectrum_index":16127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 891.395 Da; putative annotation: N/A; putative formula: C43H57N9O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1113.49,"smiles":null,"spectrum_id":"CCMSLIB00017237703","spectrum_index":16128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aS,6aS,6bR,9R,10R,11S,12aR)-11-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate (delta mass: 66.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":849.495,"smiles":null,"spectrum_id":"CCMSLIB00017237704","spectrum_index":16129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MAG (delta mass: 340.0854 Da; putative annotation: N/A; putative formula: C14H12N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.385,"smiles":null,"spectrum_id":"CCMSLIB00017237707","spectrum_index":16130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 885.5091 Da; putative annotation: N/A; putative formula: C51H67N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1066.58,"smiles":null,"spectrum_id":"CCMSLIB00017237708","spectrum_index":16131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.159,"smiles":null,"spectrum_id":"CCMSLIB00017237711","spectrum_index":16132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.289,"smiles":null,"spectrum_id":"CCMSLIB00017237712","spectrum_index":16133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 122.0371 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.139,"smiles":null,"spectrum_id":"CCMSLIB00017237715","spectrum_index":16134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 287.1158 Da; putative annotation: N/A; putative formula: C16H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.181,"smiles":null,"spectrum_id":"CCMSLIB00017237716","spectrum_index":16135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 267.1583 Da; putative annotation: N/A; putative formula: C13H21N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.276,"smiles":null,"spectrum_id":"CCMSLIB00017237719","spectrum_index":16136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 232.121 Da; putative annotation: N/A; putative formula: C13H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.218,"smiles":null,"spectrum_id":"CCMSLIB00017237720","spectrum_index":16137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 192.0937 Da; putative annotation: N/A; putative formula: C15H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.185,"smiles":null,"spectrum_id":"CCMSLIB00017237723","spectrum_index":16138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((1S,3aR,4S,6S,7R,8aR)-1-Hydroxy-4,8a-dimethyloctahydro-1H-3a,6-epoxyazulen-7-yl)prop-2-enoic acid (delta mass: 114.0824 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.241,"smiles":null,"spectrum_id":"CCMSLIB00017237724","spectrum_index":16139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 17.9683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.19,"smiles":null,"spectrum_id":"CCMSLIB00017237727","spectrum_index":16140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2-1-glyceryl ester (delta mass: 106.0769 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.346,"smiles":null,"spectrum_id":"CCMSLIB00017237728","spectrum_index":16141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 274.2499 Da; putative annotation: N/A; putative formula: C12H30N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.482,"smiles":null,"spectrum_id":"CCMSLIB00017237731","spectrum_index":16142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 342.0953 Da; putative annotation: N/A; putative formula: C10H15N8O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.25,"smiles":null,"spectrum_id":"CCMSLIB00017237732","spectrum_index":16143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 238.084 Da; putative annotation: N/A; putative formula: C12H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.165,"smiles":null,"spectrum_id":"CCMSLIB00017237735","spectrum_index":16144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 318.2574 Da; putative annotation: N/A; putative formula: C20H35N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.298,"smiles":null,"spectrum_id":"CCMSLIB00017237736","spectrum_index":16145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 616.2255 Da; putative annotation: N/A; putative formula: C27H28N12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":797.266,"smiles":null,"spectrum_id":"CCMSLIB00017237739","spectrum_index":16146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 92.0474 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017237740","spectrum_index":16147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-L-phenylalanine (delta mass: 87.0406 Da; putative annotation: N/A; putative formula: C2H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.117,"smiles":null,"spectrum_id":"CCMSLIB00017237743","spectrum_index":16148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 69.0585 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.14,"smiles":null,"spectrum_id":"CCMSLIB00017237744","spectrum_index":16149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 100.9354 Da; putative annotation: N/A; putative formula: C2H-1NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.017,"smiles":null,"spectrum_id":"CCMSLIB00017237746","spectrum_index":16150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 313.26 Da; putative annotation: N/A; putative formula: C14H31N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.513,"smiles":null,"spectrum_id":"CCMSLIB00017237748","spectrum_index":16151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pregabalin (delta mass: 124.0884 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.222,"smiles":null,"spectrum_id":"CCMSLIB00017237750","spectrum_index":16152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)acetamide (delta mass: 192.0427 Da; putative annotation: N/A; putative formula: C3H8N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.161,"smiles":null,"spectrum_id":"CCMSLIB00017237752","spectrum_index":16153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 60.0539 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.181,"smiles":null,"spectrum_id":"CCMSLIB00017237754","spectrum_index":16154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 595.5531 Da; putative annotation: N/A; putative formula: C37H73NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":878.816,"smiles":null,"spectrum_id":"CCMSLIB00017237756","spectrum_index":16155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrimidinemethanamine (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.098,"smiles":null,"spectrum_id":"CCMSLIB00017237758","spectrum_index":16156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)propanamide (delta mass: 48.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.155,"smiles":null,"spectrum_id":"CCMSLIB00017237760","spectrum_index":16157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 118.1181 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.35,"smiles":null,"spectrum_id":"CCMSLIB00017237761","spectrum_index":16158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methylaspartic acid (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.071,"smiles":null,"spectrum_id":"CCMSLIB00017237764","spectrum_index":16159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 242.0205 Da; putative annotation: N/A; putative formula: C6H11O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.144,"smiles":null,"spectrum_id":"CCMSLIB00017237765","spectrum_index":16160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 117.077 Da; putative annotation: N/A; putative formula: CH7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.201,"smiles":null,"spectrum_id":"CCMSLIB00017237768","spectrum_index":16161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 311.2472 Da; putative annotation: N/A; putative formula: C19H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.474,"smiles":null,"spectrum_id":"CCMSLIB00017237769","spectrum_index":16162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 23.0245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.101,"smiles":null,"spectrum_id":"CCMSLIB00017237772","spectrum_index":16163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 103.9996 Da; putative annotation: N/A; putative formula: C5N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.086,"smiles":null,"spectrum_id":"CCMSLIB00017237775","spectrum_index":16164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 29.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.102,"smiles":null,"spectrum_id":"CCMSLIB00017237776","spectrum_index":16165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 82.0283 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.131,"smiles":null,"spectrum_id":"CCMSLIB00017237779","spectrum_index":16166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 130.1357 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.29,"smiles":null,"spectrum_id":"CCMSLIB00017237780","spectrum_index":16167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 204.0633 Da; putative annotation: N/A; putative formula: C8H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.123,"smiles":null,"spectrum_id":"CCMSLIB00017237783","spectrum_index":16168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexadecanedioic acid (delta mass: 50.0496 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.271,"smiles":null,"spectrum_id":"CCMSLIB00017237784","spectrum_index":16169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1024.3741 Da; putative annotation: N/A; putative formula: C54H44N18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1246.47,"smiles":null,"spectrum_id":"CCMSLIB00017237786","spectrum_index":16170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 131.0849 Da; putative annotation: N/A; putative formula: C8H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.161,"smiles":null,"spectrum_id":"CCMSLIB00017237788","spectrum_index":16171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 14.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.284,"smiles":null,"spectrum_id":"CCMSLIB00017237791","spectrum_index":16172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 419.1788 Da; putative annotation: N/A; putative formula: C16H25N11O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.275,"smiles":null,"spectrum_id":"CCMSLIB00017237792","spectrum_index":16173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stanozolol (delta mass: 533.4327 Da; putative annotation: N/A; putative formula: C31H51N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":862.691,"smiles":null,"spectrum_id":"CCMSLIB00017237795","spectrum_index":16174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 56.062 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.127,"smiles":null,"spectrum_id":"CCMSLIB00017237796","spectrum_index":16175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 345.1332 Da; putative annotation: N/A; putative formula: C18H23N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.288,"smiles":null,"spectrum_id":"CCMSLIB00017237799","spectrum_index":16176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 108.094 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017237800","spectrum_index":16177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:102040 (delta mass: 398.0037 Da; putative annotation: N/A; putative formula: C20H17O-1P3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.048,"smiles":null,"spectrum_id":"CCMSLIB00017237802","spectrum_index":16178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzoic acid (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.049,"smiles":null,"spectrum_id":"CCMSLIB00017237804","spectrum_index":16179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-METHOXYSALICYLIC ACID (delta mass: 210.089 Da; putative annotation: N/A; putative formula: C11H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.138,"smiles":null,"spectrum_id":"CCMSLIB00017237807","spectrum_index":16180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 208.0732 Da; putative annotation: N/A; putative formula: C11H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.123,"smiles":null,"spectrum_id":"CCMSLIB00017237808","spectrum_index":16181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 60.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017237811","spectrum_index":16182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzylbenzoic acid (delta mass: 106.0736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017237812","spectrum_index":16183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 64.0583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.28,"smiles":null,"spectrum_id":"CCMSLIB00017237815","spectrum_index":16184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Muricholic acid (delta mass: 100.0668 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.362,"smiles":null,"spectrum_id":"CCMSLIB00017237816","spectrum_index":16185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300757 Cephaeline (delta mass: 132.9951 Da; putative annotation: N/A; putative formula: C2H3N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.286,"smiles":null,"spectrum_id":"CCMSLIB00017237819","spectrum_index":16186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 167.1158 Da; putative annotation: N/A; putative formula: C7H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.306,"smiles":null,"spectrum_id":"CCMSLIB00017237820","spectrum_index":16187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 259.144 Da; putative annotation: N/A; putative formula: C13H17N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.215,"smiles":null,"spectrum_id":"CCMSLIB00017237823","spectrum_index":16188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385097-01_C20H22O9_beta-D-Glucopyranoside, 4-hydroxy-2-(hydroxymethyl)phenyl, 6-benzoate (delta mass: 211.9863 Da; putative annotation: N/A; putative formula: C2H6N4O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.12,"smiles":null,"spectrum_id":"CCMSLIB00017237824","spectrum_index":16189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 96.0609 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.283,"smiles":null,"spectrum_id":"CCMSLIB00017237827","spectrum_index":16190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 583.3303 Da; putative annotation: N/A; putative formula: C22H41N13O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.411,"smiles":null,"spectrum_id":"CCMSLIB00017237828","spectrum_index":16191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,24-Dihydroxyvitamin D3 (delta mass: 19.0063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.343,"smiles":null,"spectrum_id":"CCMSLIB00017237831","spectrum_index":16192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 60.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.196,"smiles":null,"spectrum_id":"CCMSLIB00017237832","spectrum_index":16193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hexadec-15-en-7-ynyl-4-hydroxy-5-methyloxolan-2-one (delta mass: 64.0699 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.328,"smiles":null,"spectrum_id":"CCMSLIB00017237835","spectrum_index":16194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 289.0929 Da; putative annotation: N/A; putative formula: C19H15NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.351,"smiles":null,"spectrum_id":"CCMSLIB00017237836","spectrum_index":16195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 104.0462 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.102,"smiles":null,"spectrum_id":"CCMSLIB00017237839","spectrum_index":16196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 201.0995 Da; putative annotation: N/A; putative formula: C9H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.238,"smiles":null,"spectrum_id":"CCMSLIB00017237840","spectrum_index":16197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385919-01_C20H34O_2-Penten-1-ol, 5-[(1S,4aS,8aS)-decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]-3-methyl-, (2E)- (delta mass: 136.1256 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.394,"smiles":null,"spectrum_id":"CCMSLIB00017237843","spectrum_index":16198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (4R,4aS,10R,13aR)-14-hydroxy-4,13a-dimethyl-9,13-dioxo-2,3,4,4a,5,6,9,10,11,12,13,13a-dodecahydro-1H-7,10-methanobenzo[11]annulene-4-carboxylate (delta mass: 68.0618 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.263,"smiles":null,"spectrum_id":"CCMSLIB00017237844","spectrum_index":16199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Nitrobenzenemethanol (delta mass: 41.0262 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.076,"smiles":null,"spectrum_id":"CCMSLIB00017237846","spectrum_index":16200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-11Z,13E-eicosadienoic acid (delta mass: 193.1303 Da; putative annotation: N/A; putative formula: C12H19NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.404,"smiles":null,"spectrum_id":"CCMSLIB00017237848","spectrum_index":16201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 57.0348 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017237849","spectrum_index":16202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1,1-Tris(hydroxymethyl)propane (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.17,"smiles":null,"spectrum_id":"CCMSLIB00017237852","spectrum_index":16203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 39.995 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017237853","spectrum_index":16204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017237856","spectrum_index":16205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxyquinoline-2-carboxylic acid CollisionEnergy:102040 (delta mass: 98.0366 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.102,"smiles":null,"spectrum_id":"CCMSLIB00017237857","spectrum_index":16206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Chloro-9H-carbazole (delta mass: 62.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.063,"smiles":null,"spectrum_id":"CCMSLIB00017237860","spectrum_index":16207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Bromo-2H-indazole (delta mass: 64.0344 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.005,"smiles":null,"spectrum_id":"CCMSLIB00017237861","spectrum_index":16208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy-4(15),11(13)-eudesmadien-12,6-olide (delta mass: 70.0057 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017237864","spectrum_index":16209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 57.0726 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.133,"smiles":null,"spectrum_id":"CCMSLIB00017237866","spectrum_index":16210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 189.0797 Da; putative annotation: N/A; putative formula: C11H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.155,"smiles":null,"spectrum_id":"CCMSLIB00017237868","spectrum_index":16211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 50.0601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.175,"smiles":null,"spectrum_id":"CCMSLIB00017237870","spectrum_index":16212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 297.194 Da; putative annotation: N/A; putative formula: C16H27NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.265,"smiles":null,"spectrum_id":"CCMSLIB00017237872","spectrum_index":16213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 41.0807 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.162,"smiles":null,"spectrum_id":"CCMSLIB00017237874","spectrum_index":16214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 355.0904 Da; putative annotation: N/A; putative formula: C15H17NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.224,"smiles":null,"spectrum_id":"CCMSLIB00017237876","spectrum_index":16215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 155.0952 Da; putative annotation: N-Acetyl-DL-leucine; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.292,"smiles":null,"spectrum_id":"CCMSLIB00017237879","spectrum_index":16216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 278.2223 Da; putative annotation: (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.449,"smiles":null,"spectrum_id":"CCMSLIB00017237880","spectrum_index":16217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 262.2308 Da; putative annotation: Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.416,"smiles":null,"spectrum_id":"CCMSLIB00017237883","spectrum_index":16218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 294.0947 Da; putative annotation: N6-(2,4-Dinitrophenyl)-L-lysine; putative formula: C12H14N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.181,"smiles":null,"spectrum_id":"CCMSLIB00017237884","spectrum_index":16219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tobramycin, fragment AB or degraded (delta mass: 144.0897 Da; putative annotation: DL-5-Hydroxylysine; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.266,"smiles":null,"spectrum_id":"CCMSLIB00017237887","spectrum_index":16220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 136.1249 Da; putative annotation: (+)-Dihydrocarveol; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.393,"smiles":null,"spectrum_id":"CCMSLIB00017237888","spectrum_index":16221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Gln (delta mass: 113.084 Da; putative annotation: NORLEUCINE - 60.0 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017237891","spectrum_index":16222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 164.1572 Da; putative annotation: 1-(3,3-Dimethylbicyclo[2.2.1]hept-2-yl)-1-propanol; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.347,"smiles":null,"spectrum_id":"CCMSLIB00017237892","spectrum_index":16223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cedrol (delta mass: 190.1722 Da; putative annotation: 1-Ethynylcyclododecanol; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.378,"smiles":null,"spectrum_id":"CCMSLIB00017237895","spectrum_index":16224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 129.0793 Da; putative annotation: 4-Hydroxy-L-isoleucine; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017237896","spectrum_index":16225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 113.0842 Da; putative annotation: 6-Aminocaproic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.155,"smiles":null,"spectrum_id":"CCMSLIB00017237899","spectrum_index":16226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 152.0836 Da; putative annotation: 3-(2-Oxocyclohexyl)propanoic acid; putative formula: C9H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.331,"smiles":null,"spectrum_id":"CCMSLIB00017237900","spectrum_index":16227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 127.0519 Da; putative annotation: 3-(1H-Pyrazol-3-yl)pyridine; putative formula: C8H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.195,"smiles":null,"spectrum_id":"CCMSLIB00017237903","spectrum_index":16228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 197.0902 Da; putative annotation: (+)-Camphorsultam; putative formula: C10H15NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.275,"smiles":null,"spectrum_id":"CCMSLIB00017237904","spectrum_index":16229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 215.0945 Da; putative annotation: 1-(4-Methylbenzyl)-5-oxo-3-pyrrolidinecarboxylic acid; putative formula: C13H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017237907","spectrum_index":16230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 124.0884 Da; putative annotation: 3-Methyl-1-cyclohexanecarboxylic acid; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017237908","spectrum_index":16231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 268.2185 Da; putative annotation: Retinol; putative formula: C20H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.503,"smiles":null,"spectrum_id":"CCMSLIB00017237911","spectrum_index":16232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 176.0842 Da; putative annotation: Galiellalactone; putative formula: C11H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.155,"smiles":null,"spectrum_id":"CCMSLIB00017237912","spectrum_index":16233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 207.0525 Da; putative annotation: Madurastatin B2; putative formula: C10H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.091,"smiles":null,"spectrum_id":"CCMSLIB00017237915","spectrum_index":16234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 210.1258 Da; putative annotation: 9-(Methoxycarbonyl)dec-9-enoic acid; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.238,"smiles":null,"spectrum_id":"CCMSLIB00017237916","spectrum_index":16235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 132.0423 Da; putative annotation: L-Xylulose; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.102,"smiles":null,"spectrum_id":"CCMSLIB00017237919","spectrum_index":16236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 282.2184 Da; putative annotation: Roccellic acid; putative formula: C17H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.497,"smiles":null,"spectrum_id":"CCMSLIB00017237920","spectrum_index":16237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 244.1093 Da; putative annotation: 8-hydroxy-5,8a-dimethyl-3-methylidene-3a,4,4a,8,9,9a-hexahydrobenzo[f][1]benzofuran-2,7-dione; putative formula: C15H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.18,"smiles":null,"spectrum_id":"CCMSLIB00017237923","spectrum_index":16238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylpentadecanoic acid (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.31,"smiles":null,"spectrum_id":"CCMSLIB00017237924","spectrum_index":16239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decahydronaphthalene-2-carboxylic acid (delta mass: 27.0098 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.148,"smiles":null,"spectrum_id":"CCMSLIB00017237927","spectrum_index":16240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 295.2508 Da; putative annotation: N/A; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.634,"smiles":null,"spectrum_id":"CCMSLIB00017237928","spectrum_index":16241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 118.0777 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.31,"smiles":null,"spectrum_id":"CCMSLIB00017237931","spectrum_index":16242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 52.0676 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.321,"smiles":null,"spectrum_id":"CCMSLIB00017237932","spectrum_index":16243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 86.0368 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.149,"smiles":null,"spectrum_id":"CCMSLIB00017237935","spectrum_index":16244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 230.1558 Da; putative annotation: N/A; putative formula: C10H22N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.295,"smiles":null,"spectrum_id":"CCMSLIB00017237936","spectrum_index":16245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aureonitol (delta mass: 419.171 Da; putative annotation: N/A; putative formula: C18H30NO8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.309,"smiles":null,"spectrum_id":"CCMSLIB00017237939","spectrum_index":16246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydro-11-deoxycorticosterone (delta mass: 74.0509 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.309,"smiles":null,"spectrum_id":"CCMSLIB00017237940","spectrum_index":16247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-ethyl-4-methylhydroquinolin-2-one CollisionEnergy:205060 (delta mass: 92.0464 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.153,"smiles":null,"spectrum_id":"CCMSLIB00017237943","spectrum_index":16248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 94.0739 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.233,"smiles":null,"spectrum_id":"CCMSLIB00017237944","spectrum_index":16249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 51.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.107,"smiles":null,"spectrum_id":"CCMSLIB00017237947","spectrum_index":16250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 746.2631 Da; putative annotation: N/A; putative formula: C39H46N4O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":909.323,"smiles":null,"spectrum_id":"CCMSLIB00017237948","spectrum_index":16251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 85.016 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.155,"smiles":null,"spectrum_id":"CCMSLIB00017237951","spectrum_index":16252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Vaccenic acid (delta mass: 68.0623 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.326,"smiles":null,"spectrum_id":"CCMSLIB00017237952","spectrum_index":16253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 92.0622 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.242,"smiles":null,"spectrum_id":"CCMSLIB00017237955","spectrum_index":16254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15(S)-15-Methylprostaglandin F2.alpha. isopropyl ester (delta mass: 116.0633 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.374,"smiles":null,"spectrum_id":"CCMSLIB00017237956","spectrum_index":16255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 88.0244 Da; putative annotation: N/A; putative formula: C2H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.111,"smiles":null,"spectrum_id":"CCMSLIB00017237959","spectrum_index":16256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 354.1108 Da; putative annotation: N/A; putative formula: C12H24N2O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.16,"smiles":null,"spectrum_id":"CCMSLIB00017237960","spectrum_index":16257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 366.257 Da; putative annotation: N/A; putative formula: C18H34N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.38,"smiles":null,"spectrum_id":"CCMSLIB00017237963","spectrum_index":16258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one (delta mass: 78.047 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017237964","spectrum_index":16259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 188.0797 Da; putative annotation: N/A; putative formula: C7H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.14,"smiles":null,"spectrum_id":"CCMSLIB00017237967","spectrum_index":16260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Cyclohexanecarbonylpentadecylamine from NIST14 (delta mass: 91.0627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.404,"smiles":null,"spectrum_id":"CCMSLIB00017237968","spectrum_index":16261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aminoglutethimide (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.139,"smiles":null,"spectrum_id":"CCMSLIB00017237971","spectrum_index":16262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,7,9-Tetramethyl-5-decyne-4,7-diol (delta mass: 38.0509 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.251,"smiles":null,"spectrum_id":"CCMSLIB00017237972","spectrum_index":16263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 86.0368 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017237975","spectrum_index":16264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 41.0754 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.11,"smiles":null,"spectrum_id":"CCMSLIB00017237976","spectrum_index":16265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C20:5 (delta mass: 162.0903 Da; putative annotation: N/A; putative formula: C8H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.344,"smiles":null,"spectrum_id":"CCMSLIB00017237979","spectrum_index":16266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 967.514 Da; putative annotation: N/A; putative formula: C47H65N15O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1160.58,"smiles":null,"spectrum_id":"CCMSLIB00017237980","spectrum_index":16267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.149,"smiles":null,"spectrum_id":"CCMSLIB00017237983","spectrum_index":16268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 203.2247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.306,"smiles":null,"spectrum_id":"CCMSLIB00017237984","spectrum_index":16269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 180.0984 Da; putative annotation: N/A; putative formula: C4H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.2,"smiles":null,"spectrum_id":"CCMSLIB00017237987","spectrum_index":16270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 220.0962 Da; putative annotation: N/A; putative formula: C10H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.187,"smiles":null,"spectrum_id":"CCMSLIB00017237988","spectrum_index":16271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380451-01_C20H28O5_2-(3-Furyl)-7,8-dihydroxy-6a,7,10b-trimethyldodecahydro-4H-benzo[f]isochromen-4-one (delta mass: 78.0145 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.216,"smiles":null,"spectrum_id":"CCMSLIB00017237990","spectrum_index":16272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrokawain-5-ol (delta mass: 212.087 Da; putative annotation: N/A; putative formula: C14H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.199,"smiles":null,"spectrum_id":"CCMSLIB00017237992","spectrum_index":16273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 114.0803 Da; putative annotation: N/A; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.453,"smiles":null,"spectrum_id":"CCMSLIB00017237994","spectrum_index":16274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 122.0724 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.195,"smiles":null,"spectrum_id":"CCMSLIB00017237996","spectrum_index":16275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 76.0676 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.206,"smiles":null,"spectrum_id":"CCMSLIB00017237999","spectrum_index":16276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[5-(2-Methylpropyl)-3,6-dioxopiperazin-2-yl]propanoic acid (delta mass: 130.1112 Da; putative annotation: N/A; putative formula: C6H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017238000","spectrum_index":16277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 41.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017238003","spectrum_index":16278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.31,"smiles":null,"spectrum_id":"CCMSLIB00017238004","spectrum_index":16279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pistillarin (delta mass: 264.0839 Da; putative annotation: N/A; putative formula: C10H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.281,"smiles":null,"spectrum_id":"CCMSLIB00017238007","spectrum_index":16280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 63.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.165,"smiles":null,"spectrum_id":"CCMSLIB00017238008","spectrum_index":16281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 395.0296 Da; putative annotation: N/A; putative formula: C21H17NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.09,"smiles":null,"spectrum_id":"CCMSLIB00017238011","spectrum_index":16282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 165.0795 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.171,"smiles":null,"spectrum_id":"CCMSLIB00017238012","spectrum_index":16283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Enterolactone (delta mass: 79.9577 Da; putative annotation: N/A; putative formula: H2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.086,"smiles":null,"spectrum_id":"CCMSLIB00017238015","spectrum_index":16284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 96.0575 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017238016","spectrum_index":16285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 14.5075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.646,"smiles":null,"spectrum_id":"CCMSLIB00017238019","spectrum_index":16286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 287.1753 Da; putative annotation: N/A; putative formula: C15H21N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.433,"smiles":null,"spectrum_id":"CCMSLIB00017238020","spectrum_index":16287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 283.1424 Da; putative annotation: N/A; putative formula: C14H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.208,"smiles":null,"spectrum_id":"CCMSLIB00017238022","spectrum_index":16288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 632.1605 Da; putative annotation: N/A; putative formula: C30H29N6O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.2,"smiles":null,"spectrum_id":"CCMSLIB00017238024","spectrum_index":16289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Adamantanol (delta mass: 41.8726 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017238026","spectrum_index":16290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE0; CorrDec (delta mass: 453.2623 Da; putative annotation: N/A; putative formula: C26H35N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.338,"smiles":null,"spectrum_id":"CCMSLIB00017238028","spectrum_index":16291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Atractylenolide III (delta mass: 36.0363 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.185,"smiles":null,"spectrum_id":"CCMSLIB00017238030","spectrum_index":16292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cucurbitacin D (delta mass: 325.0845 Da; putative annotation: N/A; putative formula: C12H15N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":842.401,"smiles":null,"spectrum_id":"CCMSLIB00017238032","spectrum_index":16293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 239.1015 Da; putative annotation: N/A; putative formula: C9H13N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.25,"smiles":null,"spectrum_id":"CCMSLIB00017238034","spectrum_index":16294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)cyclopentanol (delta mass: 170.0933 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.258,"smiles":null,"spectrum_id":"CCMSLIB00017238036","spectrum_index":16295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 111.0682 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.133,"smiles":null,"spectrum_id":"CCMSLIB00017238038","spectrum_index":16296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 50.0 eV (delta mass: 307.1179 Da; putative annotation: N/A; putative formula: C15H21N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.209,"smiles":null,"spectrum_id":"CCMSLIB00017238040","spectrum_index":16297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 323.883 Da; putative annotation: N/A; putative formula: C10N2O3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.943,"smiles":null,"spectrum_id":"CCMSLIB00017238042","spectrum_index":16298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,3r,8S,9r)-1,8-dimethyl-3,6-diazatricyclo[4.3.1.1(3,8)]undecan-9-ol (delta mass: 9.0073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.172,"smiles":null,"spectrum_id":"CCMSLIB00017238044","spectrum_index":16299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 338.2829 Da; putative annotation: N/A; putative formula: C21H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.359,"smiles":null,"spectrum_id":"CCMSLIB00017238046","spectrum_index":16300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonoylglycerol (delta mass: 137.0957 Da; putative annotation: N/A; putative formula: C7H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.38,"smiles":null,"spectrum_id":"CCMSLIB00017238048","spectrum_index":16301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvaol (delta mass: 54.0465 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.435,"smiles":null,"spectrum_id":"CCMSLIB00017238051","spectrum_index":16302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 220.11 Da; putative annotation: N/A; putative formula: C13H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.154,"smiles":null,"spectrum_id":"CCMSLIB00017238052","spectrum_index":16303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 123.0424 Da; putative annotation: N/A; putative formula: C5H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.41,"smiles":null,"spectrum_id":"CCMSLIB00017238055","spectrum_index":16304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 57.0416 Da; putative annotation: N/A; putative formula: H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.154,"smiles":null,"spectrum_id":"CCMSLIB00017238056","spectrum_index":16305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 218.0801 Da; putative annotation: N/A; putative formula: C10H18OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.291,"smiles":null,"spectrum_id":"CCMSLIB00017238059","spectrum_index":16306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 257.1431 Da; putative annotation: N/A; putative formula: C9H19N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.229,"smiles":null,"spectrum_id":"CCMSLIB00017238060","spectrum_index":16307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 242.1607 Da; putative annotation: N/A; putative formula: C8H18N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.299,"smiles":null,"spectrum_id":"CCMSLIB00017238063","spectrum_index":16308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 42.0723 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.211,"smiles":null,"spectrum_id":"CCMSLIB00017238064","spectrum_index":16309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 144.1515 Da; putative annotation: N/A; putative formula: C5H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.217,"smiles":null,"spectrum_id":"CCMSLIB00017238066","spectrum_index":16310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2 methyl ester (delta mass: 45.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.305,"smiles":null,"spectrum_id":"CCMSLIB00017238068","spectrum_index":16311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 49.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.3,"smiles":null,"spectrum_id":"CCMSLIB00017238070","spectrum_index":16312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,13.alpha.)-7-Oxopimara-8,15-dien-18-oic acid (delta mass: 95.0941 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.305,"smiles":null,"spectrum_id":"CCMSLIB00017238072","spectrum_index":16313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 64.0677 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.112,"smiles":null,"spectrum_id":"CCMSLIB00017238073","spectrum_index":16314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 120.099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.451,"smiles":null,"spectrum_id":"CCMSLIB00017238076","spectrum_index":16315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 329.3268 Da; putative annotation: N/A; putative formula: C16H39N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.579,"smiles":null,"spectrum_id":"CCMSLIB00017238077","spectrum_index":16316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,5'-Methylenebis(2-hydroxy-3-methylbenzoic acid) (delta mass: 36.0325 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.134,"smiles":null,"spectrum_id":"CCMSLIB00017238080","spectrum_index":16317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Myrtenol (delta mass: 27.9937 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.121,"smiles":null,"spectrum_id":"CCMSLIB00017238081","spectrum_index":16318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 279.1151 Da; putative annotation: N/A; putative formula: C11H23NO3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.201,"smiles":null,"spectrum_id":"CCMSLIB00017238084","spectrum_index":16319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 116.1021 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.35,"smiles":null,"spectrum_id":"CCMSLIB00017238085","spectrum_index":16320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 197.9117 Da; putative annotation: N/A; putative formula: C3H2O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.987,"smiles":null,"spectrum_id":"CCMSLIB00017238088","spectrum_index":16321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130036 (delta mass: 21.9821 Da; putative annotation: N/A; putative formula: C2H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.178,"smiles":null,"spectrum_id":"CCMSLIB00017238089","spectrum_index":16322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.206,"smiles":null,"spectrum_id":"CCMSLIB00017238092","spectrum_index":16323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anthralin (delta mass: 75.0272 Da; putative annotation: N/A; putative formula: CH5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.098,"smiles":null,"spectrum_id":"CCMSLIB00017238093","spectrum_index":16324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 323.1462 Da; putative annotation: N/A; putative formula: C12H13N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.228,"smiles":null,"spectrum_id":"CCMSLIB00017238096","spectrum_index":16325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 244.0213 Da; putative annotation: N/A; putative formula: C14H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.081,"smiles":null,"spectrum_id":"CCMSLIB00017238097","spectrum_index":16326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 175.061 Da; putative annotation: N/A; putative formula: C6H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.163,"smiles":null,"spectrum_id":"CCMSLIB00017238100","spectrum_index":16327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-proline (delta mass: 68.0627 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.149,"smiles":null,"spectrum_id":"CCMSLIB00017238101","spectrum_index":16328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 143.0992 Da; putative annotation: N/A; putative formula: C6H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.18,"smiles":null,"spectrum_id":"CCMSLIB00017238104","spectrum_index":16329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 120.099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.269,"smiles":null,"spectrum_id":"CCMSLIB00017238105","spectrum_index":16330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decahydronaphthalene-2-carboxylic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.148,"smiles":null,"spectrum_id":"CCMSLIB00017238108","spectrum_index":16331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Isobutylpiperazine (delta mass: 99.1294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.284,"smiles":null,"spectrum_id":"CCMSLIB00017238109","spectrum_index":16332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 30.0063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.108,"smiles":null,"spectrum_id":"CCMSLIB00017238112","spectrum_index":16333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 251.9891 Da; putative annotation: N/A; putative formula: C7H4N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.075,"smiles":null,"spectrum_id":"CCMSLIB00017238113","spectrum_index":16334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 492.2926 Da; putative annotation: N/A; putative formula: C29H40N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.353,"smiles":null,"spectrum_id":"CCMSLIB00017238116","spectrum_index":16335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 525.4753 Da; putative annotation: N/A; putative formula: C32H63NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.535,"smiles":null,"spectrum_id":"CCMSLIB00017238117","spectrum_index":16336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 497.4441 Da; putative annotation: N/A; putative formula: C30H59NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.504,"smiles":null,"spectrum_id":"CCMSLIB00017238120","spectrum_index":16337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 483.1949 Da; putative annotation: N/A; putative formula: C25H33N5O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.276,"smiles":null,"spectrum_id":"CCMSLIB00017238121","spectrum_index":16338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 15.0551 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.16,"smiles":null,"spectrum_id":"CCMSLIB00017238124","spectrum_index":16339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 130.0626 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.232,"smiles":null,"spectrum_id":"CCMSLIB00017238125","spectrum_index":16340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one (delta mass: 48.0409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.2,"smiles":null,"spectrum_id":"CCMSLIB00017238128","spectrum_index":16341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic JBIR 27 (delta mass: 38.0158 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017238129","spectrum_index":16342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 116.097 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.35,"smiles":null,"spectrum_id":"CCMSLIB00017238132","spectrum_index":16343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of QuinicAcid (delta mass: 132.0574 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.128,"smiles":null,"spectrum_id":"CCMSLIB00017238134","spectrum_index":16344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 233.0328 Da; putative annotation: N/A; putative formula: C6H4N9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.093,"smiles":null,"spectrum_id":"CCMSLIB00017238136","spectrum_index":16345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 114.0809 Da; putative annotation: N/A; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.203,"smiles":null,"spectrum_id":"CCMSLIB00017238138","spectrum_index":16346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 98.0534 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.249,"smiles":null,"spectrum_id":"CCMSLIB00017238140","spectrum_index":16347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311078 Coumaroyl putrescin (delta mass: 32.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.171,"smiles":null,"spectrum_id":"CCMSLIB00017238142","spectrum_index":16348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of sinomenine (delta mass: 117.0457 Da; putative annotation: N/A; putative formula: C3H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.216,"smiles":null,"spectrum_id":"CCMSLIB00017238144","spectrum_index":16349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.206,"smiles":null,"spectrum_id":"CCMSLIB00017238146","spectrum_index":16350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminoheptanoic acid (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.117,"smiles":null,"spectrum_id":"CCMSLIB00017238148","spectrum_index":16351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 284.046 Da; putative annotation: N/A; putative formula: C13H17OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.106,"smiles":null,"spectrum_id":"CCMSLIB00017238150","spectrum_index":16352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 27.0248 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.091,"smiles":null,"spectrum_id":"CCMSLIB00017238152","spectrum_index":16353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000551010-01!1H-quinazolin-4-one (delta mass: 82.0884 Da; putative annotation: N/A; putative formula: C5H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.144,"smiles":null,"spectrum_id":"CCMSLIB00017238155","spectrum_index":16354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 51.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.254,"smiles":null,"spectrum_id":"CCMSLIB00017238156","spectrum_index":16355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 122.1097 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.321,"smiles":null,"spectrum_id":"CCMSLIB00017238157","spectrum_index":16356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-6,10,14,18-tetraene-2,3,22,23-tetrol (delta mass: 142.1149 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.524,"smiles":null,"spectrum_id":"CCMSLIB00017238160","spectrum_index":16357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleana-1,9(11)-dien-28-oic acid, 2-cyano-3,12-dioxo- (delta mass: 132.1005 Da; putative annotation: N/A; putative formula: C4H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.411,"smiles":null,"spectrum_id":"CCMSLIB00017238161","spectrum_index":16358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4'-Ethenyl-2'-hydroxy-1,4',4a-trimethyl-5-oxospiro[2,3,4,7,8,8a-hexahydronaphthalene-6,1'-cyclopentane]-1-carboxylic acid (delta mass: 560.4564 Da; putative annotation: N/A; putative formula: C35H56N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.678,"smiles":null,"spectrum_id":"CCMSLIB00017238164","spectrum_index":16359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 68.063 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.17,"smiles":null,"spectrum_id":"CCMSLIB00017238165","spectrum_index":16360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 104.105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.41,"smiles":null,"spectrum_id":"CCMSLIB00017238168","spectrum_index":16361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 136.0932 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.32,"smiles":null,"spectrum_id":"CCMSLIB00017238170","spectrum_index":16362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 175.1217 Da; putative annotation: N/A; putative formula: C9H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.333,"smiles":null,"spectrum_id":"CCMSLIB00017238172","spectrum_index":16363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 860.325 Da; putative annotation: N/A; putative formula: C59H44N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1082.42,"smiles":null,"spectrum_id":"CCMSLIB00017238174","spectrum_index":16364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 88.089 Da; putative annotation: N/A; putative formula: CH8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.16,"smiles":null,"spectrum_id":"CCMSLIB00017238176","spectrum_index":16365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 30.0094 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.107,"smiles":null,"spectrum_id":"CCMSLIB00017238178","spectrum_index":16366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 313.19 Da; putative annotation: N/A; putative formula: C17H23N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.261,"smiles":null,"spectrum_id":"CCMSLIB00017238180","spectrum_index":16367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 132.0423 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.144,"smiles":null,"spectrum_id":"CCMSLIB00017238183","spectrum_index":16368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 163.0377 Da; putative annotation: N/A; putative formula: C7H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.134,"smiles":null,"spectrum_id":"CCMSLIB00017238184","spectrum_index":16369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369605 Salicylic acid|2-hydroxybenzoic acid (delta mass: 59.0735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.113,"smiles":null,"spectrum_id":"CCMSLIB00017238186","spectrum_index":16370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-(2,3-dihydroxypropoxy)-9-oxononanoic acid (delta mass: 187.1209 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.27,"smiles":null,"spectrum_id":"CCMSLIB00017238188","spectrum_index":16371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 146.0575 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.128,"smiles":null,"spectrum_id":"CCMSLIB00017238190","spectrum_index":16372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 547.2824 Da; putative annotation: N/A; putative formula: C29H38N7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.353,"smiles":null,"spectrum_id":"CCMSLIB00017238192","spectrum_index":16373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 338.1895 Da; putative annotation: N/A; putative formula: C23H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.338,"smiles":null,"spectrum_id":"CCMSLIB00017238194","spectrum_index":16374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 352.2122 Da; putative annotation: N/A; putative formula: C18H24N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.361,"smiles":null,"spectrum_id":"CCMSLIB00017238196","spectrum_index":16375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 27.9035 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.979,"smiles":null,"spectrum_id":"CCMSLIB00017238199","spectrum_index":16376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 196.6199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.68,"smiles":null,"spectrum_id":"CCMSLIB00017238200","spectrum_index":16377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of rac-all-trans-4-Hydroxyretinal (delta mass: 92.062 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.278,"smiles":null,"spectrum_id":"CCMSLIB00017238203","spectrum_index":16378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 138.1042 Da; putative annotation: N/A; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.217,"smiles":null,"spectrum_id":"CCMSLIB00017238204","spectrum_index":16379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 197.2078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.249,"smiles":null,"spectrum_id":"CCMSLIB00017238206","spectrum_index":16380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 463.2642 Da; putative annotation: N/A; putative formula: C19H37N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":968.44,"smiles":null,"spectrum_id":"CCMSLIB00017238208","spectrum_index":16381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 49.0539 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.312,"smiles":null,"spectrum_id":"CCMSLIB00017238210","spectrum_index":16382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 59.0377 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.165,"smiles":null,"spectrum_id":"CCMSLIB00017238212","spectrum_index":16383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 118.0268 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.077,"smiles":null,"spectrum_id":"CCMSLIB00017238215","spectrum_index":16384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 294.247 Da; putative annotation: N/A; putative formula: C19H35P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.297,"smiles":null,"spectrum_id":"CCMSLIB00017238216","spectrum_index":16385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 134.0728 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.294,"smiles":null,"spectrum_id":"CCMSLIB00017238219","spectrum_index":16386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 242.148 Da; putative annotation: N/A; putative formula: C9H18N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.25,"smiles":null,"spectrum_id":"CCMSLIB00017238220","spectrum_index":16387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 239.1625 Da; putative annotation: N/A; putative formula: C12H21N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.223,"smiles":null,"spectrum_id":"CCMSLIB00017238223","spectrum_index":16388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 367.1468 Da; putative annotation: N/A; putative formula: C19H21N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.207,"smiles":null,"spectrum_id":"CCMSLIB00017238224","spectrum_index":16389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Deoxyprostaglandin E2 (delta mass: 49.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.29,"smiles":null,"spectrum_id":"CCMSLIB00017238227","spectrum_index":16390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 30.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.143,"smiles":null,"spectrum_id":"CCMSLIB00017238228","spectrum_index":16391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 326.133 Da; putative annotation: N/A; putative formula: C12H26N2O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.255,"smiles":null,"spectrum_id":"CCMSLIB00017238231","spectrum_index":16392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 236.1122 Da; putative annotation: N/A; putative formula: C7H16N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.24,"smiles":null,"spectrum_id":"CCMSLIB00017238232","spectrum_index":16393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 134.0377 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.113,"smiles":null,"spectrum_id":"CCMSLIB00017238235","spectrum_index":16394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 72.0394 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.287,"smiles":null,"spectrum_id":"CCMSLIB00017238236","spectrum_index":16395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 423.2172 Da; putative annotation: N/A; putative formula: C25H25N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.314,"smiles":null,"spectrum_id":"CCMSLIB00017238238","spectrum_index":16396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 202.052 Da; putative annotation: N/A; putative formula: C6H10N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.087,"smiles":null,"spectrum_id":"CCMSLIB00017238240","spectrum_index":16397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 144.0427 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.139,"smiles":null,"spectrum_id":"CCMSLIB00017238242","spectrum_index":16398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7,10-Tetraazacyclododecane (delta mass: 183.9539 Da; putative annotation: N/A; putative formula: H2N4O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.13,"smiles":null,"spectrum_id":"CCMSLIB00017238244","spectrum_index":16399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 9.9845 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017238247","spectrum_index":16400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 192.1198 Da; putative annotation: N/A; putative formula: C11H17N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.258,"smiles":null,"spectrum_id":"CCMSLIB00017238248","spectrum_index":16401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 38.0515 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017238251","spectrum_index":16402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Linolenic acid (delta mass: 35.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.269,"smiles":null,"spectrum_id":"CCMSLIB00017238252","spectrum_index":16403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU275701 Labetalol|2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide (delta mass: 460.2595 Da; putative annotation: N/A; putative formula: C26H42N2O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":789.445,"smiles":null,"spectrum_id":"CCMSLIB00017238255","spectrum_index":16404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpent-2-enoic acid (delta mass: 88.0161 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.092,"smiles":null,"spectrum_id":"CCMSLIB00017238256","spectrum_index":16405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenoxyethanol (delta mass: 232.1469 Da; putative annotation: N/A; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.222,"smiles":null,"spectrum_id":"CCMSLIB00017238259","spectrum_index":16406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 534.2166 Da; putative annotation: N/A; putative formula: C23H39N2O8PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.266,"smiles":null,"spectrum_id":"CCMSLIB00017238260","spectrum_index":16407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01041 Hexahydrocurcumin (delta mass: 167.0817 Da; putative annotation: N/A; putative formula: C6H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.262,"smiles":null,"spectrum_id":"CCMSLIB00017238263","spectrum_index":16408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 60.0576 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.128,"smiles":null,"spectrum_id":"CCMSLIB00017238264","spectrum_index":16409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 79.0627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.295,"smiles":null,"spectrum_id":"CCMSLIB00017238267","spectrum_index":16410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 53.0881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.185,"smiles":null,"spectrum_id":"CCMSLIB00017238268","spectrum_index":16411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 106.0058 Da; putative annotation: N/A; putative formula: C6H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017238271","spectrum_index":16412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 327.256 Da; putative annotation: N/A; putative formula: C22H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":920.77,"smiles":null,"spectrum_id":"CCMSLIB00017238272","spectrum_index":16413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 78.0885 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.175,"smiles":null,"spectrum_id":"CCMSLIB00017238275","spectrum_index":16414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 221.171 Da; putative annotation: N/A; putative formula: C14H24NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.326,"smiles":null,"spectrum_id":"CCMSLIB00017238276","spectrum_index":16415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenecarboxylic acid, 1,2,4a,5,6,7,8,8a-octahydro-2-(2-hydroxybutyl)-1,3-dimethyl-, [1R-[1.alpha.,2.beta.(R*),4a.alpha.,8a.alpha.]]- (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.263,"smiles":null,"spectrum_id":"CCMSLIB00017238278","spectrum_index":16416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Bisabolol (delta mass: 38.0506 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.256,"smiles":null,"spectrum_id":"CCMSLIB00017238280","spectrum_index":16417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 203.209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.275,"smiles":null,"spectrum_id":"CCMSLIB00017238282","spectrum_index":16418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 151.0766 Da; putative annotation: N/A; putative formula: C12H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.142,"smiles":null,"spectrum_id":"CCMSLIB00017238284","spectrum_index":16419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 5-Hydroxy-L-tryptophan from NIST14 (delta mass: 88.0159 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.108,"smiles":null,"spectrum_id":"CCMSLIB00017238287","spectrum_index":16420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 27.9938 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.221,"smiles":null,"spectrum_id":"CCMSLIB00017238288","spectrum_index":16421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.232,"smiles":null,"spectrum_id":"CCMSLIB00017238291","spectrum_index":16422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-7,12-Dihydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 48.0362 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.243,"smiles":null,"spectrum_id":"CCMSLIB00017238292","spectrum_index":16423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S,15S-Dihydroxy-5Z,9E,11Z,13E-eicosatetraenoic acid (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.264,"smiles":null,"spectrum_id":"CCMSLIB00017238295","spectrum_index":16424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid (delta mass: 9.948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.039,"smiles":null,"spectrum_id":"CCMSLIB00017238296","spectrum_index":16425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 111.9932 Da; putative annotation: N/A; putative formula: C2HN4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.117,"smiles":null,"spectrum_id":"CCMSLIB00017238299","spectrum_index":16426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Leu (delta mass: 474.3827 Da; putative annotation: N/A; putative formula: C29H50N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.537,"smiles":null,"spectrum_id":"CCMSLIB00017238300","spectrum_index":16427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 87.0697 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.156,"smiles":null,"spectrum_id":"CCMSLIB00017238302","spectrum_index":16428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-(3-Hydroxy-2,2,5a-trimethyl-7-methylidenedecahydro-1-benzoxepin-6-yl)ethyl)-2,2,5a,7-tetramethyldecahydro-1-benzoxepine-3,4,6-triol (delta mass: 124.068 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.452,"smiles":null,"spectrum_id":"CCMSLIB00017238304","spectrum_index":16429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 463.2937 Da; putative annotation: N/A; putative formula: C26H41NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":820.594,"smiles":null,"spectrum_id":"CCMSLIB00017238306","spectrum_index":16430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 92.0999 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.368,"smiles":null,"spectrum_id":"CCMSLIB00017238308","spectrum_index":16431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYPHENYLACETIC ACID (delta mass: 32.0627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017238311","spectrum_index":16432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 100.0161 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017238312","spectrum_index":16433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 58.0058 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.06,"smiles":null,"spectrum_id":"CCMSLIB00017238315","spectrum_index":16434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Peruvinine (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.17,"smiles":null,"spectrum_id":"CCMSLIB00017238316","spectrum_index":16435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 66.0833 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.149,"smiles":null,"spectrum_id":"CCMSLIB00017238319","spectrum_index":16436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(N-Methylacetamido)benzoic acid (delta mass: 125.0844 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.166,"smiles":null,"spectrum_id":"CCMSLIB00017238320","spectrum_index":16437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzenemethanol, .alpha.-[(1R)-1-(methylamino)butyl]-, (.alpha.S)-rel- (delta mass: 130.0415 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.195,"smiles":null,"spectrum_id":"CCMSLIB00017238322","spectrum_index":16438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 327.9721 Da; putative annotation: N/A; putative formula: C4H6N6O8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.011,"smiles":null,"spectrum_id":"CCMSLIB00017238324","spectrum_index":16439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-4-methylcoumarin (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.05,"smiles":null,"spectrum_id":"CCMSLIB00017238326","spectrum_index":16440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 176.0392 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.082,"smiles":null,"spectrum_id":"CCMSLIB00017238328","spectrum_index":16441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eicosapentaenoyl ethanolamide (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.285,"smiles":null,"spectrum_id":"CCMSLIB00017238330","spectrum_index":16442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,6,6-Tetramethyl-4-piperidinyl 2-methylacrylate (delta mass: 48.0032 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.183,"smiles":null,"spectrum_id":"CCMSLIB00017238332","spectrum_index":16443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 106.0769 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.314,"smiles":null,"spectrum_id":"CCMSLIB00017238334","spectrum_index":16444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381056-01_C22H33NO6_Valine, N-acetyl-, 1,3,5,5a,6,7,8,9,9a,9b-decahydro-9b-hydroxy-6,6,9a-trimethyl-3-oxonaphtho[1,2-c]furan-9-yl ester (delta mass: 105.02 Da; putative annotation: N/A; putative formula: C2H-1N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.258,"smiles":null,"spectrum_id":"CCMSLIB00017238336","spectrum_index":16445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 129.0427 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.145,"smiles":null,"spectrum_id":"CCMSLIB00017238339","spectrum_index":16446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 96.0938 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017238340","spectrum_index":16447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 18.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.139,"smiles":null,"spectrum_id":"CCMSLIB00017238343","spectrum_index":16448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 104.1016 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.346,"smiles":null,"spectrum_id":"CCMSLIB00017238344","spectrum_index":16449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 228.1113 Da; putative annotation: N/A; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.24,"smiles":null,"spectrum_id":"CCMSLIB00017238347","spectrum_index":16450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthro[3,2-b]furan-9(1H)-one, 2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro-6,10a-dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl- (delta mass: 122.1097 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.326,"smiles":null,"spectrum_id":"CCMSLIB00017238348","spectrum_index":16451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,8,11-Eicosatriynoic acid (delta mass: 53.0481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.264,"smiles":null,"spectrum_id":"CCMSLIB00017238351","spectrum_index":16452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C7:0 (delta mass: 154.1354 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.332,"smiles":null,"spectrum_id":"CCMSLIB00017238352","spectrum_index":16453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 146.1091 Da; putative annotation: N/A; putative formula: C11H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017238355","spectrum_index":16454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 106.0784 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017238356","spectrum_index":16455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labdanolic acid (delta mass: 70.0424 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.316,"smiles":null,"spectrum_id":"CCMSLIB00017238359","spectrum_index":16456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 98.0734 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.165,"smiles":null,"spectrum_id":"CCMSLIB00017238360","spectrum_index":16457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sphinganine (delta mass: 316.2646 Da; putative annotation: N/A; putative formula: C17H37N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.57,"smiles":null,"spectrum_id":"CCMSLIB00017238362","spectrum_index":16458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 93.0226 Da; putative annotation: N/A; putative formula: C5H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.167,"smiles":null,"spectrum_id":"CCMSLIB00017238364","spectrum_index":16459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.092,"smiles":null,"spectrum_id":"CCMSLIB00017238366","spectrum_index":16460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apigenin 6,8-di-glucopyranoside (delta mass: 120.0201 Da; putative annotation: N/A; putative formula: CH5N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.186,"smiles":null,"spectrum_id":"CCMSLIB00017238368","spectrum_index":16461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of lysergol (delta mass: 17.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.186,"smiles":null,"spectrum_id":"CCMSLIB00017238370","spectrum_index":16462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 481.8413 Da; putative annotation: N/A; putative formula: C15H6N4O-1S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.901,"smiles":null,"spectrum_id":"CCMSLIB00017238372","spectrum_index":16463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,3-DIAMINOPROPANE\"\" (delta mass: 38.0151 Da; putative annotation: N/A; putative formula: C3H2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":113.107,"smiles":null,"spectrum_id":"CCMSLIB00017238374","spectrum_index":16464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arachidonoyl amide (delta mass: 146.1154 Da; putative annotation: N/A; putative formula: CH10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.379,"smiles":null,"spectrum_id":"CCMSLIB00017238376","spectrum_index":16465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 39.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.144,"smiles":null,"spectrum_id":"CCMSLIB00017238378","spectrum_index":16466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 497.1141 Da; putative annotation: N/A; putative formula: C27H20N3O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.18,"smiles":null,"spectrum_id":"CCMSLIB00017238380","spectrum_index":16467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-5Z,8Z,11Z,13E,17Z-eicosapentaenoic acid (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.253,"smiles":null,"spectrum_id":"CCMSLIB00017238382","spectrum_index":16468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 117.1154 Da; putative annotation: N/A; putative formula: C2H11N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.332,"smiles":null,"spectrum_id":"CCMSLIB00017238384","spectrum_index":16469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 92.0476 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.28,"smiles":null,"spectrum_id":"CCMSLIB00017238386","spectrum_index":16470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid (delta mass: 100.0676 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.3,"smiles":null,"spectrum_id":"CCMSLIB00017238388","spectrum_index":16471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 182.0443 Da; putative annotation: N/A; putative formula: C6H6N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.12,"smiles":null,"spectrum_id":"CCMSLIB00017238391","spectrum_index":16472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 80.0625 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.102,"smiles":null,"spectrum_id":"CCMSLIB00017238394","spectrum_index":16473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2,6,6-Trimethyl-3-oxocyclohex-1-en-1-yl)butan-2-yl .beta.-D-glucopyranoside (delta mass: 144.0379 Da; putative annotation: N/A; putative formula: C5H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.26,"smiles":null,"spectrum_id":"CCMSLIB00017238395","spectrum_index":16474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-2-imidazoline (delta mass: 14.9483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.04,"smiles":null,"spectrum_id":"CCMSLIB00017238398","spectrum_index":16475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 195.199 Da; putative annotation: N/A; putative formula: C13H25N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.384,"smiles":null,"spectrum_id":"CCMSLIB00017238399","spectrum_index":16476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 46.0204 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.107,"smiles":null,"spectrum_id":"CCMSLIB00017238402","spectrum_index":16477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NEROLIDOL CollisionEnergy:205060 (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.242,"smiles":null,"spectrum_id":"CCMSLIB00017238403","spectrum_index":16478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 489.3452 Da; putative annotation: N/A; putative formula: C29H47NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.416,"smiles":null,"spectrum_id":"CCMSLIB00017238405","spectrum_index":16479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 201.0721 Da; putative annotation: N/A; putative formula: C11H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.158,"smiles":null,"spectrum_id":"CCMSLIB00017238407","spectrum_index":16480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 95.9991 Da; putative annotation: N/A; putative formula: C2HN4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.085,"smiles":null,"spectrum_id":"CCMSLIB00017238410","spectrum_index":16481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Digoxigenin (delta mass: 76.0349 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.283,"smiles":null,"spectrum_id":"CCMSLIB00017238411","spectrum_index":16482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 39.9929 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.262,"smiles":null,"spectrum_id":"CCMSLIB00017238414","spectrum_index":16483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxo-4-cholestenoic acid (delta mass: 18.9146 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.235,"smiles":null,"spectrum_id":"CCMSLIB00017238415","spectrum_index":16484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.alpha.-estrane-3.alpha.,17.beta.-diol (delta mass: 94.0785 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.342,"smiles":null,"spectrum_id":"CCMSLIB00017238418","spectrum_index":16485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 98.1807 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.251,"smiles":null,"spectrum_id":"CCMSLIB00017238419","spectrum_index":16486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylpiperazine (delta mass: 16.9789 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.102,"smiles":null,"spectrum_id":"CCMSLIB00017238422","spectrum_index":16487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 82.0417 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.112,"smiles":null,"spectrum_id":"CCMSLIB00017238423","spectrum_index":16488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.274,"smiles":null,"spectrum_id":"CCMSLIB00017238426","spectrum_index":16489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 95.0608 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017238427","spectrum_index":16490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 747.58 Da; putative annotation: N/A; putative formula: C48H77NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":968.77,"smiles":null,"spectrum_id":"CCMSLIB00017238430","spectrum_index":16491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Cycloisolongifol-5-ol (delta mass: 752.6074 Da; putative annotation: N/A; putative formula: C48H76N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.797,"smiles":null,"spectrum_id":"CCMSLIB00017238431","spectrum_index":16492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,3S)-3-hydroxy-1-octenyl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5E)- (delta mass: 495.2835 Da; putative annotation: N/A; putative formula: C29H42N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.536,"smiles":null,"spectrum_id":"CCMSLIB00017238433","spectrum_index":16493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017238435","spectrum_index":16494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 160.1623 Da; putative annotation: N/A; putative formula: C13H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.352,"smiles":null,"spectrum_id":"CCMSLIB00017238437","spectrum_index":16495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 1043.2421 Da; putative annotation: N/A; putative formula: C59H53N3O3S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1427.39,"smiles":null,"spectrum_id":"CCMSLIB00017238439","spectrum_index":16496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 69.0574 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.155,"smiles":null,"spectrum_id":"CCMSLIB00017238442","spectrum_index":16497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 126.0642 Da; putative annotation: N/A; putative formula: C3H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.129,"smiles":null,"spectrum_id":"CCMSLIB00017238443","spectrum_index":16498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 45.0427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.17,"smiles":null,"spectrum_id":"CCMSLIB00017238446","spectrum_index":16499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 67.0137 Da; putative annotation: N/A; putative formula: C2HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.1,"smiles":null,"spectrum_id":"CCMSLIB00017238447","spectrum_index":16500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 341.1254 Da; putative annotation: N/A; putative formula: C13H20N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.302,"smiles":null,"spectrum_id":"CCMSLIB00017238450","spectrum_index":16501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 179.0795 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.171,"smiles":null,"spectrum_id":"CCMSLIB00017238451","spectrum_index":16502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Di(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine (delta mass: 112.0669 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":948.589,"smiles":null,"spectrum_id":"CCMSLIB00017238454","spectrum_index":16503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 238.0476 Da; putative annotation: N/A; putative formula: C11H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.118,"smiles":null,"spectrum_id":"CCMSLIB00017238455","spectrum_index":16504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 255.2511 Da; putative annotation: N/A; putative formula: C12H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.613,"smiles":null,"spectrum_id":"CCMSLIB00017238458","spectrum_index":16505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 59.0117 Da; putative annotation: N/A; putative formula: HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.066,"smiles":null,"spectrum_id":"CCMSLIB00017238459","spectrum_index":16506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[17.3.2.0<1,18>.0<4,17>.0<5,14>.0< 8,13>]tetracosan-10-ol CollisionEnergy:102040\"\" (delta mass: 17.0236 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.412,"smiles":null,"spectrum_id":"CCMSLIB00017238462","spectrum_index":16507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 64.0676 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017238463","spectrum_index":16508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 413.171 Da; putative annotation: N/A; putative formula: C21H19N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.242,"smiles":null,"spectrum_id":"CCMSLIB00017238466","spectrum_index":16509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 204.183 Da; putative annotation: N/A; putative formula: C6H20N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.285,"smiles":null,"spectrum_id":"CCMSLIB00017238467","spectrum_index":16510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-.beta.,2,5,5,8a-pentamethyl-3-oxo-, (8aS)- (delta mass: 102.0876 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.33,"smiles":null,"spectrum_id":"CCMSLIB00017238470","spectrum_index":16511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dioxo-1-pyrrolidinyl)acetic acid (delta mass: 99.0474 Da; putative annotation: N/A; putative formula: C8H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.092,"smiles":null,"spectrum_id":"CCMSLIB00017238471","spectrum_index":16512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 102.0809 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.36,"smiles":null,"spectrum_id":"CCMSLIB00017238474","spectrum_index":16513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brassicasterol (delta mass: 28.9979 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.36,"smiles":null,"spectrum_id":"CCMSLIB00017238475","spectrum_index":16514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 794.4465 Da; putative annotation: N/A; putative formula: C43H62N4O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.517,"smiles":null,"spectrum_id":"CCMSLIB00017238478","spectrum_index":16515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 537.2114 Da; putative annotation: N/A; putative formula: C21H39N5O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.511,"smiles":null,"spectrum_id":"CCMSLIB00017238479","spectrum_index":16516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 44.9942 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.072,"smiles":null,"spectrum_id":"CCMSLIB00017238482","spectrum_index":16517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 160.0829 Da; putative annotation: N/A; putative formula: C2H8N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.196,"smiles":null,"spectrum_id":"CCMSLIB00017238483","spectrum_index":16518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Aminobenzoic acid (delta mass: 89.0265 Da; putative annotation: N/A; putative formula: C6H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.081,"smiles":null,"spectrum_id":"CCMSLIB00017238486","spectrum_index":16519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-3,4-dimethyl- (delta mass: 74.0589 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.265,"smiles":null,"spectrum_id":"CCMSLIB00017238487","spectrum_index":16520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 908.3386 Da; putative annotation: N/A; putative formula: C37H56N4O22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1130.44,"smiles":null,"spectrum_id":"CCMSLIB00017238490","spectrum_index":16521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-hydroxy-1-phenyl-5,6,7,8-tetrahydropyrrolizin-3-one (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.097,"smiles":null,"spectrum_id":"CCMSLIB00017238491","spectrum_index":16522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 73.0156 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.201,"smiles":null,"spectrum_id":"CCMSLIB00017238494","spectrum_index":16523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 359.1452 Da; putative annotation: N/A; putative formula: C14H17N9O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.43,"smiles":null,"spectrum_id":"CCMSLIB00017238495","spectrum_index":16524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyphenylacetic acid (delta mass: 7.99 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.045,"smiles":null,"spectrum_id":"CCMSLIB00017238498","spectrum_index":16525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 193.1058 Da; putative annotation: N/A; putative formula: C6H15N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.192,"smiles":null,"spectrum_id":"CCMSLIB00017238499","spectrum_index":16526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 93.9901 Da; putative annotation: N/A; putative formula: CH2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.123,"smiles":null,"spectrum_id":"CCMSLIB00017238501","spectrum_index":16527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 116.0592 Da; putative annotation: N/A; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.161,"smiles":null,"spectrum_id":"CCMSLIB00017238503","spectrum_index":16528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 632.7198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.833,"smiles":null,"spectrum_id":"CCMSLIB00017238505","spectrum_index":16529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 895.7284 Da; putative annotation: N/A; putative formula: C42H89N17O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1205.84,"smiles":null,"spectrum_id":"CCMSLIB00017238507","spectrum_index":16530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 124.0634 Da; putative annotation: N/A; putative formula: C6H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.431,"smiles":null,"spectrum_id":"CCMSLIB00017238510","spectrum_index":16531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-Binaphthyl-8,8'-dicarboxylic acid (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.107,"smiles":null,"spectrum_id":"CCMSLIB00017238511","spectrum_index":16532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 102.0835 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.284,"smiles":null,"spectrum_id":"CCMSLIB00017238514","spectrum_index":16533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 119.9875 Da; putative annotation: N/A; putative formula: C5HN2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.157,"smiles":null,"spectrum_id":"CCMSLIB00017238515","spectrum_index":16534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-proline (delta mass: 48.0127 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.099,"smiles":null,"spectrum_id":"CCMSLIB00017238518","spectrum_index":16535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 74.0733 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017238519","spectrum_index":16536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyquinuclidine-3-carbonitrile (delta mass: 78.0555 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.158,"smiles":null,"spectrum_id":"CCMSLIB00017238522","spectrum_index":16537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (25S)-7-Dafachronic acid (delta mass: 419.1625 Da; putative annotation: N/A; putative formula: C18H31NO6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.483,"smiles":null,"spectrum_id":"CCMSLIB00017238523","spectrum_index":16538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 104.0472 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017238526","spectrum_index":16539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 63.0471 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.185,"smiles":null,"spectrum_id":"CCMSLIB00017238527","spectrum_index":16540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 96.9338 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.025,"smiles":null,"spectrum_id":"CCMSLIB00017238530","spectrum_index":16541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 734.4242 Da; putative annotation: N/A; putative formula: C40H62O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.495,"smiles":null,"spectrum_id":"CCMSLIB00017238531","spectrum_index":16542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 286.0941 Da; putative annotation: N/A; putative formula: C9H15N6O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.233,"smiles":null,"spectrum_id":"CCMSLIB00017238533","spectrum_index":16543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 210.2342 Da; putative annotation: N/A; putative formula: C15H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.497,"smiles":null,"spectrum_id":"CCMSLIB00017238535","spectrum_index":16544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. ethylamide (delta mass: 322.1948 Da; putative annotation: N/A; putative formula: C15H26N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.49,"smiles":null,"spectrum_id":"CCMSLIB00017238538","spectrum_index":16545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-hydroxy-4Z,7Z,11E,13Z,16Z,19Z-docosahexaenoic acid (delta mass: 328.2576 Da; putative annotation: N/A; putative formula: C15H32N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.5,"smiles":null,"spectrum_id":"CCMSLIB00017238539","spectrum_index":16546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 739.4506 Da; putative annotation: N/A; putative formula: C37H53N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.511,"smiles":null,"spectrum_id":"CCMSLIB00017238541","spectrum_index":16547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 34.9681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.153,"smiles":null,"spectrum_id":"CCMSLIB00017238543","spectrum_index":16548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Quinolinecarboxamide, 1,4-dihydro-6-(1-methylethyl)-4-oxo-1-pentyl-N-tricyclo[3.3.1.1(3,7)]dec-1-yl- (delta mass: 106.0862 Da; putative annotation: N/A; putative formula: C7H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.387,"smiles":null,"spectrum_id":"CCMSLIB00017238545","spectrum_index":16549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 364.2817 Da; putative annotation: N/A; putative formula: C23H42O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.524,"smiles":null,"spectrum_id":"CCMSLIB00017238547","spectrum_index":16550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Hexadecanoyl-sn-glycerol from NIST14 (delta mass: 187.1212 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.406,"smiles":null,"spectrum_id":"CCMSLIB00017238550","spectrum_index":16551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-4-[(E)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 162.0525 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.201,"smiles":null,"spectrum_id":"CCMSLIB00017238551","spectrum_index":16552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.175,"smiles":null,"spectrum_id":"CCMSLIB00017238554","spectrum_index":16553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 86.0484 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.28,"smiles":null,"spectrum_id":"CCMSLIB00017238555","spectrum_index":16554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 1241.788 Da; putative annotation: N/A; putative formula: C64H107N9O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1379.88,"smiles":null,"spectrum_id":"CCMSLIB00017238558","spectrum_index":16555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 267.6215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.719,"smiles":null,"spectrum_id":"CCMSLIB00017238559","spectrum_index":16556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 67.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.28,"smiles":null,"spectrum_id":"CCMSLIB00017238562","spectrum_index":16557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 321.1335 Da; putative annotation: N/A; putative formula: C16H23N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.22,"smiles":null,"spectrum_id":"CCMSLIB00017238563","spectrum_index":16558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 97.0899 Da; putative annotation: N/A; putative formula: C6H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.243,"smiles":null,"spectrum_id":"CCMSLIB00017238566","spectrum_index":16559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoleoylglycine (delta mass: 60.0361 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.305,"smiles":null,"spectrum_id":"CCMSLIB00017238567","spectrum_index":16560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10-Nonadecenoic acid (delta mass: 147.0812 Da; putative annotation: N/A; putative formula: C6H14NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.36,"smiles":null,"spectrum_id":"CCMSLIB00017238570","spectrum_index":16561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 131.0947 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.3,"smiles":null,"spectrum_id":"CCMSLIB00017238571","spectrum_index":16562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 159.1256 Da; putative annotation: N/A; putative formula: C8H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.389,"smiles":null,"spectrum_id":"CCMSLIB00017238574","spectrum_index":16563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 122.1095 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.154,"smiles":null,"spectrum_id":"CCMSLIB00017238575","spectrum_index":16564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 309.1585 Da; putative annotation: N/A; putative formula: C17H27NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.234,"smiles":null,"spectrum_id":"CCMSLIB00017238578","spectrum_index":16565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 128.0989 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.331,"smiles":null,"spectrum_id":"CCMSLIB00017238579","spectrum_index":16566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 158.1099 Da; putative annotation: N/A; putative formula: C12H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017238582","spectrum_index":16567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7,10-Tetraazacyclododecane (delta mass: 84.9601 Da; putative annotation: N/A; putative formula: C2H-1NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.136,"smiles":null,"spectrum_id":"CCMSLIB00017238583","spectrum_index":16568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 254.1877 Da; putative annotation: N/A; putative formula: C15H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.316,"smiles":null,"spectrum_id":"CCMSLIB00017238585","spectrum_index":16569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 167.0645 Da; putative annotation: N/A; putative formula: C2H9N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.151,"smiles":null,"spectrum_id":"CCMSLIB00017238587","spectrum_index":16570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 49.9785 Da; putative annotation: N/A; putative formula: C3H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.071,"smiles":null,"spectrum_id":"CCMSLIB00017238588","spectrum_index":16571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017238591","spectrum_index":16572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 121.064 Da; putative annotation: N/A; putative formula: C6H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.124,"smiles":null,"spectrum_id":"CCMSLIB00017238592","spectrum_index":16573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 58.0319 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.103,"smiles":null,"spectrum_id":"CCMSLIB00017238595","spectrum_index":16574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1H-Indole-4-carboxaldehyde from NIST14 (delta mass: 86.0151 Da; putative annotation: N/A; putative formula: CH3N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.075,"smiles":null,"spectrum_id":"CCMSLIB00017238598","spectrum_index":16575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 202.1243 Da; putative annotation: N/A; putative formula: C9H19N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.263,"smiles":null,"spectrum_id":"CCMSLIB00017238599","spectrum_index":16576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of sinomenine (delta mass: 112.124 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.294,"smiles":null,"spectrum_id":"CCMSLIB00017238602","spectrum_index":16577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maprotiline (delta mass: 232.085 Da; putative annotation: N/A; putative formula: C12H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.275,"smiles":null,"spectrum_id":"CCMSLIB00017238603","spectrum_index":16578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 256.1382 Da; putative annotation: N/A; putative formula: C17H21P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.193,"smiles":null,"spectrum_id":"CCMSLIB00017238606","spectrum_index":16579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 246.133 Da; putative annotation: N/A; putative formula: C9H18N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.235,"smiles":null,"spectrum_id":"CCMSLIB00017238607","spectrum_index":16580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 84.0341 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.084,"smiles":null,"spectrum_id":"CCMSLIB00017238610","spectrum_index":16581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 151.1209 Da; putative annotation: N/A; putative formula: C7H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.311,"smiles":null,"spectrum_id":"CCMSLIB00017238611","spectrum_index":16582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 147.0569 Da; putative annotation: N/A; putative formula: C4H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017238613","spectrum_index":16583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385097-01_C20H22O9_beta-D-Glucopyranoside, 4-hydroxy-2-(hydroxymethyl)phenyl, 6-benzoate (delta mass: 213.9863 Da; putative annotation: N/A; putative formula: C6H2N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.12,"smiles":null,"spectrum_id":"CCMSLIB00017238615","spectrum_index":16584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.269,"smiles":null,"spectrum_id":"CCMSLIB00017238617","spectrum_index":16585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 81.0793 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.348,"smiles":null,"spectrum_id":"CCMSLIB00017238619","spectrum_index":16586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 188.104 Da; putative annotation: N/A; putative formula: C9H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.18,"smiles":null,"spectrum_id":"CCMSLIB00017238621","spectrum_index":16587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,3S)-3-hydroxy-1-octenyl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5E)- (delta mass: 513.2941 Da; putative annotation: N/A; putative formula: C26H43NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.547,"smiles":null,"spectrum_id":"CCMSLIB00017238623","spectrum_index":16588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 26.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.123,"smiles":null,"spectrum_id":"CCMSLIB00017238626","spectrum_index":16589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.185,"smiles":null,"spectrum_id":"CCMSLIB00017238627","spectrum_index":16590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 217.0344 Da; putative annotation: N/A; putative formula: C7H11N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.105,"smiles":null,"spectrum_id":"CCMSLIB00017238630","spectrum_index":16591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Misoprostol (delta mass: 78.0827 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.362,"smiles":null,"spectrum_id":"CCMSLIB00017238631","spectrum_index":16592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 106.0778 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.362,"smiles":null,"spectrum_id":"CCMSLIB00017238633","spectrum_index":16593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 120.0938 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.191,"smiles":null,"spectrum_id":"CCMSLIB00017238636","spectrum_index":16594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 155.0583 Da; putative annotation: N/A; putative formula: C7H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.108,"smiles":null,"spectrum_id":"CCMSLIB00017238638","spectrum_index":16595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 8.9917 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.031,"smiles":null,"spectrum_id":"CCMSLIB00017238640","spectrum_index":16596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-amino-4-methylbenzoate (delta mass: 14.9993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.086,"smiles":null,"spectrum_id":"CCMSLIB00017238642","spectrum_index":16597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 126.0467 Da; putative annotation: N/A; putative formula: C10H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.122,"smiles":null,"spectrum_id":"CCMSLIB00017238644","spectrum_index":16598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 44.0264 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017238646","spectrum_index":16599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 116.9165 Da; putative annotation: N/A; putative formula: C2H-1NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.164,"smiles":null,"spectrum_id":"CCMSLIB00017238648","spectrum_index":16600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 271.1886 Da; putative annotation: N/A; putative formula: C15H30NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.264,"smiles":null,"spectrum_id":"CCMSLIB00017238650","spectrum_index":16601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 315.2776 Da; putative annotation: N/A; putative formula: C18H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.52,"smiles":null,"spectrum_id":"CCMSLIB00017238652","spectrum_index":16602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylnorfentanyl (delta mass: 45.0214 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.171,"smiles":null,"spectrum_id":"CCMSLIB00017238655","spectrum_index":16603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heptadecasphinganine (delta mass: 63.9137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.203,"smiles":null,"spectrum_id":"CCMSLIB00017238657","spectrum_index":16604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Debromohymenialdisine (delta mass: 382.9005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.999,"smiles":null,"spectrum_id":"CCMSLIB00017238659","spectrum_index":16605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 29.0352 Da; putative annotation: N/A; putative formula: H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.257,"smiles":null,"spectrum_id":"CCMSLIB00017238661","spectrum_index":16606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cori ester (alpha-anomer) - 30.0 eV (delta mass: 117.0789 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.116,"smiles":null,"spectrum_id":"CCMSLIB00017238663","spectrum_index":16607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 174.1175 Da; putative annotation: N/A; putative formula: C9H19OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.246,"smiles":null,"spectrum_id":"CCMSLIB00017238665","spectrum_index":16608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.05,"smiles":null,"spectrum_id":"CCMSLIB00017238667","spectrum_index":16609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tryptamine-C7:0 (delta mass: 277.2027 Da; putative annotation: N/A; putative formula: C11H28N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.399,"smiles":null,"spectrum_id":"CCMSLIB00017238669","spectrum_index":16610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 238.2291 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.282,"smiles":null,"spectrum_id":"CCMSLIB00017238671","spectrum_index":16611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.-ol-17-one (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.227,"smiles":null,"spectrum_id":"CCMSLIB00017238673","spectrum_index":16612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coumaroyl putrescin (delta mass: 162.0322 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.176,"smiles":null,"spectrum_id":"CCMSLIB00017238675","spectrum_index":16613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-carboxypropanoylamino)-3-methylpentanoic acid CollisionEnergy:102040 (delta mass: 94.053 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.171,"smiles":null,"spectrum_id":"CCMSLIB00017238677","spectrum_index":16614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Naphthyl)-1H-indole (delta mass: 119.0291 Da; putative annotation: N/A; putative formula: C7H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.141,"smiles":null,"spectrum_id":"CCMSLIB00017238679","spectrum_index":16615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-GalNAc CollisionEnergy:102040 (delta mass: 70.0411 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.138,"smiles":null,"spectrum_id":"CCMSLIB00017238681","spectrum_index":16616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 60.0318 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.139,"smiles":null,"spectrum_id":"CCMSLIB00017238683","spectrum_index":16617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 45.023 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.125,"smiles":null,"spectrum_id":"CCMSLIB00017238685","spectrum_index":16618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 132.0936 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.326,"smiles":null,"spectrum_id":"CCMSLIB00017238687","spectrum_index":16619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 109.0201 Da; putative annotation: N/A; putative formula: C4H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.091,"smiles":null,"spectrum_id":"CCMSLIB00017238689","spectrum_index":16620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 190.1723 Da; putative annotation: 1-Ethynylcyclododecanol; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017238692","spectrum_index":16621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 236.2146 Da; putative annotation: (2R)-1-(2-Hydroxyethyl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.431,"smiles":null,"spectrum_id":"CCMSLIB00017238693","spectrum_index":16622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydroxy-12Z-octadecenoic acid (delta mass: 296.2361 Da; putative annotation: NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.489,"smiles":null,"spectrum_id":"CCMSLIB00017238696","spectrum_index":16623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5,9-trihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one (delta mass: 132.0939 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.248,"smiles":null,"spectrum_id":"CCMSLIB00017238697","spectrum_index":16624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 310.2142 Da; putative annotation: (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.425,"smiles":null,"spectrum_id":"CCMSLIB00017238700","spectrum_index":16625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 372.2118 Da; putative annotation: (2R,3R,4S,5S,6R)-2-[6-hydroxy-3-[(E)-3-hydroxybut-1-enyl]-2,4,4-trimethylcyclohexyl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; putative formula: C19H32O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.433,"smiles":null,"spectrum_id":"CCMSLIB00017238701","spectrum_index":16626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 220.1807 Da; putative annotation: [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.35,"smiles":null,"spectrum_id":"CCMSLIB00017238704","spectrum_index":16627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 295.2509 Da; putative annotation: N-Palmitoylglycine; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.488,"smiles":null,"spectrum_id":"CCMSLIB00017238705","spectrum_index":16628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 118.0417 Da; putative annotation: 4-Methylbenzoic acid; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.112,"smiles":null,"spectrum_id":"CCMSLIB00017238708","spectrum_index":16629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of Palitantin (delta mass: 150.0692 Da; putative annotation: \"\"2,6-Dimethoxy-4-methylphenol CollisionEnergy:205060\"\"; putative formula: C9H10O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.228,"smiles":null,"spectrum_id":"CCMSLIB00017238709","spectrum_index":16630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 206.0584 Da; putative annotation: (4-Acetyl-2-methoxyphenoxy)acetic acid; putative formula: C11H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.123,"smiles":null,"spectrum_id":"CCMSLIB00017238712","spectrum_index":16631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 234.1627 Da; putative annotation: Walleminone; putative formula: C15H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.291,"smiles":null,"spectrum_id":"CCMSLIB00017238713","spectrum_index":16632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Retinol (delta mass: 268.1844 Da; putative annotation: 4,6-Androstadien-17.beta.-ol-3-one; putative formula: C19H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.421,"smiles":null,"spectrum_id":"CCMSLIB00017238715","spectrum_index":16633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Citronellol (delta mass: 113.0477 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.206,"smiles":null,"spectrum_id":"CCMSLIB00017238717","spectrum_index":16634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,19-Trihydroxy-3,25-epoxyurs-12-en-28-oic acid (delta mass: 51.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.368,"smiles":null,"spectrum_id":"CCMSLIB00017238719","spectrum_index":16635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aspochalasin T (delta mass: 152.1049 Da; putative annotation: N/A; putative formula: C7H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.364,"smiles":null,"spectrum_id":"CCMSLIB00017238721","spectrum_index":16636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 202.1202 Da; putative annotation: N/A; putative formula: C10H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.186,"smiles":null,"spectrum_id":"CCMSLIB00017238723","spectrum_index":16637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 129.1051 Da; putative annotation: N/A; putative formula: C7H16NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.181,"smiles":null,"spectrum_id":"CCMSLIB00017238725","spectrum_index":16638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 36.0369 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.113,"smiles":null,"spectrum_id":"CCMSLIB00017238728","spectrum_index":16639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 188.0854 Da; putative annotation: N/A; putative formula: C5H12N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.14,"smiles":null,"spectrum_id":"CCMSLIB00017238729","spectrum_index":16640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Arg from NIST14 (delta mass: 100.0172 Da; putative annotation: N/A; putative formula: C5N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.22,"smiles":null,"spectrum_id":"CCMSLIB00017238732","spectrum_index":16641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thymol (delta mass: 192.1369 Da; putative annotation: N/A; putative formula: C10H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.249,"smiles":null,"spectrum_id":"CCMSLIB00017238733","spectrum_index":16642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 168.1514 Da; putative annotation: N/A; putative formula: C11H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.217,"smiles":null,"spectrum_id":"CCMSLIB00017238736","spectrum_index":16643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,18.Xi.)-3-Oxolup-20(29)-ene-27,28-dioic acid (delta mass: 94.0783 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.404,"smiles":null,"spectrum_id":"CCMSLIB00017238737","spectrum_index":16644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Di-.gamma.-linolenin (6c,9c,12c) from NIST14 (delta mass: 156.1358 Da; putative annotation: N/A; putative formula: C7H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.619,"smiles":null,"spectrum_id":"CCMSLIB00017238740","spectrum_index":16645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 298.2527 Da; putative annotation: N/A; putative formula: C19H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.49,"smiles":null,"spectrum_id":"CCMSLIB00017238741","spectrum_index":16646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 297.1942 Da; putative annotation: N/A; putative formula: C16H27NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.364,"smiles":null,"spectrum_id":"CCMSLIB00017238744","spectrum_index":16647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 116.0621 Da; putative annotation: N/A; putative formula: C3H9N4O-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017238745","spectrum_index":16648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 143.024 Da; putative annotation: N/A; putative formula: C6HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.162,"smiles":null,"spectrum_id":"CCMSLIB00017238746","spectrum_index":16649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 76.0675 Da; putative annotation: N/A; putative formula: C7H8O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017238749","spectrum_index":16650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phorbol O-Acetyl O-Tiglyl (delta mass: 505.2676 Da; putative annotation: N/A; putative formula: C27H39NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":994.516,"smiles":null,"spectrum_id":"CCMSLIB00017238750","spectrum_index":16651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 50.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.284,"smiles":null,"spectrum_id":"CCMSLIB00017238753","spectrum_index":16652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 259.2054 Da; putative annotation: N/A; putative formula: C16H25N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.589,"smiles":null,"spectrum_id":"CCMSLIB00017238754","spectrum_index":16653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 195.1976 Da; putative annotation: N/A; putative formula: C13H25N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.336,"smiles":null,"spectrum_id":"CCMSLIB00017238757","spectrum_index":16654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304315 Soyasaponin Ba (delta mass: 162.0517 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1121.57,"smiles":null,"spectrum_id":"CCMSLIB00017238758","spectrum_index":16655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decanoyl-carnitine; AIF; CE30; MS2Dec (delta mass: 84.0196 Da; putative annotation: N/A; putative formula: N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.268,"smiles":null,"spectrum_id":"CCMSLIB00017238761","spectrum_index":16656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 114.0321 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.139,"smiles":null,"spectrum_id":"CCMSLIB00017238762","spectrum_index":16657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 41.0505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.142,"smiles":null,"spectrum_id":"CCMSLIB00017238765","spectrum_index":16658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 202.0851 Da; putative annotation: N/A; putative formula: C10H18S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.333,"smiles":null,"spectrum_id":"CCMSLIB00017238766","spectrum_index":16659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Beauvericin_J_60777_dereplictor_pv_5.25366e-12 (delta mass: 17.0285 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":817.44,"smiles":null,"spectrum_id":"CCMSLIB00017238769","spectrum_index":16660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-hydroxy-3,6,9-trimethylidene-2-oxo-dodecahydroazuleno[4,5-b]furan-4-yl 2-(hydroxymethyl)prop-2-enoate (delta mass: 154.0696 Da; putative annotation: N/A; putative formula: C6H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.219,"smiles":null,"spectrum_id":"CCMSLIB00017238770","spectrum_index":16661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gitoxigenin CollisionEnergy:205060 (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.264,"smiles":null,"spectrum_id":"CCMSLIB00017238772","spectrum_index":16662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 18.9894 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":123.06,"smiles":null,"spectrum_id":"CCMSLIB00017238774","spectrum_index":16663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dehydrodocosahexaenoic acid (delta mass: 32.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017238776","spectrum_index":16664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cycloheximide CollisionEnergy:102040 (delta mass: 59.9852 Da; putative annotation: N/A; putative formula: CO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.155,"smiles":null,"spectrum_id":"CCMSLIB00017238778","spectrum_index":16665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 218.1155 Da; putative annotation: N/A; putative formula: C10H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.186,"smiles":null,"spectrum_id":"CCMSLIB00017238780","spectrum_index":16666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-cis-Retinol (delta mass: 76.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.289,"smiles":null,"spectrum_id":"CCMSLIB00017238782","spectrum_index":16667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-(2-hydroxyethyl)acetophenone (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017238785","spectrum_index":16668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 7-fluoro-3-methyl-1H-indole-2-carboxylate (delta mass: 151.0398 Da; putative annotation: N/A; putative formula: C4H10NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.117,"smiles":null,"spectrum_id":"CCMSLIB00017238786","spectrum_index":16669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monolaurin (delta mass: 273.2319 Da; putative annotation: N/A; putative formula: C16H27N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.454,"smiles":null,"spectrum_id":"CCMSLIB00017238789","spectrum_index":16670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 299.1234 Da; putative annotation: N/A; putative formula: C13H24N3O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.293,"smiles":null,"spectrum_id":"CCMSLIB00017238790","spectrum_index":16671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 537.2597 Da; putative annotation: N/A; putative formula: C29H39N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.533,"smiles":null,"spectrum_id":"CCMSLIB00017238793","spectrum_index":16672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desferrioxamine H (delta mass: 200.1163 Da; putative annotation: N/A; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.377,"smiles":null,"spectrum_id":"CCMSLIB00017238794","spectrum_index":16673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[N-(2-indol-3-ylethyl)carbamoyl]propanoic acid CollisionEnergy:102040 (delta mass: 68.0615 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.185,"smiles":null,"spectrum_id":"CCMSLIB00017238797","spectrum_index":16674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 48.0463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.139,"smiles":null,"spectrum_id":"CCMSLIB00017238798","spectrum_index":16675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Methoxy-5H-dibenzo[b,f]azepine (delta mass: 124.0894 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.196,"smiles":null,"spectrum_id":"CCMSLIB00017238801","spectrum_index":16676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 119.0583 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.201,"smiles":null,"spectrum_id":"CCMSLIB00017238802","spectrum_index":16677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 133.1465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.222,"smiles":null,"spectrum_id":"CCMSLIB00017238805","spectrum_index":16678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-oleoyl-sn-glycerol (delta mass: 108.994 Da; putative annotation: N/A; putative formula: C2N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.524,"smiles":null,"spectrum_id":"CCMSLIB00017238806","spectrum_index":16679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperazineethanol (delta mass: 27.7921 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.91,"smiles":null,"spectrum_id":"CCMSLIB00017238809","spectrum_index":16680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 129.1123 Da; putative annotation: N/A; putative formula: C3H11N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.24,"smiles":null,"spectrum_id":"CCMSLIB00017238810","spectrum_index":16681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 375.19 Da; putative annotation: N/A; putative formula: C18H33NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.25,"smiles":null,"spectrum_id":"CCMSLIB00017238813","spectrum_index":16682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 130.0776 Da; putative annotation: N/A; putative formula: C4H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.299,"smiles":null,"spectrum_id":"CCMSLIB00017238814","spectrum_index":16683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 296.2826 Da; putative annotation: N/A; putative formula: C18H36N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.541,"smiles":null,"spectrum_id":"CCMSLIB00017238817","spectrum_index":16684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 144.0426 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.28,"smiles":null,"spectrum_id":"CCMSLIB00017238820","spectrum_index":16685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (4R,4aS,10R,13aR)-14-hydroxy-4,13a-dimethyl-9,13-dioxo-2,3,4,4a,5,6,9,10,11,12,13,13a-dodecahydro-1H-7,10-methanobenzo[11]annulene-4-carboxylate (delta mass: 204.1244 Da; putative annotation: N/A; putative formula: C12H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.325,"smiles":null,"spectrum_id":"CCMSLIB00017238821","spectrum_index":16686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 191.1754 Da; putative annotation: N/A; putative formula: C12H21N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.365,"smiles":null,"spectrum_id":"CCMSLIB00017238824","spectrum_index":16687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 120.055 Da; putative annotation: N/A; putative formula: C4H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.109,"smiles":null,"spectrum_id":"CCMSLIB00017238825","spectrum_index":16688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Morpholin-4-ylsulfonyl)piperidine-4-carboxylic acid (delta mass: 64.0172 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.118,"smiles":null,"spectrum_id":"CCMSLIB00017238828","spectrum_index":16689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 182.1634 Da; putative annotation: N/A; putative formula: C8H18N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.222,"smiles":null,"spectrum_id":"CCMSLIB00017238829","spectrum_index":16690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E,12Z)-N-(2-methylpropyl)octadeca-2,4,12-trienamide (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.321,"smiles":null,"spectrum_id":"CCMSLIB00017238832","spectrum_index":16691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.258,"smiles":null,"spectrum_id":"CCMSLIB00017238833","spectrum_index":16692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 167.896 Da; putative annotation: N/A; putative formula: C2HOPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.956,"smiles":null,"spectrum_id":"CCMSLIB00017238836","spectrum_index":16693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 806.4381 Da; putative annotation: N/A; putative formula: C47H54N10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1261.79,"smiles":null,"spectrum_id":"CCMSLIB00017238837","spectrum_index":16694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 153.1507 Da; putative annotation: N/A; putative formula: C10H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.216,"smiles":null,"spectrum_id":"CCMSLIB00017238840","spectrum_index":16695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 81.0944 Da; putative annotation: N/A; putative formula: C6H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.337,"smiles":null,"spectrum_id":"CCMSLIB00017238841","spectrum_index":16696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-cis-Retinol (delta mass: 295.2231 Da; putative annotation: N/A; putative formula: C12H25N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.46,"smiles":null,"spectrum_id":"CCMSLIB00017238844","spectrum_index":16697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthosine (delta mass: 294.088 Da; putative annotation: N/A; putative formula: C12H15N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.171,"smiles":null,"spectrum_id":"CCMSLIB00017238847","spectrum_index":16698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 58.0531 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.124,"smiles":null,"spectrum_id":"CCMSLIB00017238848","spectrum_index":16699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 387.1981 Da; putative annotation: N/A; putative formula: C21H29N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.239,"smiles":null,"spectrum_id":"CCMSLIB00017238851","spectrum_index":16700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 422.2666 Da; putative annotation: N/A; putative formula: C24H38O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.327,"smiles":null,"spectrum_id":"CCMSLIB00017238852","spectrum_index":16701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 560.2102 Da; putative annotation: N/A; putative formula: C31H36N4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.291,"smiles":null,"spectrum_id":"CCMSLIB00017238855","spectrum_index":16702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 114.0432 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.24,"smiles":null,"spectrum_id":"CCMSLIB00017238856","spectrum_index":16703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 384.2987 Da; putative annotation: N/A; putative formula: C21H40N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.359,"smiles":null,"spectrum_id":"CCMSLIB00017238859","spectrum_index":16704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 41.0632 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017238860","spectrum_index":16705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 129.0427 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.235,"smiles":null,"spectrum_id":"CCMSLIB00017238863","spectrum_index":16706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 70.0417 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.289,"smiles":null,"spectrum_id":"CCMSLIB00017238864","spectrum_index":16707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11,14-Eicosadienoic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.289,"smiles":null,"spectrum_id":"CCMSLIB00017238867","spectrum_index":16708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of n-[2-(4-sec-butyl-phenoxy)-4,5-dihydroxy-6-hydroxymethyl-tetrahydro-pyran-3-yl]-acetamide (delta mass: 167.055 Da; putative annotation: N/A; putative formula: C4H5N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.246,"smiles":null,"spectrum_id":"CCMSLIB00017238868","spectrum_index":16709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 93.0427 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.254,"smiles":null,"spectrum_id":"CCMSLIB00017238871","spectrum_index":16710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 472.0836 Da; putative annotation: N/A; putative formula: C24H24O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.143,"smiles":null,"spectrum_id":"CCMSLIB00017238872","spectrum_index":16711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 29.9925 Da; putative annotation: N/A; putative formula: CH2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.048,"smiles":null,"spectrum_id":"CCMSLIB00017238875","spectrum_index":16712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 256.2031 Da; putative annotation: N/A; putative formula: C15H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.404,"smiles":null,"spectrum_id":"CCMSLIB00017238876","spectrum_index":16713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 45.0213 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017238879","spectrum_index":16714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 162.0427 Da; putative annotation: N/A; putative formula: C8H6N2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.134,"smiles":null,"spectrum_id":"CCMSLIB00017238880","spectrum_index":16715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE0; CorrDec (delta mass: 163.1007 Da; putative annotation: N/A; putative formula: C10H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.176,"smiles":null,"spectrum_id":"CCMSLIB00017238883","spectrum_index":16716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swietenocoumarin H (delta mass: 33.0239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.12,"smiles":null,"spectrum_id":"CCMSLIB00017238884","spectrum_index":16717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 126.0312 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017238887","spectrum_index":16718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 162.0306 Da; putative annotation: N/A; putative formula: C3H7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.101,"smiles":null,"spectrum_id":"CCMSLIB00017238889","spectrum_index":16719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.108,"smiles":null,"spectrum_id":"CCMSLIB00017238891","spectrum_index":16720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxy-2-decenoic acid (delta mass: 34.0205 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017238893","spectrum_index":16721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 263.173 Da; putative annotation: N/A; putative formula: C12H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.244,"smiles":null,"spectrum_id":"CCMSLIB00017238895","spectrum_index":16722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16.beta.-Hydroxyfurazabol (delta mass: 60.0448 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.278,"smiles":null,"spectrum_id":"CCMSLIB00017238897","spectrum_index":16723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 36.0363 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.195,"smiles":null,"spectrum_id":"CCMSLIB00017238899","spectrum_index":16724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,9-Dihydroxy-5Z,11Z,14Z-eicosatrienoic acid (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.264,"smiles":null,"spectrum_id":"CCMSLIB00017238901","spectrum_index":16725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 164.1953 Da; putative annotation: N/A; putative formula: C13H24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.375,"smiles":null,"spectrum_id":"CCMSLIB00017238903","spectrum_index":16726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 299.2815 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.588,"smiles":null,"spectrum_id":"CCMSLIB00017238904","spectrum_index":16727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 509.246 Da; putative annotation: N/A; putative formula: C27H35N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.317,"smiles":null,"spectrum_id":"CCMSLIB00017238907","spectrum_index":16728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 385.2817 Da; putative annotation: N/A; putative formula: C21H39NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.519,"smiles":null,"spectrum_id":"CCMSLIB00017238908","spectrum_index":16729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 197.0709 Da; putative annotation: N/A; putative formula: C10H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.235,"smiles":null,"spectrum_id":"CCMSLIB00017238911","spectrum_index":16730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ginsenoside F1 (delta mass: 100.0671 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.514,"smiles":null,"spectrum_id":"CCMSLIB00017238912","spectrum_index":16731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 214.0592 Da; putative annotation: N/A; putative formula: C8H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.151,"smiles":null,"spectrum_id":"CCMSLIB00017238915","spectrum_index":16732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110001 Salbutamol|Albuterol|4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol (delta mass: 31.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.196,"smiles":null,"spectrum_id":"CCMSLIB00017238916","spectrum_index":16733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 179.0799 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.239,"smiles":null,"spectrum_id":"CCMSLIB00017238919","spectrum_index":16734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 58.0559 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.153,"smiles":null,"spectrum_id":"CCMSLIB00017238920","spectrum_index":16735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desoxypipradrol (delta mass: 557.2242 Da; putative annotation: N/A; putative formula: C26H35N7O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":809.399,"smiles":null,"spectrum_id":"CCMSLIB00017238923","spectrum_index":16736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 199.1368 Da; putative annotation: N/A; putative formula: C14H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.391,"smiles":null,"spectrum_id":"CCMSLIB00017238924","spectrum_index":16737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 18.0299 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.133,"smiles":null,"spectrum_id":"CCMSLIB00017238927","spectrum_index":16738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 66.1058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.192,"smiles":null,"spectrum_id":"CCMSLIB00017238928","spectrum_index":16739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 453.2588 Da; putative annotation: N/A; putative formula: C21H35N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.319,"smiles":null,"spectrum_id":"CCMSLIB00017238931","spectrum_index":16740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 14.9827 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.033,"smiles":null,"spectrum_id":"CCMSLIB00017238932","spectrum_index":16741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 19.0138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.105,"smiles":null,"spectrum_id":"CCMSLIB00017238935","spectrum_index":16742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA001061 Anabasine (delta mass: 119.0218 Da; putative annotation: N/A; putative formula: C3H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.145,"smiles":null,"spectrum_id":"CCMSLIB00017238936","spectrum_index":16743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 141.0426 Da; putative annotation: N/A; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.181,"smiles":null,"spectrum_id":"CCMSLIB00017238939","spectrum_index":16744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 300.1942 Da; putative annotation: N/A; putative formula: C17H32S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.254,"smiles":null,"spectrum_id":"CCMSLIB00017238940","spectrum_index":16745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA001061 Anabasine (delta mass: 132.0047 Da; putative annotation: N/A; putative formula: C4H4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.128,"smiles":null,"spectrum_id":"CCMSLIB00017238943","spectrum_index":16746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 92.0471 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.18,"smiles":null,"spectrum_id":"CCMSLIB00017238944","spectrum_index":16747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 354.0749 Da; putative annotation: N/A; putative formula: C20H18O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.135,"smiles":null,"spectrum_id":"CCMSLIB00017238947","spectrum_index":16748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1018.2028 Da; putative annotation: N/A; putative formula: C48H42O25)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1240.3,"smiles":null,"spectrum_id":"CCMSLIB00017238948","spectrum_index":16749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 928.4912 Da; putative annotation: N/A; putative formula: C38H68N14O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1109.56,"smiles":null,"spectrum_id":"CCMSLIB00017238951","spectrum_index":16750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017238952","spectrum_index":16751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 359.2322 Da; putative annotation: N/A; putative formula: C19H29N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.464,"smiles":null,"spectrum_id":"CCMSLIB00017238954","spectrum_index":16752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 574.5154 Da; putative annotation: N/A; putative formula: C31H62N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.758,"smiles":null,"spectrum_id":"CCMSLIB00017238956","spectrum_index":16753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desoxypipradrol (delta mass: 126.0885 Da; putative annotation: N/A; putative formula: C8H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.263,"smiles":null,"spectrum_id":"CCMSLIB00017238957","spectrum_index":16754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luzindole (delta mass: 60.0691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.234,"smiles":null,"spectrum_id":"CCMSLIB00017238960","spectrum_index":16755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 90.0739 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.15,"smiles":null,"spectrum_id":"CCMSLIB00017238962","spectrum_index":16756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-(3-Hydroxy-2,3-dimethyl-2-bicyclo[2.2.1]heptanyl)-2-methylpent-2-enoic acid (delta mass: 48.0343 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.214,"smiles":null,"spectrum_id":"CCMSLIB00017238964","spectrum_index":16757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-cis-Retinoic acid (delta mass: 166.0996 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.316,"smiles":null,"spectrum_id":"CCMSLIB00017238966","spectrum_index":16758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 207.9737 Da; putative annotation: N/A; putative formula: C4N8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.065,"smiles":null,"spectrum_id":"CCMSLIB00017238968","spectrum_index":16759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 106.0414 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.289,"smiles":null,"spectrum_id":"CCMSLIB00017238971","spectrum_index":16760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 618.462 Da; putative annotation: N/A; putative formula: C37H58N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":917.72,"smiles":null,"spectrum_id":"CCMSLIB00017238972","spectrum_index":16761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 150.0834 Da; putative annotation: N/A; putative formula: C13H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.43,"smiles":null,"spectrum_id":"CCMSLIB00017238975","spectrum_index":16762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(4-Methoxyphenyl)propanoic acid (delta mass: 84.0211 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017238976","spectrum_index":16763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 216.0759 Da; putative annotation: N/A; putative formula: C13H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.12,"smiles":null,"spectrum_id":"CCMSLIB00017238979","spectrum_index":16764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 972.3286 Da; putative annotation: N/A; putative formula: C62H40N10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1477.5,"smiles":null,"spectrum_id":"CCMSLIB00017238980","spectrum_index":16765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 364.1146 Da; putative annotation: N/A; putative formula: C23H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.154,"smiles":null,"spectrum_id":"CCMSLIB00017238983","spectrum_index":16766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentaethylene glycol (delta mass: 186.2179 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.367,"smiles":null,"spectrum_id":"CCMSLIB00017238985","spectrum_index":16767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 329.329 Da; putative annotation: N/A; putative formula: C16H39N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.592,"smiles":null,"spectrum_id":"CCMSLIB00017238986","spectrum_index":16768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Modiolide A (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.144,"smiles":null,"spectrum_id":"CCMSLIB00017238989","spectrum_index":16769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 368.2069 Da; putative annotation: N/A; putative formula: C18H32N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.288,"smiles":null,"spectrum_id":"CCMSLIB00017238990","spectrum_index":16770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[3-(2-(3-pyridyl)piperidyl)prop-1-ynyl]cycloheptan-1-ol CollisionEnergy:102040 (delta mass: 32.0472 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.275,"smiles":null,"spectrum_id":"CCMSLIB00017238993","spectrum_index":16771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 84.0538 Da; putative annotation: N/A; putative formula: CH4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.187,"smiles":null,"spectrum_id":"CCMSLIB00017238994","spectrum_index":16772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 15.9954 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.201,"smiles":null,"spectrum_id":"CCMSLIB00017238996","spectrum_index":16773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 270.0432 Da; putative annotation: N/A; putative formula: C10H14N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.14,"smiles":null,"spectrum_id":"CCMSLIB00017238998","spectrum_index":16774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-nitro- (delta mass: 61.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.198,"smiles":null,"spectrum_id":"CCMSLIB00017239000","spectrum_index":16775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 143.1381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.225,"smiles":null,"spectrum_id":"CCMSLIB00017239003","spectrum_index":16776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 80.0627 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017239004","spectrum_index":16777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 269.9173 Da; putative annotation: N/A; putative formula: C6H2N4OP4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.196,"smiles":null,"spectrum_id":"CCMSLIB00017239007","spectrum_index":16778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penitremone-A (delta mass: 26.9999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.347,"smiles":null,"spectrum_id":"CCMSLIB00017239008","spectrum_index":16779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,6-Tetrahydrobenzylalcohol (delta mass: 104.0221 Da; putative annotation: N/A; putative formula: C2H4N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.118,"smiles":null,"spectrum_id":"CCMSLIB00017239010","spectrum_index":16780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 185.0403 Da; putative annotation: N/A; putative formula: CH7N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.09,"smiles":null,"spectrum_id":"CCMSLIB00017239012","spectrum_index":16781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.248,"smiles":null,"spectrum_id":"CCMSLIB00017239014","spectrum_index":16782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 75.9985 Da; putative annotation: N/A; putative formula: C2H4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.1,"smiles":null,"spectrum_id":"CCMSLIB00017239016","spectrum_index":16783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 238.2323 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.36,"smiles":null,"spectrum_id":"CCMSLIB00017239018","spectrum_index":16784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11-Methyl-2-dodecenoic acid (delta mass: 74.0376 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.223,"smiles":null,"spectrum_id":"CCMSLIB00017239020","spectrum_index":16785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 68.0031 Da; putative annotation: N/A; putative formula: C7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.219,"smiles":null,"spectrum_id":"CCMSLIB00017239022","spectrum_index":16786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 45.9188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017239023","spectrum_index":16787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 58.9214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.06,"smiles":null,"spectrum_id":"CCMSLIB00017239026","spectrum_index":16788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 206.0765 Da; putative annotation: N/A; putative formula: C12H14OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.215,"smiles":null,"spectrum_id":"CCMSLIB00017239027","spectrum_index":16789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homogentisic acid (delta mass: 148.0165 Da; putative annotation: N/A; putative formula: C8H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.066,"smiles":null,"spectrum_id":"CCMSLIB00017239030","spectrum_index":16790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 491.2168 Da; putative annotation: N/A; putative formula: C26H29N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.277,"smiles":null,"spectrum_id":"CCMSLIB00017239031","spectrum_index":16791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20a,20b-Dihomo-9-oxo-11R,15S-dihydroxy-5Z,13E-prostadienoic acid (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.29,"smiles":null,"spectrum_id":"CCMSLIB00017239034","spectrum_index":16792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)acetamide (delta mass: 38.0336 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.152,"smiles":null,"spectrum_id":"CCMSLIB00017239036","spectrum_index":16793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 11.0053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.081,"smiles":null,"spectrum_id":"CCMSLIB00017239037","spectrum_index":16794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 15.9941 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.054,"smiles":null,"spectrum_id":"CCMSLIB00017239040","spectrum_index":16795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYBENZOATE (delta mass: 53.0286 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.068,"smiles":null,"spectrum_id":"CCMSLIB00017239041","spectrum_index":16796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 164.0478 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.217,"smiles":null,"spectrum_id":"CCMSLIB00017239044","spectrum_index":16797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 91.027 Da; putative annotation: N/A; putative formula: C2H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.103,"smiles":null,"spectrum_id":"CCMSLIB00017239045","spectrum_index":16798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 45.0445 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.09,"smiles":null,"spectrum_id":"CCMSLIB00017239047","spectrum_index":16799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zizanoic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.185,"smiles":null,"spectrum_id":"CCMSLIB00017239049","spectrum_index":16800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 407.375 Da; putative annotation: N/A; putative formula: C26H49NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.435,"smiles":null,"spectrum_id":"CCMSLIB00017239051","spectrum_index":16801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydodecanoic acid (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.227,"smiles":null,"spectrum_id":"CCMSLIB00017239054","spectrum_index":16802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017239055","spectrum_index":16803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 46.9812 Da; putative annotation: N/A; putative formula: HNS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.041,"smiles":null,"spectrum_id":"CCMSLIB00017239058","spectrum_index":16804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 58.0763 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.131,"smiles":null,"spectrum_id":"CCMSLIB00017239059","spectrum_index":16805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 84.0386 Da; putative annotation: N/A; putative formula: C5H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.127,"smiles":null,"spectrum_id":"CCMSLIB00017239061","spectrum_index":16806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 45.9665 Da; putative annotation: N/A; putative formula: H-2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.047,"smiles":null,"spectrum_id":"CCMSLIB00017239063","spectrum_index":16807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYPHENYLACETIC ACID (delta mass: 76.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017239065","spectrum_index":16808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 242.5879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.764,"smiles":null,"spectrum_id":"CCMSLIB00017239067","spectrum_index":16809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 129.0427 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.272,"smiles":null,"spectrum_id":"CCMSLIB00017239069","spectrum_index":16810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 118.0536 Da; putative annotation: N/A; putative formula: C7H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.119,"smiles":null,"spectrum_id":"CCMSLIB00017239072","spectrum_index":16811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 74.2388 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.34,"smiles":null,"spectrum_id":"CCMSLIB00017239073","spectrum_index":16812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol - 30.0 eV (delta mass: 50.0375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.197,"smiles":null,"spectrum_id":"CCMSLIB00017239076","spectrum_index":16813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 44.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.122,"smiles":null,"spectrum_id":"CCMSLIB00017239077","spectrum_index":16814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 735.5505 Da; putative annotation: N/A; putative formula: C40H73N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.611,"smiles":null,"spectrum_id":"CCMSLIB00017239079","spectrum_index":16815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 134.1092 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.206,"smiles":null,"spectrum_id":"CCMSLIB00017239081","spectrum_index":16816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 632.3932 Da; putative annotation: N/A; putative formula: C36H56O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1137.57,"smiles":null,"spectrum_id":"CCMSLIB00017239083","spectrum_index":16817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 366.3128 Da; putative annotation: N/A; putative formula: C23H42O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.576,"smiles":null,"spectrum_id":"CCMSLIB00017239085","spectrum_index":16818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 41.9296 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.011,"smiles":null,"spectrum_id":"CCMSLIB00017239087","spectrum_index":16819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CHEMBL1602917 CollisionEnergy:102040 (delta mass: 170.0582 Da; putative annotation: N/A; putative formula: C8H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.182,"smiles":null,"spectrum_id":"CCMSLIB00017239090","spectrum_index":16820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 140.0837 Da; putative annotation: N/A; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.201,"smiles":null,"spectrum_id":"CCMSLIB00017239091","spectrum_index":16821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one (delta mass: 104.0974 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.257,"smiles":null,"spectrum_id":"CCMSLIB00017239094","spectrum_index":16822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 153.1517 Da; putative annotation: N/A; putative formula: C10H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.29,"smiles":null,"spectrum_id":"CCMSLIB00017239095","spectrum_index":16823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 641.5219 Da; putative annotation: N/A; putative formula: C37H71NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.749,"smiles":null,"spectrum_id":"CCMSLIB00017239098","spectrum_index":16824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [3-Ethoxy-4-(ethoxycarbonyl)phenyl]acetic acid (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.118,"smiles":null,"spectrum_id":"CCMSLIB00017239099","spectrum_index":16825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 164.2147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.31,"smiles":null,"spectrum_id":"CCMSLIB00017239102","spectrum_index":16826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 180.0521 Da; putative annotation: N/A; putative formula: C2H9N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.102,"smiles":null,"spectrum_id":"CCMSLIB00017239103","spectrum_index":16827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 182.1675 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.457,"smiles":null,"spectrum_id":"CCMSLIB00017239106","spectrum_index":16828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 211.0693 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.202,"smiles":null,"spectrum_id":"CCMSLIB00017239107","spectrum_index":16829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 145.1104 Da; putative annotation: N/A; putative formula: C7H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.192,"smiles":null,"spectrum_id":"CCMSLIB00017239110","spectrum_index":16830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 80.0262 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.227,"smiles":null,"spectrum_id":"CCMSLIB00017239111","spectrum_index":16831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic OM 173.alpha.2 (delta mass: 14.0161 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.113,"smiles":null,"spectrum_id":"CCMSLIB00017239113","spectrum_index":16832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 64.0535 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.265,"smiles":null,"spectrum_id":"CCMSLIB00017239115","spectrum_index":16833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 188.8234 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.895,"smiles":null,"spectrum_id":"CCMSLIB00017239118","spectrum_index":16834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4'-Bipiperidine (delta mass: 27.0113 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.181,"smiles":null,"spectrum_id":"CCMSLIB00017239119","spectrum_index":16835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Ethyl-9H-carbazol-3-ylamine (delta mass: 44.9736 Da; putative annotation: N/A; putative formula: NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.097,"smiles":null,"spectrum_id":"CCMSLIB00017239122","spectrum_index":16836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 132.0974 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.303,"smiles":null,"spectrum_id":"CCMSLIB00017239123","spectrum_index":16837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 30.0079 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.24,"smiles":null,"spectrum_id":"CCMSLIB00017239126","spectrum_index":16838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 446.1103 Da; putative annotation: N/A; putative formula: C20H34O-1P4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.149,"smiles":null,"spectrum_id":"CCMSLIB00017239127","spectrum_index":16839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-1-(2-Hydroxyethyl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol (delta mass: 78.0832 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.315,"smiles":null,"spectrum_id":"CCMSLIB00017239130","spectrum_index":16840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 404.1187 Da; putative annotation: N/A; putative formula: C25H25O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.199,"smiles":null,"spectrum_id":"CCMSLIB00017239131","spectrum_index":16841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3,4-Dimethoxyphenyl)-1H-indole (delta mass: 77.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.165,"smiles":null,"spectrum_id":"CCMSLIB00017239133","spectrum_index":16842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvidin C (delta mass: 64.0676 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.263,"smiles":null,"spectrum_id":"CCMSLIB00017239135","spectrum_index":16843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 194.0729 Da; putative annotation: N/A; putative formula: C14H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.201,"smiles":null,"spectrum_id":"CCMSLIB00017239138","spectrum_index":16844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 206.132 Da; putative annotation: N/A; putative formula: C13H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.255,"smiles":null,"spectrum_id":"CCMSLIB00017239139","spectrum_index":16845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-(3-methylbut-2-enyl)benzoic acid (delta mass: 35.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.144,"smiles":null,"spectrum_id":"CCMSLIB00017239142","spectrum_index":16846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin A (delta mass: 94.0413 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.216,"smiles":null,"spectrum_id":"CCMSLIB00017239143","spectrum_index":16847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 305.2612 Da; putative annotation: N/A; putative formula: C20H36NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.535,"smiles":null,"spectrum_id":"CCMSLIB00017239146","spectrum_index":16848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sumaresinolic acid (delta mass: 128.026 Da; putative annotation: N/A; putative formula: C9H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.388,"smiles":null,"spectrum_id":"CCMSLIB00017239149","spectrum_index":16849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 375.1378 Da; putative annotation: N/A; putative formula: C18H17N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.323,"smiles":null,"spectrum_id":"CCMSLIB00017239150","spectrum_index":16850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA001379 Coniine (delta mass: 72.0216 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.165,"smiles":null,"spectrum_id":"CCMSLIB00017239153","spectrum_index":16851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-isoleucine (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017239156","spectrum_index":16852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxygeraniol-1-carboxylic acid, .beta.-D-glucopyranosyl ester (delta mass: 100.0675 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.237,"smiles":null,"spectrum_id":"CCMSLIB00017239157","spectrum_index":16853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 216.0992 Da; putative annotation: N/A; putative formula: C10H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.185,"smiles":null,"spectrum_id":"CCMSLIB00017239160","spectrum_index":16854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 118.0632 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.41,"smiles":null,"spectrum_id":"CCMSLIB00017239161","spectrum_index":16855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Isolongifolol (delta mass: 67.0792 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.285,"smiles":null,"spectrum_id":"CCMSLIB00017239164","spectrum_index":16856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thuggacin A (delta mass: 473.2097 Da; putative annotation: N/A; putative formula: C23H31N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1105.57,"smiles":null,"spectrum_id":"CCMSLIB00017239165","spectrum_index":16857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 35.0092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":107.09,"smiles":null,"spectrum_id":"CCMSLIB00017239168","spectrum_index":16858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 396.1912 Da; putative annotation: N/A; putative formula: C28H28S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.262,"smiles":null,"spectrum_id":"CCMSLIB00017239169","spectrum_index":16859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 774.4365 Da; putative annotation: N/A; putative formula: C48H62N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":955.507,"smiles":null,"spectrum_id":"CCMSLIB00017239172","spectrum_index":16860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methylbenzyl)pyrrolidine (delta mass: 86.0863 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.23,"smiles":null,"spectrum_id":"CCMSLIB00017239173","spectrum_index":16861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 27.98 Da; putative annotation: N/A; putative formula: CO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.029,"smiles":null,"spectrum_id":"CCMSLIB00017239175","spectrum_index":16862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 158.019 Da; putative annotation: N/A; putative formula: C10H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.085,"smiles":null,"spectrum_id":"CCMSLIB00017239177","spectrum_index":16863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin C (delta mass: 103.0079 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.188,"smiles":null,"spectrum_id":"CCMSLIB00017239179","spectrum_index":16864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 641.1926 Da; putative annotation: N/A; putative formula: C45H27N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.253,"smiles":null,"spectrum_id":"CCMSLIB00017239181","spectrum_index":16865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannose 6-phosphate (delta mass: 157.0249 Da; putative annotation: N/A; putative formula: C4H-1N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.062,"smiles":null,"spectrum_id":"CCMSLIB00017239184","spectrum_index":16866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,8-Dihydroxy-1,4-naphthoquinone (delta mass: 225.1261 Da; putative annotation: N/A; putative formula: C14H15N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.16,"smiles":null,"spectrum_id":"CCMSLIB00017239185","spectrum_index":16867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tibolone (delta mass: 196.1097 Da; putative annotation: N/A; putative formula: C11H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.326,"smiles":null,"spectrum_id":"CCMSLIB00017239188","spectrum_index":16868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 182.0931 Da; putative annotation: N/A; putative formula: C10H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.33,"smiles":null,"spectrum_id":"CCMSLIB00017239189","spectrum_index":16869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 239.0992 Da; putative annotation: N/A; putative formula: C12H19NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.331,"smiles":null,"spectrum_id":"CCMSLIB00017239192","spectrum_index":16870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 104.0988 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.321,"smiles":null,"spectrum_id":"CCMSLIB00017239193","spectrum_index":16871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 262.1099 Da; putative annotation: N/A; putative formula: C9H18N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.191,"smiles":null,"spectrum_id":"CCMSLIB00017239196","spectrum_index":16872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 255.1682 Da; putative annotation: N/A; putative formula: C14H27NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.239,"smiles":null,"spectrum_id":"CCMSLIB00017239197","spectrum_index":16873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desferrioxamine E (delta mass: 406.1595 Da; putative annotation: N/A; putative formula: C17H30N2O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1007.52,"smiles":null,"spectrum_id":"CCMSLIB00017239200","spectrum_index":16874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 61.0168 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.28,"smiles":null,"spectrum_id":"CCMSLIB00017239201","spectrum_index":16875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 27.005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.055,"smiles":null,"spectrum_id":"CCMSLIB00017239204","spectrum_index":16876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 25.0102 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.096,"smiles":null,"spectrum_id":"CCMSLIB00017239207","spectrum_index":16877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 427.1844 Da; putative annotation: N/A; putative formula: C20H29NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.255,"smiles":null,"spectrum_id":"CCMSLIB00017239208","spectrum_index":16878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 173.0477 Da; putative annotation: N/A; putative formula: C10H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.118,"smiles":null,"spectrum_id":"CCMSLIB00017239211","spectrum_index":16879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carabrol (delta mass: 94.0784 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.243,"smiles":null,"spectrum_id":"CCMSLIB00017239214","spectrum_index":16880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 352.1888 Da; putative annotation: N/A; putative formula: C19H28O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.233,"smiles":null,"spectrum_id":"CCMSLIB00017239215","spectrum_index":16881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 74.0464 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.294,"smiles":null,"spectrum_id":"CCMSLIB00017239217","spectrum_index":16882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 144.0789 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.197,"smiles":null,"spectrum_id":"CCMSLIB00017239219","spectrum_index":16883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 24.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.08,"smiles":null,"spectrum_id":"CCMSLIB00017239221","spectrum_index":16884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385919-01_C20H34O_2-Penten-1-ol, 5-[(1S,4aS,8aS)-decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]-3-methyl-, (2E)- (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.295,"smiles":null,"spectrum_id":"CCMSLIB00017239223","spectrum_index":16885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 201.2386 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.434,"smiles":null,"spectrum_id":"CCMSLIB00017239226","spectrum_index":16886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 60.0204 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.127,"smiles":null,"spectrum_id":"CCMSLIB00017239227","spectrum_index":16887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Methylbenzyl)piperazine (delta mass: 60.046 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.2,"smiles":null,"spectrum_id":"CCMSLIB00017239230","spectrum_index":16888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 95.9187 Da; putative annotation: N/A; putative formula: S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.973,"smiles":null,"spectrum_id":"CCMSLIB00017239231","spectrum_index":16889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 376.2096 Da; putative annotation: N/A; putative formula: C18H32O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.28,"smiles":null,"spectrum_id":"CCMSLIB00017239234","spectrum_index":16890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 175.0398 Da; putative annotation: N/A; putative formula: C6H10NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.194,"smiles":null,"spectrum_id":"CCMSLIB00017239235","spectrum_index":16891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 147.0406 Da; putative annotation: N/A; putative formula: C3HN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.132,"smiles":null,"spectrum_id":"CCMSLIB00017239238","spectrum_index":16892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 277.0499 Da; putative annotation: N/A; putative formula: C16H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.226,"smiles":null,"spectrum_id":"CCMSLIB00017239239","spectrum_index":16893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (Z,E)-Tetradeca-9,12-dienol from NIST14 (delta mass: 350.9989 Da; putative annotation: N/A; putative formula: C14H13N3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.205,"smiles":null,"spectrum_id":"CCMSLIB00017239241","spectrum_index":16894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine (delta mass: 159.0913 Da; putative annotation: N/A; putative formula: C8H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.24,"smiles":null,"spectrum_id":"CCMSLIB00017239243","spectrum_index":16895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 101.0112 Da; putative annotation: N/A; putative formula: C3H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.071,"smiles":null,"spectrum_id":"CCMSLIB00017239246","spectrum_index":16896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 76.0677 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.315,"smiles":null,"spectrum_id":"CCMSLIB00017239248","spectrum_index":16897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvidin C (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.243,"smiles":null,"spectrum_id":"CCMSLIB00017239250","spectrum_index":16898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 100.0636 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.135,"smiles":null,"spectrum_id":"CCMSLIB00017239252","spectrum_index":16899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.176,"smiles":null,"spectrum_id":"CCMSLIB00017239254","spectrum_index":16900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 351.241 Da; putative annotation: N/A; putative formula: C20H33NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.38,"smiles":null,"spectrum_id":"CCMSLIB00017239257","spectrum_index":16901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 75.0703 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.13,"smiles":null,"spectrum_id":"CCMSLIB00017239258","spectrum_index":16902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 395.3036 Da; putative annotation: N/A; putative formula: C23H41NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.416,"smiles":null,"spectrum_id":"CCMSLIB00017239261","spectrum_index":16903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 505.362 Da; putative annotation: N/A; putative formula: C27H55NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.432,"smiles":null,"spectrum_id":"CCMSLIB00017239262","spectrum_index":16904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 353.1297 Da; putative annotation: N/A; putative formula: C17H23NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1020.36,"smiles":null,"spectrum_id":"CCMSLIB00017239264","spectrum_index":16905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 353.2567 Da; putative annotation: N/A; putative formula: C20H35NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.39,"smiles":null,"spectrum_id":"CCMSLIB00017239266","spectrum_index":16906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thelephoric acid (delta mass: 110.0592 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.088,"smiles":null,"spectrum_id":"CCMSLIB00017239268","spectrum_index":16907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 102.0832 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.31,"smiles":null,"spectrum_id":"CCMSLIB00017239270","spectrum_index":16908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 113.0836 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.144,"smiles":null,"spectrum_id":"CCMSLIB00017239273","spectrum_index":16909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 396.2277 Da; putative annotation: N/A; putative formula: C18H37O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.309,"smiles":null,"spectrum_id":"CCMSLIB00017239275","spectrum_index":16910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(?)-ampicillin - 40.0 eV (delta mass: 323.13 Da; putative annotation: N/A; putative formula: C17H18N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.247,"smiles":null,"spectrum_id":"CCMSLIB00017239277","spectrum_index":16911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 54.0324 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.39,"smiles":null,"spectrum_id":"CCMSLIB00017239279","spectrum_index":16912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Oxo-5-phenylpentanoic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.081,"smiles":null,"spectrum_id":"CCMSLIB00017239281","spectrum_index":16913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 115.0269 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.134,"smiles":null,"spectrum_id":"CCMSLIB00017239283","spectrum_index":16914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 109.0532 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017239285","spectrum_index":16915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 96.06 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.139,"smiles":null,"spectrum_id":"CCMSLIB00017239287","spectrum_index":16916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 160.0837 Da; putative annotation: N/A; putative formula: C8H17O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.186,"smiles":null,"spectrum_id":"CCMSLIB00017239288","spectrum_index":16917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 576.1286 Da; putative annotation: N/A; putative formula: C24H28N6O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.199,"smiles":null,"spectrum_id":"CCMSLIB00017239291","spectrum_index":16918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 16.0313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.165,"smiles":null,"spectrum_id":"CCMSLIB00017239293","spectrum_index":16919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-(4-hydroxypentyl)- (delta mass: 58.0774 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.205,"smiles":null,"spectrum_id":"CCMSLIB00017239295","spectrum_index":16920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 88.0374 Da; putative annotation: N/A; putative formula: CH4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.113,"smiles":null,"spectrum_id":"CCMSLIB00017239297","spectrum_index":16921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 57.9843 Da; putative annotation: N/A; putative formula: C5H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017239300","spectrum_index":16922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 34.0055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.269,"smiles":null,"spectrum_id":"CCMSLIB00017239302","spectrum_index":16923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 58.0784 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017239304","spectrum_index":16924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austinoneol (delta mass: 197.1782 Da; putative annotation: N/A; putative formula: C12H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.39,"smiles":null,"spectrum_id":"CCMSLIB00017239306","spectrum_index":16925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 714.4376 Da; putative annotation: N/A; putative formula: C28H50N20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":877.498,"smiles":null,"spectrum_id":"CCMSLIB00017239308","spectrum_index":16926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 268.2405 Da; putative annotation: N/A; putative formula: C17H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.348,"smiles":null,"spectrum_id":"CCMSLIB00017239310","spectrum_index":16927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 118.0769 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.34,"smiles":null,"spectrum_id":"CCMSLIB00017239312","spectrum_index":16928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 114.0435 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.214,"smiles":null,"spectrum_id":"CCMSLIB00017239315","spectrum_index":16929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 106.0787 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.279,"smiles":null,"spectrum_id":"CCMSLIB00017239316","spectrum_index":16930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Quinazolinediamine, N4-[2-(4-phenoxyphenyl)ethyl]- (delta mass: 99.0379 Da; putative annotation: N/A; putative formula: C3H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.209,"smiles":null,"spectrum_id":"CCMSLIB00017239319","spectrum_index":16931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 29.956 Da; putative annotation: N/A; putative formula: C15H24N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.224,"smiles":null,"spectrum_id":"CCMSLIB00017239320","spectrum_index":16932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 101.0987 Da; putative annotation: N/A; putative formula: C4H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.159,"smiles":null,"spectrum_id":"CCMSLIB00017239323","spectrum_index":16933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 84.0524 Da; putative annotation: N/A; putative formula: CH4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.133,"smiles":null,"spectrum_id":"CCMSLIB00017239325","spectrum_index":16934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetamide (delta mass: 87.0395 Da; putative annotation: N/A; putative formula: C2H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.126,"smiles":null,"spectrum_id":"CCMSLIB00017239327","spectrum_index":16935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 179.0847 Da; putative annotation: N/A; putative formula: C12H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.28,"smiles":null,"spectrum_id":"CCMSLIB00017239329","spectrum_index":16936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 334.1168 Da; putative annotation: N/A; putative formula: C16H18N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.198,"smiles":null,"spectrum_id":"CCMSLIB00017239331","spectrum_index":16937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Myristoleic acid from NIST14 (delta mass: 349.1794 Da; putative annotation: N/A; putative formula: C14H23N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.38,"smiles":null,"spectrum_id":"CCMSLIB00017239333","spectrum_index":16938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,15-Labdanediol (delta mass: 88.0676 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.362,"smiles":null,"spectrum_id":"CCMSLIB00017239336","spectrum_index":16939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2Z-Eicosenoic acid (delta mass: 100.0676 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.362,"smiles":null,"spectrum_id":"CCMSLIB00017239337","spectrum_index":16940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[2-(1H-Tetraazol-5-yl)ethyl]-1H-tetraazole (delta mass: 98.0041 Da; putative annotation: N/A; putative formula: C3H3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.083,"smiles":null,"spectrum_id":"CCMSLIB00017239339","spectrum_index":16941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 52.0303 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.111,"smiles":null,"spectrum_id":"CCMSLIB00017239341","spectrum_index":16942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydodecanoic acid (delta mass: 82.0785 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.258,"smiles":null,"spectrum_id":"CCMSLIB00017239344","spectrum_index":16943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 127.0887 Da; putative annotation: N/A; putative formula: C7H14NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.196,"smiles":null,"spectrum_id":"CCMSLIB00017239345","spectrum_index":16944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdesmethoxycurcumin (delta mass: 302.1511 Da; putative annotation: N/A; putative formula: C12H23N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.263,"smiles":null,"spectrum_id":"CCMSLIB00017239348","spectrum_index":16945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine (delta mass: 72.0035 Da; putative annotation: N/A; putative formula: C3H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.116,"smiles":null,"spectrum_id":"CCMSLIB00017239349","spectrum_index":16946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tuberonic acid (delta mass: 38.0518 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.18,"smiles":null,"spectrum_id":"CCMSLIB00017239352","spectrum_index":16947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 143.0193 Da; putative annotation: N/A; putative formula: C9H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.085,"smiles":null,"spectrum_id":"CCMSLIB00017239353","spectrum_index":16948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-deoxyfructosylleucylisoleucine (delta mass: 83.0312 Da; putative annotation: N/A; putative formula: C4H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.27,"smiles":null,"spectrum_id":"CCMSLIB00017239355","spectrum_index":16949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Fluorobenzoyl)-5-amino-1H-indole (delta mass: 86.0819 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.175,"smiles":null,"spectrum_id":"CCMSLIB00017239357","spectrum_index":16950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7-Triazacyclononane (delta mass: 103.1106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.245,"smiles":null,"spectrum_id":"CCMSLIB00017239359","spectrum_index":16951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 48.019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.11,"smiles":null,"spectrum_id":"CCMSLIB00017239361","spectrum_index":16952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-ol (delta mass: 36.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.222,"smiles":null,"spectrum_id":"CCMSLIB00017239363","spectrum_index":16953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 102.0466 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017239365","spectrum_index":16954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(9H-Carbazol-9-yl)propanoic acid (delta mass: 551.1459 Da; putative annotation: N/A; putative formula: C27H26N3O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.248,"smiles":null,"spectrum_id":"CCMSLIB00017239367","spectrum_index":16955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 98.0369 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.087,"smiles":null,"spectrum_id":"CCMSLIB00017239369","spectrum_index":16956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Orbifloxacin (delta mass: 121.0468 Da; putative annotation: N/A; putative formula: C2H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.2,"smiles":null,"spectrum_id":"CCMSLIB00017239371","spectrum_index":16957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 26.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.143,"smiles":null,"spectrum_id":"CCMSLIB00017239373","spectrum_index":16958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 27.0058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.192,"smiles":null,"spectrum_id":"CCMSLIB00017239376","spectrum_index":16959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 127.0843 Da; putative annotation: N/A; putative formula: C4H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.301,"smiles":null,"spectrum_id":"CCMSLIB00017239378","spectrum_index":16960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 42.0443 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.125,"smiles":null,"spectrum_id":"CCMSLIB00017239380","spectrum_index":16961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 18.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.118,"smiles":null,"spectrum_id":"CCMSLIB00017239382","spectrum_index":16962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 88.0152 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.112,"smiles":null,"spectrum_id":"CCMSLIB00017239384","spectrum_index":16963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanylglycol (delta mass: 23.9998 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.081,"smiles":null,"spectrum_id":"CCMSLIB00017239387","spectrum_index":16964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxylimaprost (delta mass: 76.0675 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.357,"smiles":null,"spectrum_id":"CCMSLIB00017239388","spectrum_index":16965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 106.0799 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.307,"smiles":null,"spectrum_id":"CCMSLIB00017239391","spectrum_index":16966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 179.0789 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.28,"smiles":null,"spectrum_id":"CCMSLIB00017239392","spectrum_index":16967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Desferrioxamine from NIST14 (delta mass: 180.0075 Da; putative annotation: N/A; putative formula: C9N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.368,"smiles":null,"spectrum_id":"CCMSLIB00017239395","spectrum_index":16968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 262.0759 Da; putative annotation: N/A; putative formula: C14H15O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.181,"smiles":null,"spectrum_id":"CCMSLIB00017239396","spectrum_index":16969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9,9b-Dihydroxy-6,6,9a-trimethyl-1-oxo-3,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl) hexanoate (delta mass: 380.2313 Da; putative annotation: N/A; putative formula: C22H39O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.458,"smiles":null,"spectrum_id":"CCMSLIB00017239399","spectrum_index":16970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Deoxylactucin (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.128,"smiles":null,"spectrum_id":"CCMSLIB00017239400","spectrum_index":16971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid, methyl ester (delta mass: 17.9653 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.223,"smiles":null,"spectrum_id":"CCMSLIB00017239402","spectrum_index":16972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 204.1873 Da; putative annotation: N/A; putative formula: C15H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.278,"smiles":null,"spectrum_id":"CCMSLIB00017239404","spectrum_index":16973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linalool oxide (delta mass: 191.0424 Da; putative annotation: N/A; putative formula: C6H9NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.18,"smiles":null,"spectrum_id":"CCMSLIB00017239407","spectrum_index":16974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 78.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.134,"smiles":null,"spectrum_id":"CCMSLIB00017239408","spectrum_index":16975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aristololactam (delta mass: 197.0909 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.167,"smiles":null,"spectrum_id":"CCMSLIB00017239411","spectrum_index":16976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 89.0478 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.145,"smiles":null,"spectrum_id":"CCMSLIB00017239412","spectrum_index":16977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 63.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.437,"smiles":null,"spectrum_id":"CCMSLIB00017239415","spectrum_index":16978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 161.1044 Da; putative annotation: N/A; putative formula: C7H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.352,"smiles":null,"spectrum_id":"CCMSLIB00017239416","spectrum_index":16979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Deoxy-12-hydroxyandrographolide (delta mass: 48.0361 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.253,"smiles":null,"spectrum_id":"CCMSLIB00017239419","spectrum_index":16980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 221.0894 Da; putative annotation: N/A; putative formula: C8H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.15,"smiles":null,"spectrum_id":"CCMSLIB00017239420","spectrum_index":16981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloropropyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 46.0136 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.077,"smiles":null,"spectrum_id":"CCMSLIB00017239423","spectrum_index":16982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 101.0875 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.158,"smiles":null,"spectrum_id":"CCMSLIB00017239424","spectrum_index":16983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 164.0931 Da; putative annotation: N/A; putative formula: C3H13N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.44,"smiles":null,"spectrum_id":"CCMSLIB00017239427","spectrum_index":16984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 713.3125 Da; putative annotation: N/A; putative formula: C34H48N7O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.383,"smiles":null,"spectrum_id":"CCMSLIB00017239428","spectrum_index":16985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzocain (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.144,"smiles":null,"spectrum_id":"CCMSLIB00017239431","spectrum_index":16986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1a,1b-Dihomoprostaglandin E1 (delta mass: 64.0702 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.349,"smiles":null,"spectrum_id":"CCMSLIB00017239432","spectrum_index":16987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 117.1145 Da; putative annotation: N/A; putative formula: C2H11N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.336,"smiles":null,"spectrum_id":"CCMSLIB00017239435","spectrum_index":16988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-hydroxy-1,7-diphenylhept-1-en-3-one (delta mass: 15.9964 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.15,"smiles":null,"spectrum_id":"CCMSLIB00017239437","spectrum_index":16989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alisol B acetate (delta mass: 94.0797 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.453,"smiles":null,"spectrum_id":"CCMSLIB00017239439","spectrum_index":16990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 209.0725 Da; putative annotation: N/A; putative formula: C7H15NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.175,"smiles":null,"spectrum_id":"CCMSLIB00017239441","spectrum_index":16991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 104.0993 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.357,"smiles":null,"spectrum_id":"CCMSLIB00017239443","spectrum_index":16992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis,cis-9,12-Octadecadien-1-ol (delta mass: 88.0162 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.284,"smiles":null,"spectrum_id":"CCMSLIB00017239445","spectrum_index":16993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.06,"smiles":null,"spectrum_id":"CCMSLIB00017239447","spectrum_index":16994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00179862-03_C20H32O2_1-Naphthalenecarboxaldehyde, decahydro-5-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-1,4a-dimethyl-6-methylene-, (1R,4aR,5S)- (delta mass: 91.0639 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.311,"smiles":null,"spectrum_id":"CCMSLIB00017239448","spectrum_index":16995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Dihydrotestosterone (delta mass: 141.0575 Da; putative annotation: N/A; putative formula: C10H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.289,"smiles":null,"spectrum_id":"CCMSLIB00017239451","spectrum_index":16996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 32.0292 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.084,"smiles":null,"spectrum_id":"CCMSLIB00017239452","spectrum_index":16997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 30.0 eV (delta mass: 89.0113 Da; putative annotation: N/A; putative formula: C2H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.087,"smiles":null,"spectrum_id":"CCMSLIB00017239455","spectrum_index":16998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 156.0332 Da; putative annotation: N/A; putative formula: C2H4N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.114,"smiles":null,"spectrum_id":"CCMSLIB00017239457","spectrum_index":16999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (((3a,7a)-3,7-trihydroxy-24-oxocholan-22-en-24-yl)amino)ethanesulfonic acid (delta mass: 134.1121 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.401,"smiles":null,"spectrum_id":"CCMSLIB00017239459","spectrum_index":17000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 174.1626 Da; putative annotation: N/A; putative formula: C6H18N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.228,"smiles":null,"spectrum_id":"CCMSLIB00017239461","spectrum_index":17001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 344.2313 Da; putative annotation: N/A; putative formula: C17H32N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.307,"smiles":null,"spectrum_id":"CCMSLIB00017239463","spectrum_index":17002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 63.9941 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.101,"smiles":null,"spectrum_id":"CCMSLIB00017239465","spectrum_index":17003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Octen-3-ol (delta mass: 74.0724 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.2,"smiles":null,"spectrum_id":"CCMSLIB00017239467","spectrum_index":17004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 60.0233 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017239470","spectrum_index":17005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 alcohol (delta mass: 102.0855 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.354,"smiles":null,"spectrum_id":"CCMSLIB00017239471","spectrum_index":17006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 120.0068 Da; putative annotation: N/A; putative formula: C4H8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.145,"smiles":null,"spectrum_id":"CCMSLIB00017239473","spectrum_index":17007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 109.0388 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.151,"smiles":null,"spectrum_id":"CCMSLIB00017239475","spectrum_index":17008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 97.0531 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.113,"smiles":null,"spectrum_id":"CCMSLIB00017239478","spectrum_index":17009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300024 Voacristine (delta mass: 17.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.233,"smiles":null,"spectrum_id":"CCMSLIB00017239479","spectrum_index":17010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 90.0284 Da; putative annotation: N/A; putative formula: C2H6N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.124,"smiles":null,"spectrum_id":"CCMSLIB00017239482","spectrum_index":17011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 144.9882 Da; putative annotation: N/A; putative formula: C2H3N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.137,"smiles":null,"spectrum_id":"CCMSLIB00017239483","spectrum_index":17012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 51.0722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.174,"smiles":null,"spectrum_id":"CCMSLIB00017239486","spectrum_index":17013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,3-DIAMINOPROPANE\"\" (delta mass: 55.0673 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":130.159,"smiles":null,"spectrum_id":"CCMSLIB00017239488","spectrum_index":17014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 250.1677 Da; putative annotation: N/A; putative formula: C14H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.28,"smiles":null,"spectrum_id":"CCMSLIB00017239490","spectrum_index":17015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 102.0822 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.34,"smiles":null,"spectrum_id":"CCMSLIB00017239492","spectrum_index":17016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 310.1016 Da; putative annotation: N/A; putative formula: C12H25O3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.156,"smiles":null,"spectrum_id":"CCMSLIB00017239494","spectrum_index":17017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 252.0799 Da; putative annotation: Pinostrobin; putative formula: C16H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.208,"smiles":null,"spectrum_id":"CCMSLIB00017239496","spectrum_index":17018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 113.0862 Da; putative annotation: Massbank:PB000392 Leucine|2-amino-4-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.21,"smiles":null,"spectrum_id":"CCMSLIB00017239498","spectrum_index":17019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 148.0526 Da; putative annotation: 3-Phenoxypropionic acid; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.149,"smiles":null,"spectrum_id":"CCMSLIB00017239500","spectrum_index":17020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Pro (delta mass: 97.054 Da; putative annotation: L-PROLINE; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.167,"smiles":null,"spectrum_id":"CCMSLIB00017239503","spectrum_index":17021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tyramine CollisionEnergy:102040 (delta mass: 107.0371 Da; putative annotation: 4-Amino-1,2-benzenediol; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.128,"smiles":null,"spectrum_id":"CCMSLIB00017239504","spectrum_index":17022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-N-stearoylsphingosine (delta mass: 238.2296 Da; putative annotation: 2-Hexyldecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.519,"smiles":null,"spectrum_id":"CCMSLIB00017239507","spectrum_index":17023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 334.2505 Da; putative annotation: 1-Monolinolenin; putative formula: C21H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.519,"smiles":null,"spectrum_id":"CCMSLIB00017239508","spectrum_index":17024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Palmitoyl-2-oleoyl-sn-glycerol from NIST14 (delta mass: 238.2273 Da; putative annotation: 2-Hexyldecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.757,"smiles":null,"spectrum_id":"CCMSLIB00017239511","spectrum_index":17025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 176.0685 Da; putative annotation: Methyl .alpha.-D-mannopyranoside; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.129,"smiles":null,"spectrum_id":"CCMSLIB00017239512","spectrum_index":17026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 345.2724 Da; putative annotation: 15(S)-Hydroxy-N-(2-hydroxyethyl)-5Z,8Z,11Z,13E-eicosatetraenamide; putative formula: C22H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.504,"smiles":null,"spectrum_id":"CCMSLIB00017239515","spectrum_index":17027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 113.0833 Da; putative annotation: 6-Aminocaproic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.207,"smiles":null,"spectrum_id":"CCMSLIB00017239516","spectrum_index":17028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 278.2232 Da; putative annotation: (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.45,"smiles":null,"spectrum_id":"CCMSLIB00017239519","spectrum_index":17029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 188.0474 Da; putative annotation: 7-Hydroxy-4-(methoxymethyl)coumarin; putative formula: C11H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.091,"smiles":null,"spectrum_id":"CCMSLIB00017239520","spectrum_index":17030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[5-[(3Z,6Z)-2,12-Dihydroxydodeca-3,6-dienyl]oxolan-2-yl]acetic acid (delta mass: 376.2248 Da; putative annotation: [(1aR,2S,2aS,5R,5aS,6S,7aS)-2-Acetyloxy-5-hydroxy-2a,7a-dimethyl-5-propan-2-yl-2,3,4,5a,6,7-hexahydro-1aH-azuleno[6,7-b]oxiren-6-yl] (Z)-2-methylbut-2-enoate; putative formula: C22H32O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.441,"smiles":null,"spectrum_id":"CCMSLIB00017239523","spectrum_index":17031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 140.0834 Da; putative annotation: (1-Hydroxycyclohexyl)acetic acid; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017239524","spectrum_index":17032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 295.2509 Da; putative annotation: N-Palmitoylglycine; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.503,"smiles":null,"spectrum_id":"CCMSLIB00017239527","spectrum_index":17033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 146.0576 Da; putative annotation: 2-DEOXY-D-GLUCOSE - 20.0 eV; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.181,"smiles":null,"spectrum_id":"CCMSLIB00017239529","spectrum_index":17034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 472.3579 Da; putative annotation: NCGC00380239-01!16-hydroxy-4,4,8,10,14-pentamethyl-17-(4,5,6-trihydroxy-6-methylheptan-2-yl)-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-3-one [IIN-based: Match]; putative formula: C30H48O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":927.71,"smiles":null,"spectrum_id":"CCMSLIB00017239531","spectrum_index":17035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Leu (delta mass: 113.084 Da; putative annotation: L-ISOLEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017239533","spectrum_index":17036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-15-Tetracosenoic acid (delta mass: 122.108 Da; putative annotation: trans,cis-3,6-Nonadien-1-ol; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.465,"smiles":null,"spectrum_id":"CCMSLIB00017239536","spectrum_index":17037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 161.0686 Da; putative annotation: 2-((2H-pyrazolo[3,4-d]pyrimidin-4-yl)amino)ethanol; putative formula: C7H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.134,"smiles":null,"spectrum_id":"CCMSLIB00017239538","spectrum_index":17038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 84.0216 Da; putative annotation: Succinic semialdehyde; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.124,"smiles":null,"spectrum_id":"CCMSLIB00017239540","spectrum_index":17039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 309.1232 Da; putative annotation: N-Fructosyl phenylalanine; putative formula: C15H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.299,"smiles":null,"spectrum_id":"CCMSLIB00017239543","spectrum_index":17040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 174.0528 Da; putative annotation: Sedoheptulosan; putative formula: C7H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.113,"smiles":null,"spectrum_id":"CCMSLIB00017239545","spectrum_index":17041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 68.0652 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.18,"smiles":null,"spectrum_id":"CCMSLIB00017239548","spectrum_index":17042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 391.3444 Da; putative annotation: N/A; putative formula: C25H45NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.597,"smiles":null,"spectrum_id":"CCMSLIB00017239549","spectrum_index":17043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lanosterol (delta mass: 225.1728 Da; putative annotation: N/A; putative formula: C13H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.566,"smiles":null,"spectrum_id":"CCMSLIB00017239552","spectrum_index":17044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017239554","spectrum_index":17045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to p-Acetaminobenzoic acid from NIST14 (delta mass: 88.0885 Da; putative annotation: N/A; putative formula: CH8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.154,"smiles":null,"spectrum_id":"CCMSLIB00017239556","spectrum_index":17046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zizanoic acid (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017239559","spectrum_index":17047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 85.0741 Da; putative annotation: N/A; putative formula: C2H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.155,"smiles":null,"spectrum_id":"CCMSLIB00017239560","spectrum_index":17048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 453.2724 Da; putative annotation: N/A; putative formula: C24H39NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.515,"smiles":null,"spectrum_id":"CCMSLIB00017239563","spectrum_index":17049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-(Methoxycarbonyl)dec-9-enoic acid (delta mass: 82.0725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.216,"smiles":null,"spectrum_id":"CCMSLIB00017239564","spectrum_index":17050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ricinoleic acid methyl ester (delta mass: 180.0635 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.337,"smiles":null,"spectrum_id":"CCMSLIB00017239567","spectrum_index":17051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 14.0151 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017239568","spectrum_index":17052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-9-(hydroxymethyl)-1,4,9-trimethyl-2,4,5,7,8,8a-hexahydro-4,7-methanoazulen-6(1H)-one (delta mass: 116.0991 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.263,"smiles":null,"spectrum_id":"CCMSLIB00017239571","spectrum_index":17053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 56.0337 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.308,"smiles":null,"spectrum_id":"CCMSLIB00017239573","spectrum_index":17054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,16.Xi.)-17-Hydroxykauran-19-oic acid (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.289,"smiles":null,"spectrum_id":"CCMSLIB00017239575","spectrum_index":17055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-4(Z),7(Z),10(Z),13(Z),15(E),19(Z)-docosahexaenoic acid (delta mass: 53.0487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.276,"smiles":null,"spectrum_id":"CCMSLIB00017239578","spectrum_index":17056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 159.0899 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.192,"smiles":null,"spectrum_id":"CCMSLIB00017239580","spectrum_index":17057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chorismic acid (delta mass: 122.0368 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.092,"smiles":null,"spectrum_id":"CCMSLIB00017239582","spectrum_index":17058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 66.0461 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.283,"smiles":null,"spectrum_id":"CCMSLIB00017239584","spectrum_index":17059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 341.2844 Da; putative annotation: N/A; putative formula: C20H40NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.355,"smiles":null,"spectrum_id":"CCMSLIB00017239586","spectrum_index":17060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 18.0234 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.09,"smiles":null,"spectrum_id":"CCMSLIB00017239589","spectrum_index":17061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 412.2971 Da; putative annotation: N/A; putative formula: C27H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":917.473,"smiles":null,"spectrum_id":"CCMSLIB00017239591","spectrum_index":17062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7b,9-Dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl acetate (delta mass: 731.3369 Da; putative annotation: N/A; putative formula: C48H49N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1122.55,"smiles":null,"spectrum_id":"CCMSLIB00017239593","spectrum_index":17063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 220.1211 Da; putative annotation: N/A; putative formula: C12H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.26,"smiles":null,"spectrum_id":"CCMSLIB00017239596","spectrum_index":17064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(3-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]- (delta mass: 18.0074 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.2,"smiles":null,"spectrum_id":"CCMSLIB00017239597","spectrum_index":17065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 158.1058 Da; putative annotation: N/A; putative formula: C7H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.181,"smiles":null,"spectrum_id":"CCMSLIB00017239600","spectrum_index":17066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 161.1112 Da; putative annotation: N/A; putative formula: C5H15N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.207,"smiles":null,"spectrum_id":"CCMSLIB00017239601","spectrum_index":17067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 442.3132 Da; putative annotation: N/A; putative formula: C26H42N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.404,"smiles":null,"spectrum_id":"CCMSLIB00017239604","spectrum_index":17068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 4.0891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017239607","spectrum_index":17069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 35.0737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.202,"smiles":null,"spectrum_id":"CCMSLIB00017239608","spectrum_index":17070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 135.1504 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.247,"smiles":null,"spectrum_id":"CCMSLIB00017239610","spectrum_index":17071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 298.1418 Da; putative annotation: N/A; putative formula: C15H22O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.322,"smiles":null,"spectrum_id":"CCMSLIB00017239612","spectrum_index":17072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)piperazine (delta mass: 136.0633 Da; putative annotation: N/A; putative formula: C7H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.197,"smiles":null,"spectrum_id":"CCMSLIB00017239615","spectrum_index":17073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 64.0312 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.071,"smiles":null,"spectrum_id":"CCMSLIB00017239616","spectrum_index":17074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.195,"smiles":null,"spectrum_id":"CCMSLIB00017239619","spectrum_index":17075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 475.1797 Da; putative annotation: N/A; putative formula: C32H21N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.266,"smiles":null,"spectrum_id":"CCMSLIB00017239620","spectrum_index":17076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 184.0739 Da; putative annotation: N/A; putative formula: C9H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.189,"smiles":null,"spectrum_id":"CCMSLIB00017239623","spectrum_index":17077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300456 Emetine (delta mass: 123.0788 Da; putative annotation: N/A; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.385,"smiles":null,"spectrum_id":"CCMSLIB00017239624","spectrum_index":17078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 102.104 Da; putative annotation: N/A; putative formula: C2H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.165,"smiles":null,"spectrum_id":"CCMSLIB00017239627","spectrum_index":17079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; CorrDec (delta mass: 26.0271 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":112.087,"smiles":null,"spectrum_id":"CCMSLIB00017239628","spectrum_index":17080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 69.0427 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.212,"smiles":null,"spectrum_id":"CCMSLIB00017239631","spectrum_index":17081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bis(2-butoxyethyl) 3?-hydroxy-2-butoxyethyl phosphate (delta mass: 45.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.303,"smiles":null,"spectrum_id":"CCMSLIB00017239633","spectrum_index":17082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 313.2617 Da; putative annotation: N/A; putative formula: C18H35NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.348,"smiles":null,"spectrum_id":"CCMSLIB00017239635","spectrum_index":17083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 455.2256 Da; putative annotation: N/A; putative formula: C26H29N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.291,"smiles":null,"spectrum_id":"CCMSLIB00017239638","spectrum_index":17084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 44.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.133,"smiles":null,"spectrum_id":"CCMSLIB00017239640","spectrum_index":17085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 38.0512 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.106,"smiles":null,"spectrum_id":"CCMSLIB00017239642","spectrum_index":17086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methylphenyl)-2,3,4,9-tetrahydro-1H-.beta.-carboline (delta mass: 176.0611 Da; putative annotation: N/A; putative formula: C8H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.215,"smiles":null,"spectrum_id":"CCMSLIB00017239644","spectrum_index":17087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 130.1144 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017239647","spectrum_index":17088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-(2,3-Dihydroxypropoxy)-9-oxononanoic acid (delta mass: 185.1411 Da; putative annotation: N/A; putative formula: C10H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.29,"smiles":null,"spectrum_id":"CCMSLIB00017239649","spectrum_index":17089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 92.0621 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.31,"smiles":null,"spectrum_id":"CCMSLIB00017239651","spectrum_index":17090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 155.0933 Da; putative annotation: N/A; putative formula: C4H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.221,"smiles":null,"spectrum_id":"CCMSLIB00017239654","spectrum_index":17091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 132.9441 Da; putative annotation: N/A; putative formula: C2H-1NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.01,"smiles":null,"spectrum_id":"CCMSLIB00017239655","spectrum_index":17092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 30.0 eV (delta mass: 306.0944 Da; putative annotation: N/A; putative formula: C17H14N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.218,"smiles":null,"spectrum_id":"CCMSLIB00017239658","spectrum_index":17093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 43.9895 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.26,"smiles":null,"spectrum_id":"CCMSLIB00017239661","spectrum_index":17094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-8,11,14-Eicosatrienoic acid from NIST14 (delta mass: 68.0261 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.289,"smiles":null,"spectrum_id":"CCMSLIB00017239662","spectrum_index":17095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 111.0571 Da; putative annotation: N/A; putative formula: C3H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.186,"smiles":null,"spectrum_id":"CCMSLIB00017239665","spectrum_index":17096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 291.2307 Da; putative annotation: N/A; putative formula: C17H29N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.489,"smiles":null,"spectrum_id":"CCMSLIB00017239666","spectrum_index":17097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 42.1111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.159,"smiles":null,"spectrum_id":"CCMSLIB00017239669","spectrum_index":17098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Hydroxyphenethylamine (delta mass: 56.9087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017239670","spectrum_index":17099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 145.1101 Da; putative annotation: N/A; putative formula: C7H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.17,"smiles":null,"spectrum_id":"CCMSLIB00017239673","spectrum_index":17100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 133.9975 Da; putative annotation: N/A; putative formula: C3H-2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.271,"smiles":null,"spectrum_id":"CCMSLIB00017239676","spectrum_index":17101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 27.0473 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.18,"smiles":null,"spectrum_id":"CCMSLIB00017239677","spectrum_index":17102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 135.1257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.306,"smiles":null,"spectrum_id":"CCMSLIB00017239680","spectrum_index":17103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 545.3515 Da; putative annotation: N/A; putative formula: C28H47N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":734.5,"smiles":null,"spectrum_id":"CCMSLIB00017239683","spectrum_index":17104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Diaminonaphthalene (delta mass: 4.4083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017239684","spectrum_index":17105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Citronellol (delta mass: 180.0624 Da; putative annotation: N/A; putative formula: C10H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.221,"smiles":null,"spectrum_id":"CCMSLIB00017239687","spectrum_index":17106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 177.0606 Da; putative annotation: N/A; putative formula: C10H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.199,"smiles":null,"spectrum_id":"CCMSLIB00017239688","spectrum_index":17107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 157.0708 Da; putative annotation: N/A; putative formula: C3H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.136,"smiles":null,"spectrum_id":"CCMSLIB00017239691","spectrum_index":17108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 206.1309 Da; putative annotation: N/A; putative formula: C13H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.212,"smiles":null,"spectrum_id":"CCMSLIB00017239694","spectrum_index":17109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 56.0692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017239696","spectrum_index":17110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 528.1696 Da; putative annotation: N/A; putative formula: C34H28N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.23,"smiles":null,"spectrum_id":"CCMSLIB00017239698","spectrum_index":17111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 247.1039 Da; putative annotation: N/A; putative formula: C14H19NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.227,"smiles":null,"spectrum_id":"CCMSLIB00017239700","spectrum_index":17112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 351.2614 Da; putative annotation: N/A; putative formula: C21H37NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.326,"smiles":null,"spectrum_id":"CCMSLIB00017239702","spectrum_index":17113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347544-02!4-hydroxy-3-[(E)-7-hydroxy-3,7-dimethyl-4-oxooct-5-enyl]-5-(3-methylbut-2-enyl)benzoic acid (delta mass: 78.0173 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.234,"smiles":null,"spectrum_id":"CCMSLIB00017239705","spectrum_index":17114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-2-carboxylic acid (delta mass: 108.0585 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.092,"smiles":null,"spectrum_id":"CCMSLIB00017239707","spectrum_index":17115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 238.2296 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.379,"smiles":null,"spectrum_id":"CCMSLIB00017239709","spectrum_index":17116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 73.0259 Da; putative annotation: N/A; putative formula: CH3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.081,"smiles":null,"spectrum_id":"CCMSLIB00017239711","spectrum_index":17117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroxy-5Z,8Z,11Z,13E,17Z-eicosapentaenoic acid (delta mass: 19.014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.241,"smiles":null,"spectrum_id":"CCMSLIB00017239714","spectrum_index":17118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 77.0839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.295,"smiles":null,"spectrum_id":"CCMSLIB00017239716","spectrum_index":17119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 168.0832 Da; putative annotation: N/A; putative formula: C7H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.18,"smiles":null,"spectrum_id":"CCMSLIB00017239718","spectrum_index":17120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 13.4188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.5,"smiles":null,"spectrum_id":"CCMSLIB00017239721","spectrum_index":17121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 293.0489 Da; putative annotation: N/A; putative formula: C10H16NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.11,"smiles":null,"spectrum_id":"CCMSLIB00017239723","spectrum_index":17122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 278.0961 Da; putative annotation: N/A; putative formula: C19H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.178,"smiles":null,"spectrum_id":"CCMSLIB00017239725","spectrum_index":17123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 886.4558 Da; putative annotation: N/A; putative formula: C42H66N10O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1049.52,"smiles":null,"spectrum_id":"CCMSLIB00017239728","spectrum_index":17124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-[5-Hydroxy-6-(2-hydroxypropan-2-yl)oxan-3-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one (delta mass: 138.0886 Da; putative annotation: N/A; putative formula: C9H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.451,"smiles":null,"spectrum_id":"CCMSLIB00017239730","spectrum_index":17125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 136.0161 Da; putative annotation: N/A; putative formula: C7H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.055,"smiles":null,"spectrum_id":"CCMSLIB00017239732","spectrum_index":17126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (.+/-.)-8-Hydroxy-5Z,9E,11Z,14Z,17Z-eicosapentaenoic acid from NIST14 (delta mass: 17.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.253,"smiles":null,"spectrum_id":"CCMSLIB00017239734","spectrum_index":17127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304070 Indole-3-acetyl-L-valine (delta mass: 502.293 Da; putative annotation: N/A; putative formula: C29H42O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":777.432,"smiles":null,"spectrum_id":"CCMSLIB00017239737","spectrum_index":17128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-3-hydroxy-3-(2-pyridinylmethyl)-1,3-dihydro-2H-indol-2-one (delta mass: 22.1155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.123,"smiles":null,"spectrum_id":"CCMSLIB00017239739","spectrum_index":17129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002984 Fraxidin|8-hydroxy-6,7-dimethoxychromen-2-one (delta mass: 16.0299 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.09,"smiles":null,"spectrum_id":"CCMSLIB00017239742","spectrum_index":17130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 172.0737 Da; putative annotation: N/A; putative formula: C8H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.133,"smiles":null,"spectrum_id":"CCMSLIB00017239743","spectrum_index":17131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 55.0417 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.139,"smiles":null,"spectrum_id":"CCMSLIB00017239746","spectrum_index":17132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(1H-Indol-3-yl)ethyl]propanamide (delta mass: 43.0059 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.139,"smiles":null,"spectrum_id":"CCMSLIB00017239747","spectrum_index":17133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 110.0749 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.135,"smiles":null,"spectrum_id":"CCMSLIB00017239750","spectrum_index":17134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 215.2316 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.438,"smiles":null,"spectrum_id":"CCMSLIB00017239752","spectrum_index":17135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 104.0475 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.149,"smiles":null,"spectrum_id":"CCMSLIB00017239754","spectrum_index":17136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 131.0946 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.176,"smiles":null,"spectrum_id":"CCMSLIB00017239757","spectrum_index":17137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 188.1932 Da; putative annotation: N/A; putative formula: C15H24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.399,"smiles":null,"spectrum_id":"CCMSLIB00017239759","spectrum_index":17138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid (delta mass: 89.0846 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.348,"smiles":null,"spectrum_id":"CCMSLIB00017239761","spectrum_index":17139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 523.2999 Da; putative annotation: N/A; putative formula: C35H42NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":858.558,"smiles":null,"spectrum_id":"CCMSLIB00017239764","spectrum_index":17140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxylic acid CollisionEnergy:205060 (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.066,"smiles":null,"spectrum_id":"CCMSLIB00017239766","spectrum_index":17141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 196.2006 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.248,"smiles":null,"spectrum_id":"CCMSLIB00017239768","spectrum_index":17142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 100.0734 Da; putative annotation: N/A; putative formula: C3H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.369,"smiles":null,"spectrum_id":"CCMSLIB00017239770","spectrum_index":17143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 229.0875 Da; putative annotation: N/A; putative formula: C11H12N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.142,"smiles":null,"spectrum_id":"CCMSLIB00017239772","spectrum_index":17144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uzarigenin (delta mass: 108.0938 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.347,"smiles":null,"spectrum_id":"CCMSLIB00017239774","spectrum_index":17145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 52.0688 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.123,"smiles":null,"spectrum_id":"CCMSLIB00017239777","spectrum_index":17146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 630.2005 Da; putative annotation: N/A; putative formula: C30H38N4O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.324,"smiles":null,"spectrum_id":"CCMSLIB00017239778","spectrum_index":17147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 282.0471 Da; putative annotation: N/A; putative formula: C8H10N8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.107,"smiles":null,"spectrum_id":"CCMSLIB00017239781","spectrum_index":17148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 178.1569 Da; putative annotation: N/A; putative formula: C10H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.228,"smiles":null,"spectrum_id":"CCMSLIB00017239783","spectrum_index":17149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1,3-dimethyl-1H-pyrazole-4-carbonitrile (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.093,"smiles":null,"spectrum_id":"CCMSLIB00017239785","spectrum_index":17150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 295.2513 Da; putative annotation: N/A; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.478,"smiles":null,"spectrum_id":"CCMSLIB00017239788","spectrum_index":17151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethyl L-glutamate (delta mass: 210.1978 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.321,"smiles":null,"spectrum_id":"CCMSLIB00017239789","spectrum_index":17152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 340.1749 Da; putative annotation: N/A; putative formula: C15H24N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.256,"smiles":null,"spectrum_id":"CCMSLIB00017239792","spectrum_index":17153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin C (delta mass: 496.3035 Da; putative annotation: N/A; putative formula: C27H44O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.483,"smiles":null,"spectrum_id":"CCMSLIB00017239794","spectrum_index":17154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 771.3792 Da; putative annotation: N/A; putative formula: C50H45N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":993.476,"smiles":null,"spectrum_id":"CCMSLIB00017239797","spectrum_index":17155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid (delta mass: 74.0518 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.404,"smiles":null,"spectrum_id":"CCMSLIB00017239799","spectrum_index":17156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 145.0836 Da; putative annotation: N/A; putative formula: C5H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.222,"smiles":null,"spectrum_id":"CCMSLIB00017239801","spectrum_index":17157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 33.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.279,"smiles":null,"spectrum_id":"CCMSLIB00017239803","spectrum_index":17158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 330.2903 Da; putative annotation: N/A; putative formula: C19H34N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.361,"smiles":null,"spectrum_id":"CCMSLIB00017239805","spectrum_index":17159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (((3a,7a)-3,7-trihydroxy-24-oxocholan-22-en-24-yl)amino)ethanesulfonic acid (delta mass: 148.1273 Da; putative annotation: N/A; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.416,"smiles":null,"spectrum_id":"CCMSLIB00017239807","spectrum_index":17160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,9.beta.,10.alpha.)-3-Hydroxypregna-5,7-dien-20-one (delta mass: 229.0797 Da; putative annotation: N/A; putative formula: C9H16N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.312,"smiles":null,"spectrum_id":"CCMSLIB00017239810","spectrum_index":17161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 128.063 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.149,"smiles":null,"spectrum_id":"CCMSLIB00017239812","spectrum_index":17162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 65.0266 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.087,"smiles":null,"spectrum_id":"CCMSLIB00017239815","spectrum_index":17163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 63.998 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.246,"smiles":null,"spectrum_id":"CCMSLIB00017239816","spectrum_index":17164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decoyinine (delta mass: 58.0465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.151,"smiles":null,"spectrum_id":"CCMSLIB00017239819","spectrum_index":17165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methylbenzyl)pyrrolidine (delta mass: 212.1412 Da; putative annotation: N/A; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.285,"smiles":null,"spectrum_id":"CCMSLIB00017239820","spectrum_index":17166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 7-Hydroxychromanone from NIST14 (delta mass: 153.0434 Da; putative annotation: N/A; putative formula: C8H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.098,"smiles":null,"spectrum_id":"CCMSLIB00017239823","spectrum_index":17167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phthalic acid (delta mass: 10.0661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017239824","spectrum_index":17168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 114.0833 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.326,"smiles":null,"spectrum_id":"CCMSLIB00017239827","spectrum_index":17169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-3-yl)propanenitrile (delta mass: 41.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.124,"smiles":null,"spectrum_id":"CCMSLIB00017239830","spectrum_index":17170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 92.0586 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017239831","spectrum_index":17171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 23.9886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017239834","spectrum_index":17172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Erythrodiol (delta mass: 23.0136 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.402,"smiles":null,"spectrum_id":"CCMSLIB00017239835","spectrum_index":17173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 137.9978 Da; putative annotation: N/A; putative formula: C5H3N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.074,"smiles":null,"spectrum_id":"CCMSLIB00017239838","spectrum_index":17174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-17-ol-3,20-dione (delta mass: 90.083 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.325,"smiles":null,"spectrum_id":"CCMSLIB00017239839","spectrum_index":17175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 2.0555 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.131,"smiles":null,"spectrum_id":"CCMSLIB00017239842","spectrum_index":17176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleana-1,9(11)-dien-28-oic acid, 2-cyano-3,12-dioxo- (delta mass: 62.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.368,"smiles":null,"spectrum_id":"CCMSLIB00017239844","spectrum_index":17177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alisol B acetate (delta mass: 461.3005 Da; putative annotation: N/A; putative formula: C24H39N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":976.674,"smiles":null,"spectrum_id":"CCMSLIB00017239846","spectrum_index":17178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 15.995 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.081,"smiles":null,"spectrum_id":"CCMSLIB00017239849","spectrum_index":17179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 54.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.086,"smiles":null,"spectrum_id":"CCMSLIB00017239850","spectrum_index":17180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 70.0086 Da; putative annotation: N/A; putative formula: C2H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.075,"smiles":null,"spectrum_id":"CCMSLIB00017239853","spectrum_index":17181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 148.0162 Da; putative annotation: N/A; putative formula: C8H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.045,"smiles":null,"spectrum_id":"CCMSLIB00017239854","spectrum_index":17182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 50.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.275,"smiles":null,"spectrum_id":"CCMSLIB00017239857","spectrum_index":17183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 100.0233 Da; putative annotation: N/A; putative formula: C2H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.11,"smiles":null,"spectrum_id":"CCMSLIB00017239859","spectrum_index":17184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 52.0301 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.132,"smiles":null,"spectrum_id":"CCMSLIB00017239861","spectrum_index":17185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 55.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.138,"smiles":null,"spectrum_id":"CCMSLIB00017239864","spectrum_index":17186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 30.0105 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.049,"smiles":null,"spectrum_id":"CCMSLIB00017239865","spectrum_index":17187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,7-dihydroxymellein_130075\"\" (delta mass: 176.0694 Da; putative annotation: N/A; putative formula: C8H16S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.129,"smiles":null,"spectrum_id":"CCMSLIB00017239868","spectrum_index":17188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of agmatine - 40.0 eV (delta mass: 41.9981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.127,"smiles":null,"spectrum_id":"CCMSLIB00017239870","spectrum_index":17189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacetic acid (delta mass: 54.0116 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.082,"smiles":null,"spectrum_id":"CCMSLIB00017239873","spectrum_index":17190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.beta.-Homomethionine (delta mass: 71.0375 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.111,"smiles":null,"spectrum_id":"CCMSLIB00017239875","spectrum_index":17191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 44.0647 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.145,"smiles":null,"spectrum_id":"CCMSLIB00017239877","spectrum_index":17192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(cyclohexylmethyl)- (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.155,"smiles":null,"spectrum_id":"CCMSLIB00017239880","spectrum_index":17193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Methoxyphenyl)acetic acid (delta mass: 12.0003 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.071,"smiles":null,"spectrum_id":"CCMSLIB00017239881","spectrum_index":17194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 36.0352 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.526,"smiles":null,"spectrum_id":"CCMSLIB00017239884","spectrum_index":17195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Piperidin-3-yl)methanesulfonamide (delta mass: 18.0166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.102,"smiles":null,"spectrum_id":"CCMSLIB00017239886","spectrum_index":17196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 1.9972 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.03,"smiles":null,"spectrum_id":"CCMSLIB00017239888","spectrum_index":17197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 11.137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.323,"smiles":null,"spectrum_id":"CCMSLIB00017239891","spectrum_index":17198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Acetaminobenzoic acid (delta mass: 28.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017239892","spectrum_index":17199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Isolongifolol (delta mass: 79.0634 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.269,"smiles":null,"spectrum_id":"CCMSLIB00017239895","spectrum_index":17200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 270.0029 Da; putative annotation: N/A; putative formula: C12H14O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.142,"smiles":null,"spectrum_id":"CCMSLIB00017239896","spectrum_index":17201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 23.0019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.041,"smiles":null,"spectrum_id":"CCMSLIB00017239899","spectrum_index":17202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 196.7886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.849,"smiles":null,"spectrum_id":"CCMSLIB00017239901","spectrum_index":17203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 301.7647 Da; putative annotation: N/A; putative formula: CH2S9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.836,"smiles":null,"spectrum_id":"CCMSLIB00017239903","spectrum_index":17204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 94.0416 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.263,"smiles":null,"spectrum_id":"CCMSLIB00017239906","spectrum_index":17205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cellobiose (D[+]) (delta mass: 448.2431 Da; putative annotation: N/A; putative formula: C31H33N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.367,"smiles":null,"spectrum_id":"CCMSLIB00017239908","spectrum_index":17206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 130.1727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.222,"smiles":null,"spectrum_id":"CCMSLIB00017239910","spectrum_index":17207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-O-(Phenylacetyl)-.beta.-D-glucopyranose (delta mass: 17.0271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.14,"smiles":null,"spectrum_id":"CCMSLIB00017239912","spectrum_index":17208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 74.005 Da; putative annotation: N/A; putative formula: CH3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.102,"smiles":null,"spectrum_id":"CCMSLIB00017239914","spectrum_index":17209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 167.0807 Da; putative annotation: N/A; putative formula: C6H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.448,"smiles":null,"spectrum_id":"CCMSLIB00017239916","spectrum_index":17210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoleoyl-sn-glycero-3-phosphoethanolamine (delta mass: 64.0682 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.559,"smiles":null,"spectrum_id":"CCMSLIB00017239919","spectrum_index":17211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 256.1801 Da; putative annotation: N/A; putative formula: C18H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.266,"smiles":null,"spectrum_id":"CCMSLIB00017239920","spectrum_index":17212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 285.1362 Da; putative annotation: N/A; putative formula: C17H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.217,"smiles":null,"spectrum_id":"CCMSLIB00017239923","spectrum_index":17213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 90.0823 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.325,"smiles":null,"spectrum_id":"CCMSLIB00017239924","spectrum_index":17214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grandiflorenic acid (delta mass: 571.3361 Da; putative annotation: N/A; putative formula: C29H49NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.552,"smiles":null,"spectrum_id":"CCMSLIB00017239927","spectrum_index":17215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 103.0092 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.178,"smiles":null,"spectrum_id":"CCMSLIB00017239929","spectrum_index":17216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 12.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.158,"smiles":null,"spectrum_id":"CCMSLIB00017239931","spectrum_index":17217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 36.0277 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017239933","spectrum_index":17218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 26.0488 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.144,"smiles":null,"spectrum_id":"CCMSLIB00017239935","spectrum_index":17219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 384.1944 Da; putative annotation: N/A; putative formula: C16H28N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.255,"smiles":null,"spectrum_id":"CCMSLIB00017239937","spectrum_index":17220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 388.1161 Da; putative annotation: N/A; putative formula: C13H28N2O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.166,"smiles":null,"spectrum_id":"CCMSLIB00017239939","spectrum_index":17221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylvanillin (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017239942","spectrum_index":17222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 98.0366 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.138,"smiles":null,"spectrum_id":"CCMSLIB00017239943","spectrum_index":17223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methylphenyl)azepane (delta mass: 159.0568 Da; putative annotation: N/A; putative formula: C5H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.216,"smiles":null,"spectrum_id":"CCMSLIB00017239946","spectrum_index":17224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 280.1676 Da; putative annotation: N/A; putative formula: C16H24O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.254,"smiles":null,"spectrum_id":"CCMSLIB00017239948","spectrum_index":17225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophan butyl ester (delta mass: 113.0834 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.243,"smiles":null,"spectrum_id":"CCMSLIB00017239950","spectrum_index":17226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 79.9895 Da; putative annotation: N/A; putative formula: C4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.039,"smiles":null,"spectrum_id":"CCMSLIB00017239953","spectrum_index":17227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 96.983 Da; putative annotation: N/A; putative formula: C2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.158,"smiles":null,"spectrum_id":"CCMSLIB00017239955","spectrum_index":17228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 84.0574 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.285,"smiles":null,"spectrum_id":"CCMSLIB00017239957","spectrum_index":17229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 48.0219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.108,"smiles":null,"spectrum_id":"CCMSLIB00017239959","spectrum_index":17230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 82.5264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.598,"smiles":null,"spectrum_id":"CCMSLIB00017239961","spectrum_index":17231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 987.5042 Da; putative annotation: N/A; putative formula: C54H69N9O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1194.59,"smiles":null,"spectrum_id":"CCMSLIB00017239963","spectrum_index":17232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 33.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017239965","spectrum_index":17233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ribitol (delta mass: 98.1106 Da; putative annotation: N/A; putative formula: C7H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.186,"smiles":null,"spectrum_id":"CCMSLIB00017239968","spectrum_index":17234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU035602 Ethirimol|5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one (delta mass: 71.1113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.271,"smiles":null,"spectrum_id":"CCMSLIB00017239969","spectrum_index":17235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Dehydroshikimic acid (delta mass: 196.0945 Da; putative annotation: N/A; putative formula: C11H18O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.139,"smiles":null,"spectrum_id":"CCMSLIB00017239972","spectrum_index":17236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 152.099 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017239973","spectrum_index":17237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 211.07 Da; putative annotation: N/A; putative formula: C9H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.161,"smiles":null,"spectrum_id":"CCMSLIB00017239976","spectrum_index":17238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 158.1037 Da; putative annotation: N/A; putative formula: C7H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.19,"smiles":null,"spectrum_id":"CCMSLIB00017239977","spectrum_index":17239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decahydronaphthalene-2-carboxylic acid (delta mass: 45.0214 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.159,"smiles":null,"spectrum_id":"CCMSLIB00017239980","spectrum_index":17240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Mercaptobenzoic acid (delta mass: 14.964 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.98,"smiles":null,"spectrum_id":"CCMSLIB00017239981","spectrum_index":17241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 334.191 Da; putative annotation: N/A; putative formula: C16H31O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.298,"smiles":null,"spectrum_id":"CCMSLIB00017239983","spectrum_index":17242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 36.0361 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.237,"smiles":null,"spectrum_id":"CCMSLIB00017239985","spectrum_index":17243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 90.0499 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.282,"smiles":null,"spectrum_id":"CCMSLIB00017239987","spectrum_index":17244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 54.0468 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.331,"smiles":null,"spectrum_id":"CCMSLIB00017239989","spectrum_index":17245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetinic acid (delta mass: 154.1204 Da; putative annotation: N/A; putative formula: C7H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.467,"smiles":null,"spectrum_id":"CCMSLIB00017239992","spectrum_index":17246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 16.9365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.174,"smiles":null,"spectrum_id":"CCMSLIB00017239993","spectrum_index":17247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 85.0542 Da; putative annotation: N/A; putative formula: C4H7NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.124,"smiles":null,"spectrum_id":"CCMSLIB00017239996","spectrum_index":17248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 45.0603 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.246,"smiles":null,"spectrum_id":"CCMSLIB00017239997","spectrum_index":17249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 212.9408 Da; putative annotation: N/A; putative formula: C4H7NOS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.195,"smiles":null,"spectrum_id":"CCMSLIB00017240000","spectrum_index":17250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5,9-trihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one (delta mass: 122.1093 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.263,"smiles":null,"spectrum_id":"CCMSLIB00017240003","spectrum_index":17251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Azaindole (delta mass: 54.9947 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.055,"smiles":null,"spectrum_id":"CCMSLIB00017240004","spectrum_index":17252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311082 Dicoumaroyl Spermidine (delta mass: 191.0931 Da; putative annotation: N/A; putative formula: C7H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.332,"smiles":null,"spectrum_id":"CCMSLIB00017240007","spectrum_index":17253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 28.0786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.18,"smiles":null,"spectrum_id":"CCMSLIB00017240008","spectrum_index":17254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 59.0833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.159,"smiles":null,"spectrum_id":"CCMSLIB00017240011","spectrum_index":17255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 129.0465 Da; putative annotation: N/A; putative formula: C3H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.17,"smiles":null,"spectrum_id":"CCMSLIB00017240012","spectrum_index":17256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 110.0912 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.15,"smiles":null,"spectrum_id":"CCMSLIB00017240015","spectrum_index":17257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-phenyl-1H-1,2,3-triazole-4-carboxamide (delta mass: 49.0088 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.097,"smiles":null,"spectrum_id":"CCMSLIB00017240016","spectrum_index":17258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 66.0467 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.273,"smiles":null,"spectrum_id":"CCMSLIB00017240019","spectrum_index":17259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 489.3306 Da; putative annotation: N/A; putative formula: C25H47NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":742.547,"smiles":null,"spectrum_id":"CCMSLIB00017240021","spectrum_index":17260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Dec-9-enylpentanedioic acid (delta mass: 52.0312 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017240024","spectrum_index":17261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxy-2-decenoic acid (delta mass: 135.035 Da; putative annotation: N/A; putative formula: C6H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.168,"smiles":null,"spectrum_id":"CCMSLIB00017240026","spectrum_index":17262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.beta.-Leucine (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.113,"smiles":null,"spectrum_id":"CCMSLIB00017240029","spectrum_index":17263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 79.9664 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.003,"smiles":null,"spectrum_id":"CCMSLIB00017240030","spectrum_index":17264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 257.1999 Da; putative annotation: N/A; putative formula: C15H23N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.442,"smiles":null,"spectrum_id":"CCMSLIB00017240033","spectrum_index":17265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-3,4-dihydro-1(2H)-naphthalenone (delta mass: 396.2366 Da; putative annotation: N/A; putative formula: C29H33O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.312,"smiles":null,"spectrum_id":"CCMSLIB00017240034","spectrum_index":17266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[17.3.2.0<1,18>.0<4,17>.0<5,14>.0< 8,13>]tetracosan-10-ol CollisionEnergy:205060\"\" (delta mass: 176.1554 Da; putative annotation: N/A; putative formula: C13H20)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.544,"smiles":null,"spectrum_id":"CCMSLIB00017240037","spectrum_index":17267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 218.2731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.349,"smiles":null,"spectrum_id":"CCMSLIB00017240039","spectrum_index":17268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S-Hydroxy-9E,11Z,14Z-eicosatrienoic acid (delta mass: 62.0515 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017240041","spectrum_index":17269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 55.0809 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.24,"smiles":null,"spectrum_id":"CCMSLIB00017240044","spectrum_index":17270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 43.0309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.122,"smiles":null,"spectrum_id":"CCMSLIB00017240045","spectrum_index":17271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 180.0569 Da; putative annotation: N/A; putative formula: C5H12N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.185,"smiles":null,"spectrum_id":"CCMSLIB00017240048","spectrum_index":17272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 252.0755 Da; putative annotation: N/A; putative formula: C12H16N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.116,"smiles":null,"spectrum_id":"CCMSLIB00017240050","spectrum_index":17273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 258.2694 Da; putative annotation: N/A; putative formula: C20H34O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.402,"smiles":null,"spectrum_id":"CCMSLIB00017240052","spectrum_index":17274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 102.0853 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.33,"smiles":null,"spectrum_id":"CCMSLIB00017240053","spectrum_index":17275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 138.1023 Da; putative annotation: N/A; putative formula: C5H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.143,"smiles":null,"spectrum_id":"CCMSLIB00017240056","spectrum_index":17276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.145,"smiles":null,"spectrum_id":"CCMSLIB00017240058","spectrum_index":17277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Obeticholic_Acid_NCE45 (delta mass: 104.1001 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.431,"smiles":null,"spectrum_id":"CCMSLIB00017240060","spectrum_index":17278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 17.0881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.191,"smiles":null,"spectrum_id":"CCMSLIB00017240063","spectrum_index":17279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ketoprostaglandin F2.alpha. (delta mass: 17.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017240064","spectrum_index":17280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 403.2304 Da; putative annotation: N/A; putative formula: C30H29N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.271,"smiles":null,"spectrum_id":"CCMSLIB00017240067","spectrum_index":17281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 497.2176 Da; putative annotation: N/A; putative formula: C27H27N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.309,"smiles":null,"spectrum_id":"CCMSLIB00017240068","spectrum_index":17282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 74.0364 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017240071","spectrum_index":17283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 193.1319 Da; putative annotation: N/A; putative formula: C9H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.197,"smiles":null,"spectrum_id":"CCMSLIB00017240072","spectrum_index":17284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 198.1012 Da; putative annotation: N/A; putative formula: C10H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.182,"smiles":null,"spectrum_id":"CCMSLIB00017240075","spectrum_index":17285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 217.2035 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.269,"smiles":null,"spectrum_id":"CCMSLIB00017240076","spectrum_index":17286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 229.2043 Da; putative annotation: N/A; putative formula: C13H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.462,"smiles":null,"spectrum_id":"CCMSLIB00017240079","spectrum_index":17287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 90.0582 Da; putative annotation: N/A; putative formula: C6H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.118,"smiles":null,"spectrum_id":"CCMSLIB00017240080","spectrum_index":17288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 417.1725 Da; putative annotation: N/A; putative formula: C15H30N7OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.274,"smiles":null,"spectrum_id":"CCMSLIB00017240083","spectrum_index":17289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 662.1278 Da; putative annotation: N/A; putative formula: C34H30O10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.241,"smiles":null,"spectrum_id":"CCMSLIB00017240085","spectrum_index":17290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[1,3-Dimethyl-2-oxo-6-(1-pyrrolidinyl)-2,3-dihydro-1H-benzimidazol-5-yl]-2-methoxybenzamide (delta mass: 186.1329 Da; putative annotation: N/A; putative formula: C5H14N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.325,"smiles":null,"spectrum_id":"CCMSLIB00017240087","spectrum_index":17291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 114.0835 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.279,"smiles":null,"spectrum_id":"CCMSLIB00017240089","spectrum_index":17292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 79.9665 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.198,"smiles":null,"spectrum_id":"CCMSLIB00017240091","spectrum_index":17293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 235.1423 Da; putative annotation: N/A; putative formula: C10H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.259,"smiles":null,"spectrum_id":"CCMSLIB00017240094","spectrum_index":17294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 277.1891 Da; putative annotation: N/A; putative formula: C13H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.332,"smiles":null,"spectrum_id":"CCMSLIB00017240096","spectrum_index":17295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norharmane (delta mass: 14.0275 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.104,"smiles":null,"spectrum_id":"CCMSLIB00017240098","spectrum_index":17296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 237.1578 Da; putative annotation: N/A; putative formula: C11H19N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.306,"smiles":null,"spectrum_id":"CCMSLIB00017240101","spectrum_index":17297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 42.9814 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.099,"smiles":null,"spectrum_id":"CCMSLIB00017240102","spectrum_index":17298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 65.0268 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.264,"smiles":null,"spectrum_id":"CCMSLIB00017240105","spectrum_index":17299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Val (delta mass: 101.0473 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.181,"smiles":null,"spectrum_id":"CCMSLIB00017240106","spectrum_index":17300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 74.0518 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017240109","spectrum_index":17301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 10.0782 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.113,"smiles":null,"spectrum_id":"CCMSLIB00017240110","spectrum_index":17302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 247.142 Da; putative annotation: N/A; putative formula: C11H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.202,"smiles":null,"spectrum_id":"CCMSLIB00017240113","spectrum_index":17303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ellagic acid (delta mass: 496.0851 Da; putative annotation: N/A; putative formula: C27H20N4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.099,"smiles":null,"spectrum_id":"CCMSLIB00017240114","spectrum_index":17304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 63.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.176,"smiles":null,"spectrum_id":"CCMSLIB00017240116","spectrum_index":17305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Pro (delta mass: 71.0378 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.193,"smiles":null,"spectrum_id":"CCMSLIB00017240118","spectrum_index":17306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 120.0576 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017240120","spectrum_index":17307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dihydroxy-5a-methyl-3-methylidene-2-oxo-4,5,6,7,8,9,9a,9b-octahydro-3aH-benzo[g][1]benzofuran-9-carbaldehyde (delta mass: 77.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.186,"smiles":null,"spectrum_id":"CCMSLIB00017240122","spectrum_index":17308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 236.0663 Da; putative annotation: N/A; putative formula: C16H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.147,"smiles":null,"spectrum_id":"CCMSLIB00017240124","spectrum_index":17309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 294.2561 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.297,"smiles":null,"spectrum_id":"CCMSLIB00017240126","spectrum_index":17310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butaprost (free acid) (delta mass: 66.046 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.325,"smiles":null,"spectrum_id":"CCMSLIB00017240128","spectrum_index":17311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Makisterone A (delta mass: 102.0819 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.414,"smiles":null,"spectrum_id":"CCMSLIB00017240130","spectrum_index":17312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 45.1769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.263,"smiles":null,"spectrum_id":"CCMSLIB00017240132","spectrum_index":17313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE - 70.0 eV (delta mass: 30.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.091,"smiles":null,"spectrum_id":"CCMSLIB00017240134","spectrum_index":17314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 598.2784 Da; putative annotation: N/A; putative formula: C25H48N2O10P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1094.62,"smiles":null,"spectrum_id":"CCMSLIB00017240136","spectrum_index":17315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-sitosterol (delta mass: 246.1131 Da; putative annotation: N/A; putative formula: C10H19N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.506,"smiles":null,"spectrum_id":"CCMSLIB00017240138","spectrum_index":17316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 114.0681 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017240140","spectrum_index":17317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 118.0741 Da; putative annotation: N/A; putative formula: C4H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017240142","spectrum_index":17318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 90.0317 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017240144","spectrum_index":17319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 24.0105 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.061,"smiles":null,"spectrum_id":"CCMSLIB00017240146","spectrum_index":17320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazole (delta mass: 55.0662 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.111,"smiles":null,"spectrum_id":"CCMSLIB00017240148","spectrum_index":17321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyvalproic acid (delta mass: 196.9989 Da; putative annotation: N/A; putative formula: C6H4N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.116,"smiles":null,"spectrum_id":"CCMSLIB00017240150","spectrum_index":17322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 280.1393 Da; putative annotation: N/A; putative formula: C10H16N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.19,"smiles":null,"spectrum_id":"CCMSLIB00017240152","spectrum_index":17323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorobenzyl)piperidine (delta mass: 17.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.144,"smiles":null,"spectrum_id":"CCMSLIB00017240154","spectrum_index":17324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 43.0181 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.25,"smiles":null,"spectrum_id":"CCMSLIB00017240156","spectrum_index":17325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7-Triazacyclononane (delta mass: 143.1055 Da; putative annotation: N/A; putative formula: C6H13N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.239,"smiles":null,"spectrum_id":"CCMSLIB00017240159","spectrum_index":17326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Met-C4:0 (delta mass: 48.0002 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.1,"smiles":null,"spectrum_id":"CCMSLIB00017240160","spectrum_index":17327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 433.258 Da; putative annotation: N/A; putative formula: C23H35N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.521,"smiles":null,"spectrum_id":"CCMSLIB00017240163","spectrum_index":17328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 278.2331 Da; putative annotation: N/A; putative formula: C13H26N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.47,"smiles":null,"spectrum_id":"CCMSLIB00017240164","spectrum_index":17329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Morpholinyl)-1-phenylethanol (delta mass: 24.0353 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.169,"smiles":null,"spectrum_id":"CCMSLIB00017240167","spectrum_index":17330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19,20-Dihydroxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 78.0468 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017240169","spectrum_index":17331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methoxybenzaldehyde (delta mass: 64.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.106,"smiles":null,"spectrum_id":"CCMSLIB00017240171","spectrum_index":17332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.beta.-Homomethionine (delta mass: 129.043 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.117,"smiles":null,"spectrum_id":"CCMSLIB00017240173","spectrum_index":17333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asperlactone (delta mass: 46.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.122,"smiles":null,"spectrum_id":"CCMSLIB00017240176","spectrum_index":17334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol - 30.0 eV (delta mass: 101.0478 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.207,"smiles":null,"spectrum_id":"CCMSLIB00017240177","spectrum_index":17335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Isopentyloxy)benzoic acid (delta mass: 88.0154 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017240180","spectrum_index":17336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.159,"smiles":null,"spectrum_id":"CCMSLIB00017240181","spectrum_index":17337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 99.1048 Da; putative annotation: N/A; putative formula: C6H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.165,"smiles":null,"spectrum_id":"CCMSLIB00017240183","spectrum_index":17338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 421.2824 Da; putative annotation: N/A; putative formula: C24H39NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.49,"smiles":null,"spectrum_id":"CCMSLIB00017240185","spectrum_index":17339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Ketodeoxycholic acid (delta mass: 60.0363 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017240187","spectrum_index":17340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D3 (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.388,"smiles":null,"spectrum_id":"CCMSLIB00017240189","spectrum_index":17341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydroxy-2-naphthoic acid (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.076,"smiles":null,"spectrum_id":"CCMSLIB00017240192","spectrum_index":17342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 128.058 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.129,"smiles":null,"spectrum_id":"CCMSLIB00017240193","spectrum_index":17343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 65.0108 Da; putative annotation: N/A; putative formula: CH-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.233,"smiles":null,"spectrum_id":"CCMSLIB00017240195","spectrum_index":17344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine 5'-triphosphate (delta mass: 96.0213 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.024,"smiles":null,"spectrum_id":"CCMSLIB00017240197","spectrum_index":17345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 32.0993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.228,"smiles":null,"spectrum_id":"CCMSLIB00017240199","spectrum_index":17346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 114.0314 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.097,"smiles":null,"spectrum_id":"CCMSLIB00017240201","spectrum_index":17347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Dimethylamino)propanol (delta mass: 154.0032 Da; putative annotation: N/A; putative formula: C3H7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.11,"smiles":null,"spectrum_id":"CCMSLIB00017240203","spectrum_index":17348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)propanamide (delta mass: 27.0349 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.168,"smiles":null,"spectrum_id":"CCMSLIB00017240205","spectrum_index":17349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 31.0663 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.122,"smiles":null,"spectrum_id":"CCMSLIB00017240208","spectrum_index":17350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 189.0342 Da; putative annotation: N/A; putative formula: C10H8NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.167,"smiles":null,"spectrum_id":"CCMSLIB00017240209","spectrum_index":17351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 104.0628 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.3,"smiles":null,"spectrum_id":"CCMSLIB00017240211","spectrum_index":17352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 71.0569 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.268,"smiles":null,"spectrum_id":"CCMSLIB00017240213","spectrum_index":17353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 91.0286 Da; putative annotation: N/A; putative formula: C3HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.14,"smiles":null,"spectrum_id":"CCMSLIB00017240215","spectrum_index":17354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 87.0317 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.201,"smiles":null,"spectrum_id":"CCMSLIB00017240217","spectrum_index":17355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 16.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.159,"smiles":null,"spectrum_id":"CCMSLIB00017240220","spectrum_index":17356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 147.0527 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.16,"smiles":null,"spectrum_id":"CCMSLIB00017240221","spectrum_index":17357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 270.0489 Da; putative annotation: N/A; putative formula: C10H10N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.109,"smiles":null,"spectrum_id":"CCMSLIB00017240224","spectrum_index":17358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 197.0684 Da; putative annotation: N/A; putative formula: C9H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.144,"smiles":null,"spectrum_id":"CCMSLIB00017240225","spectrum_index":17359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169534-02_C14H18O9_Ethanone, 1-[4-(beta-D-glucopyranosyloxy)-2,6-dihydroxyphenyl]- (delta mass: 14.3976 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.5,"smiles":null,"spectrum_id":"CCMSLIB00017240227","spectrum_index":17360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 35.0239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.074,"smiles":null,"spectrum_id":"CCMSLIB00017240229","spectrum_index":17361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 45.9478 Da; putative annotation: N/A; putative formula: H-2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017240231","spectrum_index":17362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-6-carboxaldehyde (delta mass: 118.0631 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.123,"smiles":null,"spectrum_id":"CCMSLIB00017240234","spectrum_index":17363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 5.0741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.103,"smiles":null,"spectrum_id":"CCMSLIB00017240235","spectrum_index":17364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 246.0093 Da; putative annotation: N/A; putative formula: C13H11O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.08,"smiles":null,"spectrum_id":"CCMSLIB00017240238","spectrum_index":17365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,8-Dihydroxy-1-methylanthraquinone-2-carboxylic acid (delta mass: 27.0111 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.066,"smiles":null,"spectrum_id":"CCMSLIB00017240239","spectrum_index":17366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-methylphenol (delta mass: 143.0367 Da; putative annotation: N/A; putative formula: C9H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.112,"smiles":null,"spectrum_id":"CCMSLIB00017240242","spectrum_index":17367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 94.0391 Da; putative annotation: N/A; putative formula: C2H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.089,"smiles":null,"spectrum_id":"CCMSLIB00017240244","spectrum_index":17368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipalmitolein (9c) (delta mass: 78.0479 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.531,"smiles":null,"spectrum_id":"CCMSLIB00017240246","spectrum_index":17369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-Butaprost (free acid) (delta mass: 38.0525 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017240248","spectrum_index":17370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 5-fluoro-1H-indazole-3-carboxylate (delta mass: 192.1969 Da; putative annotation: N/A; putative formula: C13H24N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.253,"smiles":null,"spectrum_id":"CCMSLIB00017240250","spectrum_index":17371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 39.0496 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.125,"smiles":null,"spectrum_id":"CCMSLIB00017240252","spectrum_index":17372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLADENINE - 60.0 eV (delta mass: 67.0637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.141,"smiles":null,"spectrum_id":"CCMSLIB00017240254","spectrum_index":17373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 275.1507 Da; putative annotation: N/A; putative formula: C12H17N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.216,"smiles":null,"spectrum_id":"CCMSLIB00017240256","spectrum_index":17374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 301.2965 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.466,"smiles":null,"spectrum_id":"CCMSLIB00017240258","spectrum_index":17375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tryptamine-C7:0 (delta mass: 272.1876 Da; putative annotation: N/A; putative formula: C17H24N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.384,"smiles":null,"spectrum_id":"CCMSLIB00017240260","spectrum_index":17376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 138.075 Da; putative annotation: N/A; putative formula: C3H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.323,"smiles":null,"spectrum_id":"CCMSLIB00017240262","spectrum_index":17377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 106.0629 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017240264","spectrum_index":17378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E3 (delta mass: 38.0149 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.232,"smiles":null,"spectrum_id":"CCMSLIB00017240266","spectrum_index":17379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 196.0736 Da; putative annotation: N/A; putative formula: C10H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.134,"smiles":null,"spectrum_id":"CCMSLIB00017240269","spectrum_index":17380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homoveratrylamine (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017240271","spectrum_index":17381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-phenylalanine (delta mass: 129.044 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.141,"smiles":null,"spectrum_id":"CCMSLIB00017240273","spectrum_index":17382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine (delta mass: 136.0524 Da; putative annotation: 4-Hydroxy-3-methoxybenzenemethanol; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.228,"smiles":null,"spectrum_id":"CCMSLIB00017240276","spectrum_index":17383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 97.0534 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.124,"smiles":null,"spectrum_id":"CCMSLIB00017240277","spectrum_index":17384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 108.0211 Da; putative annotation: 1,3,5-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017240280","spectrum_index":17385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Glu (delta mass: 101.047 Da; putative annotation: L-.beta.-Homoserine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.176,"smiles":null,"spectrum_id":"CCMSLIB00017240281","spectrum_index":17386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gln (delta mass: 129.0421 Da; putative annotation: D-(-)-Glutamic acid - 30.0 eV; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.161,"smiles":null,"spectrum_id":"CCMSLIB00017240282","spectrum_index":17387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 292.2399 Da; putative annotation: 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.487,"smiles":null,"spectrum_id":"CCMSLIB00017240285","spectrum_index":17388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 98.0369 Da; putative annotation: Levulinic acid; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.097,"smiles":null,"spectrum_id":"CCMSLIB00017240288","spectrum_index":17389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 294.2196 Da; putative annotation: (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid; putative formula: C18H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.457,"smiles":null,"spectrum_id":"CCMSLIB00017240289","spectrum_index":17390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 146.0575 Da; putative annotation: 2-DEOXY-D-GLUCOSE - 70.0 eV; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.123,"smiles":null,"spectrum_id":"CCMSLIB00017240291","spectrum_index":17391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 244.1093 Da; putative annotation: 1-Dehydroperuvinine; putative formula: C15H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.18,"smiles":null,"spectrum_id":"CCMSLIB00017240293","spectrum_index":17392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 263.2616 Da; putative annotation: Oleamide; putative formula: C18H33N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.562,"smiles":null,"spectrum_id":"CCMSLIB00017240295","spectrum_index":17393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385369-01_C32H48O9_Card-20(22)-enolide, 16-(acetyloxy)-3-[(2,6-dideoxy-3-O-methylhexopyranosyl)oxy]-14-hydroxy-, (3beta,5beta,8xi,9xi,16beta)- (delta mass: 432.249 Da; putative annotation: 3.beta.-Tetrahydrocortisol, 3,21-diacetate; putative formula: C25H36O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1009.59,"smiles":null,"spectrum_id":"CCMSLIB00017240297","spectrum_index":17394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 97.0889 Da; putative annotation: 4-Aminomethyltetrahydropyran; putative formula: C6H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.305,"smiles":null,"spectrum_id":"CCMSLIB00017240300","spectrum_index":17395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 264.2451 Da; putative annotation: (Z)-6-Octadecenoic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.289,"smiles":null,"spectrum_id":"CCMSLIB00017240301","spectrum_index":17396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 170.1308 Da; putative annotation: 10-Hydroxydecanoic acid CollisionEnergy:205060; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.175,"smiles":null,"spectrum_id":"CCMSLIB00017240303","spectrum_index":17397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 363.2601 Da; putative annotation: D-erythro-Sphinganine-1-phosphate; putative formula: C18H38NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.492,"smiles":null,"spectrum_id":"CCMSLIB00017240305","spectrum_index":17398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 116.0839 Da; putative annotation: 1,1,1-Tris(hydroxymethyl)propane; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017240307","spectrum_index":17399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 33.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.092,"smiles":null,"spectrum_id":"CCMSLIB00017240308","spectrum_index":17400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 63.1 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.202,"smiles":null,"spectrum_id":"CCMSLIB00017240311","spectrum_index":17401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 35.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.138,"smiles":null,"spectrum_id":"CCMSLIB00017240313","spectrum_index":17402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tuberonic acid (delta mass: 62.0518 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017240315","spectrum_index":17403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 85.0364 Da; putative annotation: N/A; putative formula: C4H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.388,"smiles":null,"spectrum_id":"CCMSLIB00017240317","spectrum_index":17404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 227.0991 Da; putative annotation: N/A; putative formula: C4H9N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.331,"smiles":null,"spectrum_id":"CCMSLIB00017240319","spectrum_index":17405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 71.0009 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.098,"smiles":null,"spectrum_id":"CCMSLIB00017240321","spectrum_index":17406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 92.0625 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.3,"smiles":null,"spectrum_id":"CCMSLIB00017240324","spectrum_index":17407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 316.2597 Da; putative annotation: N/A; putative formula: C22H36O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.507,"smiles":null,"spectrum_id":"CCMSLIB00017240325","spectrum_index":17408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 179.0795 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.203,"smiles":null,"spectrum_id":"CCMSLIB00017240328","spectrum_index":17409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 651.4341 Da; putative annotation: N/A; putative formula: C34H49N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.494,"smiles":null,"spectrum_id":"CCMSLIB00017240330","spectrum_index":17410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.306,"smiles":null,"spectrum_id":"CCMSLIB00017240332","spectrum_index":17411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 119.0374 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.161,"smiles":null,"spectrum_id":"CCMSLIB00017240334","spectrum_index":17412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E,9E)-5,6-Dihydroxy-9,12,13-trimethyl-14-(2-methylpropyl)-6,7,8,10a,13,13a,14,15-octahydro-2H-oxacyclododecino[2,3-d]isoindole-2,16(5H)-dione (delta mass: 48.0364 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.295,"smiles":null,"spectrum_id":"CCMSLIB00017240336","spectrum_index":17413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 135.0686 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017240339","spectrum_index":17414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.284,"smiles":null,"spectrum_id":"CCMSLIB00017240340","spectrum_index":17415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Piperidinyl)morpholine (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.16,"smiles":null,"spectrum_id":"CCMSLIB00017240343","spectrum_index":17416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 17.9742 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.206,"smiles":null,"spectrum_id":"CCMSLIB00017240344","spectrum_index":17417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 50.0518 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.294,"smiles":null,"spectrum_id":"CCMSLIB00017240347","spectrum_index":17418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 230.1154 Da; putative annotation: N/A; putative formula: C11H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.186,"smiles":null,"spectrum_id":"CCMSLIB00017240348","spectrum_index":17419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desoxypipradrol (delta mass: 106.0843 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.259,"smiles":null,"spectrum_id":"CCMSLIB00017240350","spectrum_index":17420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.294,"smiles":null,"spectrum_id":"CCMSLIB00017240352","spectrum_index":17421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 54.0467 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.3,"smiles":null,"spectrum_id":"CCMSLIB00017240354","spectrum_index":17422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 64.0674 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.32,"smiles":null,"spectrum_id":"CCMSLIB00017240356","spectrum_index":17423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 27.0541 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.223,"smiles":null,"spectrum_id":"CCMSLIB00017240358","spectrum_index":17424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 88.0522 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017240360","spectrum_index":17425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 811.4719 Da; putative annotation: N/A; putative formula: C42H69NO14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1138.6,"smiles":null,"spectrum_id":"CCMSLIB00017240362","spectrum_index":17426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 44.0378 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.119,"smiles":null,"spectrum_id":"CCMSLIB00017240364","spectrum_index":17427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylbutanoic acid (delta mass: 27.0098 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.096,"smiles":null,"spectrum_id":"CCMSLIB00017240366","spectrum_index":17428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 193.1098 Da; putative annotation: N/A; putative formula: C11H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.212,"smiles":null,"spectrum_id":"CCMSLIB00017240367","spectrum_index":17429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 72.0576 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017240370","spectrum_index":17430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 110.0519 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.419,"smiles":null,"spectrum_id":"CCMSLIB00017240371","spectrum_index":17431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 100.0669 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.153,"smiles":null,"spectrum_id":"CCMSLIB00017240374","spectrum_index":17432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 153.1127 Da; putative annotation: N/A; putative formula: C5H11N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.241,"smiles":null,"spectrum_id":"CCMSLIB00017240375","spectrum_index":17433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.beta.,17.alpha.-Dimethyl-5.beta.-androstane-3.alpha.,17.beta.-diol (delta mass: 40.0311 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.31,"smiles":null,"spectrum_id":"CCMSLIB00017240378","spectrum_index":17434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 18.0637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.129,"smiles":null,"spectrum_id":"CCMSLIB00017240379","spectrum_index":17435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 343.2783 Da; putative annotation: N/A; putative formula: C23H38NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.5,"smiles":null,"spectrum_id":"CCMSLIB00017240382","spectrum_index":17436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 197.0287 Da; putative annotation: N/A; putative formula: C3H7N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.12,"smiles":null,"spectrum_id":"CCMSLIB00017240383","spectrum_index":17437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hendecenoic acid (delta mass: 66.0832 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.237,"smiles":null,"spectrum_id":"CCMSLIB00017240386","spectrum_index":17438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 139.0299 Da; putative annotation: N/A; putative formula: C5H6N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.111,"smiles":null,"spectrum_id":"CCMSLIB00017240388","spectrum_index":17439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 270.1217 Da; putative annotation: N/A; putative formula: C12H18N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.26,"smiles":null,"spectrum_id":"CCMSLIB00017240390","spectrum_index":17440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 82.0058 Da; putative annotation: N/A; putative formula: C4H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.077,"smiles":null,"spectrum_id":"CCMSLIB00017240391","spectrum_index":17441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 433.1582 Da; putative annotation: N/A; putative formula: C16H15N15O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.239,"smiles":null,"spectrum_id":"CCMSLIB00017240394","spectrum_index":17442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 126.0708 Da; putative annotation: N/A; putative formula: C6H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.151,"smiles":null,"spectrum_id":"CCMSLIB00017240396","spectrum_index":17443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzocain (delta mass: 56.0254 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.112,"smiles":null,"spectrum_id":"CCMSLIB00017240398","spectrum_index":17444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 42.0467 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.106,"smiles":null,"spectrum_id":"CCMSLIB00017240400","spectrum_index":17445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 235.2144 Da; putative annotation: N/A; putative formula: C13H25N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.384,"smiles":null,"spectrum_id":"CCMSLIB00017240402","spectrum_index":17446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 27.9382 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.108,"smiles":null,"spectrum_id":"CCMSLIB00017240404","spectrum_index":17447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleanolic acid methyl ester (delta mass: 128.0242 Da; putative annotation: N/A; putative formula: C5N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.407,"smiles":null,"spectrum_id":"CCMSLIB00017240405","spectrum_index":17448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Resibufogenin (delta mass: 110.0589 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.296,"smiles":null,"spectrum_id":"CCMSLIB00017240408","spectrum_index":17449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 59.0189 Da; putative annotation: N/A; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.152,"smiles":null,"spectrum_id":"CCMSLIB00017240409","spectrum_index":17450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 38.0269 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.124,"smiles":null,"spectrum_id":"CCMSLIB00017240412","spectrum_index":17451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one (delta mass: 82.0414 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.258,"smiles":null,"spectrum_id":"CCMSLIB00017240413","spectrum_index":17452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 80.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.4,"smiles":null,"spectrum_id":"CCMSLIB00017240416","spectrum_index":17453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GLUCOSAMINE (delta mass: 125.0512 Da; putative annotation: N/A; putative formula: C5H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.148,"smiles":null,"spectrum_id":"CCMSLIB00017240417","spectrum_index":17454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 44.1065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.168,"smiles":null,"spectrum_id":"CCMSLIB00017240420","spectrum_index":17455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 103.0067 Da; putative annotation: N/A; putative formula: C6HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.265,"smiles":null,"spectrum_id":"CCMSLIB00017240421","spectrum_index":17456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 64.0672 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.325,"smiles":null,"spectrum_id":"CCMSLIB00017240424","spectrum_index":17457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,,3S,5Z)-3-hydroxy-1,5-octadien-1-yl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5Z)- (delta mass: 35.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.274,"smiles":null,"spectrum_id":"CCMSLIB00017240425","spectrum_index":17458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 106.0777 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.211,"smiles":null,"spectrum_id":"CCMSLIB00017240428","spectrum_index":17459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 240.0743 Da; putative annotation: N/A; putative formula: C10H12N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.171,"smiles":null,"spectrum_id":"CCMSLIB00017240430","spectrum_index":17460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 61.9438 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.249,"smiles":null,"spectrum_id":"CCMSLIB00017240432","spectrum_index":17461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 194.0584 Da; putative annotation: N/A; putative formula: C3H10N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.134,"smiles":null,"spectrum_id":"CCMSLIB00017240434","spectrum_index":17462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis,cis-9,12-Octadecadien-1-ol (delta mass: 76.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.331,"smiles":null,"spectrum_id":"CCMSLIB00017240435","spectrum_index":17463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 84.0689 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.14,"smiles":null,"spectrum_id":"CCMSLIB00017240438","spectrum_index":17464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381236-01![(2S,3S,4R,5R,6R)-5-acetyloxy-3-hydroxy-2-methyl-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]oxan-4-yl] acetate (delta mass: 706.1921 Da; putative annotation: N/A; putative formula: C48H27N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1413.41,"smiles":null,"spectrum_id":"CCMSLIB00017240439","spectrum_index":17465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 267.1892 Da; putative annotation: N/A; putative formula: C13H25N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.23,"smiles":null,"spectrum_id":"CCMSLIB00017240442","spectrum_index":17466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazole (delta mass: 26.0151 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":95.0598,"smiles":null,"spectrum_id":"CCMSLIB00017240443","spectrum_index":17467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 205.1104 Da; putative annotation: N/A; putative formula: C12H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.196,"smiles":null,"spectrum_id":"CCMSLIB00017240446","spectrum_index":17468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole (delta mass: 264.2363 Da; putative annotation: N/A; putative formula: C18H33O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.305,"smiles":null,"spectrum_id":"CCMSLIB00017240448","spectrum_index":17469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 40.0677 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017240450","spectrum_index":17470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Phenylpropyl)piperidine (delta mass: 78.0318 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.207,"smiles":null,"spectrum_id":"CCMSLIB00017240451","spectrum_index":17471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.113,"smiles":null,"spectrum_id":"CCMSLIB00017240454","spectrum_index":17472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-15-ketoprostaglandin D1 (delta mass: 200.1206 Da; putative annotation: N/A; putative formula: C7H16N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.369,"smiles":null,"spectrum_id":"CCMSLIB00017240455","spectrum_index":17473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 490.1112 Da; putative annotation: N/A; putative formula: C28H20N4OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.176,"smiles":null,"spectrum_id":"CCMSLIB00017240458","spectrum_index":17474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 198.0976 Da; putative annotation: N/A; putative formula: C5H10N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.184,"smiles":null,"spectrum_id":"CCMSLIB00017240459","spectrum_index":17475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 122.9588 Da; putative annotation: N/A; putative formula: C5HNO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.206,"smiles":null,"spectrum_id":"CCMSLIB00017240462","spectrum_index":17476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one (delta mass: 23.0075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.035,"smiles":null,"spectrum_id":"CCMSLIB00017240463","spectrum_index":17477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 344.1616 Da; putative annotation: N/A; putative formula: C14H25N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.258,"smiles":null,"spectrum_id":"CCMSLIB00017240465","spectrum_index":17478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 161.1131 Da; putative annotation: N/A; putative formula: C5H15N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.35,"smiles":null,"spectrum_id":"CCMSLIB00017240467","spectrum_index":17479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 94.0784 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.3,"smiles":null,"spectrum_id":"CCMSLIB00017240470","spectrum_index":17480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 118.0782 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.352,"smiles":null,"spectrum_id":"CCMSLIB00017240473","spectrum_index":17481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 163.0538 Da; putative annotation: N/A; putative formula: C11H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.27,"smiles":null,"spectrum_id":"CCMSLIB00017240474","spectrum_index":17482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 128.1059 Da; putative annotation: N/A; putative formula: C5H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.338,"smiles":null,"spectrum_id":"CCMSLIB00017240477","spectrum_index":17483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 199.4978 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.589,"smiles":null,"spectrum_id":"CCMSLIB00017240479","spectrum_index":17484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arthrobactin (delta mass: 476.2479 Da; putative annotation: N/A; putative formula: C30H37O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":953.503,"smiles":null,"spectrum_id":"CCMSLIB00017240482","spectrum_index":17485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CORTISOL (delta mass: 362.2144 Da; putative annotation: N/A; putative formula: C27H26N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.431,"smiles":null,"spectrum_id":"CCMSLIB00017240483","spectrum_index":17486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 371.1151 Da; putative annotation: N/A; putative formula: C15H21N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.156,"smiles":null,"spectrum_id":"CCMSLIB00017240486","spectrum_index":17487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 86.0525 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.295,"smiles":null,"spectrum_id":"CCMSLIB00017240489","spectrum_index":17488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 210.1983 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.315,"smiles":null,"spectrum_id":"CCMSLIB00017240491","spectrum_index":17489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-acetyloxy-8-(3-oxo-2-pent-2-enylcyclopenten-1-yl)octanoic acid (delta mass: 130.0813 Da; putative annotation: N/A; putative formula: C7H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.298,"smiles":null,"spectrum_id":"CCMSLIB00017240493","spectrum_index":17490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 54.0101 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.117,"smiles":null,"spectrum_id":"CCMSLIB00017240496","spectrum_index":17491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 96.0575 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.164,"smiles":null,"spectrum_id":"CCMSLIB00017240499","spectrum_index":17492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 279.1469 Da; putative annotation: N/A; putative formula: C15H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.218,"smiles":null,"spectrum_id":"CCMSLIB00017240500","spectrum_index":17493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 925.0269 Da; putative annotation: N/A; putative formula: C35H31N3O17S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1147.12,"smiles":null,"spectrum_id":"CCMSLIB00017240503","spectrum_index":17494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 617.2404 Da; putative annotation: N/A; putative formula: C22H35N9O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.395,"smiles":null,"spectrum_id":"CCMSLIB00017240506","spectrum_index":17495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-OxoOTrE from NIST14 (delta mass: 51.0315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017240507","spectrum_index":17496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 86.0496 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.114,"smiles":null,"spectrum_id":"CCMSLIB00017240510","spectrum_index":17497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.274,"smiles":null,"spectrum_id":"CCMSLIB00017240513","spectrum_index":17498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 132.1308 Da; putative annotation: N/A; putative formula: C11H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.368,"smiles":null,"spectrum_id":"CCMSLIB00017240514","spectrum_index":17499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Isobutyl-2-(2-methyl-1H-indol-1-yl)acetamide (delta mass: 204.0899 Da; putative annotation: N/A; putative formula: C11H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.255,"smiles":null,"spectrum_id":"CCMSLIB00017240517","spectrum_index":17500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 298.2147 Da; putative annotation: N/A; putative formula: C17H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.316,"smiles":null,"spectrum_id":"CCMSLIB00017240520","spectrum_index":17501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 74.0521 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.232,"smiles":null,"spectrum_id":"CCMSLIB00017240521","spectrum_index":17502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(hydroxymethyl)-4,9a-dimethyl-2,7,8,9-tetrahydro-1H-benzo[7]annulen-3-one (delta mass: 74.0553 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.22,"smiles":null,"spectrum_id":"CCMSLIB00017240524","spectrum_index":17503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 207.0529 Da; putative annotation: N/A; putative formula: C10H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.118,"smiles":null,"spectrum_id":"CCMSLIB00017240525","spectrum_index":17504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 70.0236 Da; putative annotation: N/A; putative formula: C4H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.25,"smiles":null,"spectrum_id":"CCMSLIB00017240528","spectrum_index":17505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 249.1936 Da; putative annotation: N/A; putative formula: C13H23N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.41,"smiles":null,"spectrum_id":"CCMSLIB00017240530","spectrum_index":17506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 160.0372 Da; putative annotation: N/A; putative formula: C6H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.108,"smiles":null,"spectrum_id":"CCMSLIB00017240532","spectrum_index":17507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 58.0016 Da; putative annotation: N/A; putative formula: CH2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.093,"smiles":null,"spectrum_id":"CCMSLIB00017240535","spectrum_index":17508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 84.0194 Da; putative annotation: N/A; putative formula: N6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.09,"smiles":null,"spectrum_id":"CCMSLIB00017240537","spectrum_index":17509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 599.3428 Da; putative annotation: N/A; putative formula: C30H53N3O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":821.44,"smiles":null,"spectrum_id":"CCMSLIB00017240539","spectrum_index":17510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 17.9527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.117,"smiles":null,"spectrum_id":"CCMSLIB00017240542","spectrum_index":17511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 116.0838 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.331,"smiles":null,"spectrum_id":"CCMSLIB00017240544","spectrum_index":17512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin C (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.185,"smiles":null,"spectrum_id":"CCMSLIB00017240546","spectrum_index":17513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-6,10,14,18-tetraene-1,2,3,22,23-pentol (delta mass: 184.1605 Da; putative annotation: N/A; putative formula: C15H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.565,"smiles":null,"spectrum_id":"CCMSLIB00017240548","spectrum_index":17514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 97.0532 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.15,"smiles":null,"spectrum_id":"CCMSLIB00017240551","spectrum_index":17515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 211.1785 Da; putative annotation: N/A; putative formula: C10H21N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.254,"smiles":null,"spectrum_id":"CCMSLIB00017240552","spectrum_index":17516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 34.0053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.216,"smiles":null,"spectrum_id":"CCMSLIB00017240555","spectrum_index":17517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.279,"smiles":null,"spectrum_id":"CCMSLIB00017240556","spectrum_index":17518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 67.0642 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.312,"smiles":null,"spectrum_id":"CCMSLIB00017240559","spectrum_index":17519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":101.071,"smiles":null,"spectrum_id":"CCMSLIB00017240561","spectrum_index":17520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 178.0431 Da; putative annotation: N/A; putative formula: C6H6N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.121,"smiles":null,"spectrum_id":"CCMSLIB00017240563","spectrum_index":17521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 192.0567 Da; putative annotation: N/A; putative formula: C6H12N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.134,"smiles":null,"spectrum_id":"CCMSLIB00017240565","spectrum_index":17522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 73.0393 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.13,"smiles":null,"spectrum_id":"CCMSLIB00017240567","spectrum_index":17523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 110.0324 Da; putative annotation: N/A; putative formula: C2H2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.123,"smiles":null,"spectrum_id":"CCMSLIB00017240570","spectrum_index":17524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eremofortin B (delta mass: 74.0366 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.185,"smiles":null,"spectrum_id":"CCMSLIB00017240572","spectrum_index":17525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 100.0838 Da; putative annotation: N/A; putative formula: C2H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.15,"smiles":null,"spectrum_id":"CCMSLIB00017240574","spectrum_index":17526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 38.0522 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.274,"smiles":null,"spectrum_id":"CCMSLIB00017240576","spectrum_index":17527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 38.0559 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.158,"smiles":null,"spectrum_id":"CCMSLIB00017240578","spectrum_index":17528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 71.0688 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.117,"smiles":null,"spectrum_id":"CCMSLIB00017240580","spectrum_index":17529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 73.0445 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.105,"smiles":null,"spectrum_id":"CCMSLIB00017240582","spectrum_index":17530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 182.1304 Da; putative annotation: N/A; putative formula: C11H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.388,"smiles":null,"spectrum_id":"CCMSLIB00017240585","spectrum_index":17531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 58.0646 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.14,"smiles":null,"spectrum_id":"CCMSLIB00017240587","spectrum_index":17532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 336.2666 Da; putative annotation: N/A; putative formula: C21H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.317,"smiles":null,"spectrum_id":"CCMSLIB00017240589","spectrum_index":17533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 81.0667 Da; putative annotation: N/A; putative formula: C4H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.154,"smiles":null,"spectrum_id":"CCMSLIB00017240591","spectrum_index":17534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 232.9749 Da; putative annotation: N/A; putative formula: C6H7N3OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.151,"smiles":null,"spectrum_id":"CCMSLIB00017240592","spectrum_index":17535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169031-03![6-(2-formamido-3-methylbutanoyl)oxy-2,3,4,5-tetrahydroxyhexyl] 2-formamido-3-methylbutanoate (delta mass: 127.0639 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.277,"smiles":null,"spectrum_id":"CCMSLIB00017240595","spectrum_index":17536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 63.5558 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.647,"smiles":null,"spectrum_id":"CCMSLIB00017240597","spectrum_index":17537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Bisabolol (delta mass: 66.0826 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.288,"smiles":null,"spectrum_id":"CCMSLIB00017240599","spectrum_index":17538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 27.0471 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.134,"smiles":null,"spectrum_id":"CCMSLIB00017240601","spectrum_index":17539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 258.0711 Da; putative annotation: N/A; putative formula: C17H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.142,"smiles":null,"spectrum_id":"CCMSLIB00017240603","spectrum_index":17540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 76.0148 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.101,"smiles":null,"spectrum_id":"CCMSLIB00017240606","spectrum_index":17541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 64.0675 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.299,"smiles":null,"spectrum_id":"CCMSLIB00017240608","spectrum_index":17542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 122.1094 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.315,"smiles":null,"spectrum_id":"CCMSLIB00017240610","spectrum_index":17543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(R)-Hydroxydocosahexaenoic acid (delta mass: 43.0412 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.284,"smiles":null,"spectrum_id":"CCMSLIB00017240612","spectrum_index":17544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 216.0036 Da; putative annotation: N/A; putative formula: C4H9O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.069,"smiles":null,"spectrum_id":"CCMSLIB00017240615","spectrum_index":17545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 70.0125 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.114,"smiles":null,"spectrum_id":"CCMSLIB00017240616","spectrum_index":17546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 320.0383 Da; putative annotation: N/A; putative formula: C14H13N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.079,"smiles":null,"spectrum_id":"CCMSLIB00017240619","spectrum_index":17547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 294.094 Da; putative annotation: N/A; putative formula: C16H14N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.451,"smiles":null,"spectrum_id":"CCMSLIB00017240620","spectrum_index":17548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 356.2703 Da; putative annotation: N/A; putative formula: C18H37N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.336,"smiles":null,"spectrum_id":"CCMSLIB00017240623","spectrum_index":17549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 164.1188 Da; putative annotation: N/A; putative formula: C11H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.163,"smiles":null,"spectrum_id":"CCMSLIB00017240624","spectrum_index":17550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,10-Bisaboladiene-1,4-diol (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017240627","spectrum_index":17551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fucosterol (delta mass: 62.0522 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.43,"smiles":null,"spectrum_id":"CCMSLIB00017240628","spectrum_index":17552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 11.9633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017240630","spectrum_index":17553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 12.0002 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.102,"smiles":null,"spectrum_id":"CCMSLIB00017240632","spectrum_index":17554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic_acid (delta mass: 39.9909 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.254,"smiles":null,"spectrum_id":"CCMSLIB00017240634","spectrum_index":17555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5,9-trihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one (delta mass: 134.1091 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.263,"smiles":null,"spectrum_id":"CCMSLIB00017240637","spectrum_index":17556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palatinose (delta mass: 448.2426 Da; putative annotation: N/A; putative formula: C23H37N4OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.366,"smiles":null,"spectrum_id":"CCMSLIB00017240638","spectrum_index":17557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 25.0315 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.149,"smiles":null,"spectrum_id":"CCMSLIB00017240641","spectrum_index":17558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-1H-indole-2-carbaldehyde (delta mass: 59.0797 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.05,"smiles":null,"spectrum_id":"CCMSLIB00017240642","spectrum_index":17559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 17.935 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.198,"smiles":null,"spectrum_id":"CCMSLIB00017240645","spectrum_index":17560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 75.0438 Da; putative annotation: N/A; putative formula: CH5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.26,"smiles":null,"spectrum_id":"CCMSLIB00017240646","spectrum_index":17561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 85.8967 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.988,"smiles":null,"spectrum_id":"CCMSLIB00017240649","spectrum_index":17562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 190.0757 Da; putative annotation: N/A; putative formula: C8H15O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.23,"smiles":null,"spectrum_id":"CCMSLIB00017240651","spectrum_index":17563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nervobscurine (delta mass: 17.0293 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.226,"smiles":null,"spectrum_id":"CCMSLIB00017240653","spectrum_index":17564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 208.1338 Da; putative annotation: N/A; putative formula: C10H16N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.273,"smiles":null,"spectrum_id":"CCMSLIB00017240654","spectrum_index":17565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstenetriol (delta mass: 38.0167 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.243,"smiles":null,"spectrum_id":"CCMSLIB00017240657","spectrum_index":17566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Palmitoyl-D-sphingosine (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.602,"smiles":null,"spectrum_id":"CCMSLIB00017240659","spectrum_index":17567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017240661","spectrum_index":17568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 133.0376 Da; putative annotation: N/A; putative formula: C4H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.161,"smiles":null,"spectrum_id":"CCMSLIB00017240664","spectrum_index":17569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.055,"smiles":null,"spectrum_id":"CCMSLIB00017240665","spectrum_index":17570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 274.2508 Da; putative annotation: N/A; putative formula: C17H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.316,"smiles":null,"spectrum_id":"CCMSLIB00017240668","spectrum_index":17571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 50.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.097,"smiles":null,"spectrum_id":"CCMSLIB00017240670","spectrum_index":17572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 8.9426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.112,"smiles":null,"spectrum_id":"CCMSLIB00017240672","spectrum_index":17573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 28.998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.068,"smiles":null,"spectrum_id":"CCMSLIB00017240674","spectrum_index":17574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 129.0524 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.206,"smiles":null,"spectrum_id":"CCMSLIB00017240676","spectrum_index":17575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 40.0314 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.133,"smiles":null,"spectrum_id":"CCMSLIB00017240678","spectrum_index":17576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.beta.-Hydroxypalmitic acid (delta mass: 36.0362 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.279,"smiles":null,"spectrum_id":"CCMSLIB00017240680","spectrum_index":17577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 90.0314 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.112,"smiles":null,"spectrum_id":"CCMSLIB00017240682","spectrum_index":17578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 254.1883 Da; putative annotation: N/A; putative formula: C15H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.431,"smiles":null,"spectrum_id":"CCMSLIB00017240684","spectrum_index":17579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 24.9947 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.164,"smiles":null,"spectrum_id":"CCMSLIB00017240687","spectrum_index":17580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2Z-Eicosenoic acid (delta mass: 56.0732 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.368,"smiles":null,"spectrum_id":"CCMSLIB00017240688","spectrum_index":17581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-cysteine; AIF; CE0; CorrDec (delta mass: 46.0049 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.042,"smiles":null,"spectrum_id":"CCMSLIB00017240691","spectrum_index":17582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dimethyl-1,3-benzenediol (delta mass: 41.0628 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.138,"smiles":null,"spectrum_id":"CCMSLIB00017240692","spectrum_index":17583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 11.9999 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.055,"smiles":null,"spectrum_id":"CCMSLIB00017240695","spectrum_index":17584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 172.1206 Da; putative annotation: N/A; putative formula: C8H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.212,"smiles":null,"spectrum_id":"CCMSLIB00017240696","spectrum_index":17585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.alpha.-Hydroxyprogesterone (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017240699","spectrum_index":17586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 202.2137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.409,"smiles":null,"spectrum_id":"CCMSLIB00017240700","spectrum_index":17587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 278.027 Da; putative annotation: N/A; putative formula: C9H10O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.379,"smiles":null,"spectrum_id":"CCMSLIB00017240703","spectrum_index":17588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 893.4784 Da; putative annotation: N/A; putative formula: C47H67N5O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1176.58,"smiles":null,"spectrum_id":"CCMSLIB00017240704","spectrum_index":17589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isovitexin (delta mass: 426.1896 Da; putative annotation: N/A; putative formula: C14H30N6O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":859.302,"smiles":null,"spectrum_id":"CCMSLIB00017240707","spectrum_index":17590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 27.0812 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.147,"smiles":null,"spectrum_id":"CCMSLIB00017240708","spectrum_index":17591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 190.1354 Da; putative annotation: N/A; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.18,"smiles":null,"spectrum_id":"CCMSLIB00017240711","spectrum_index":17592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 94.0782 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.341,"smiles":null,"spectrum_id":"CCMSLIB00017240712","spectrum_index":17593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 309.1043 Da; putative annotation: N/A; putative formula: C16H23NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.237,"smiles":null,"spectrum_id":"CCMSLIB00017240715","spectrum_index":17594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 356.1217 Da; putative annotation: N/A; putative formula: C15H20N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.256,"smiles":null,"spectrum_id":"CCMSLIB00017240716","spectrum_index":17595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyibuprofen (delta mass: 222.125 Da; putative annotation: N/A; putative formula: C7H19N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.258,"smiles":null,"spectrum_id":"CCMSLIB00017240719","spectrum_index":17596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 471.2485 Da; putative annotation: N/A; putative formula: C17H33N11O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.351,"smiles":null,"spectrum_id":"CCMSLIB00017240720","spectrum_index":17597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.129,"smiles":null,"spectrum_id":"CCMSLIB00017240723","spectrum_index":17598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11(12)-Epoxy-5Z,8Z,14Z-eicosatrienoic acid (delta mass: 121.0196 Da; putative annotation: N/A; putative formula: C3H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.262,"smiles":null,"spectrum_id":"CCMSLIB00017240725","spectrum_index":17599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-C11:0 (delta mass: 71.0807 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.318,"smiles":null,"spectrum_id":"CCMSLIB00017240727","spectrum_index":17600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 150.0682 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.295,"smiles":null,"spectrum_id":"CCMSLIB00017240729","spectrum_index":17601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 129.022 Da; putative annotation: N/A; putative formula: C8H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017240731","spectrum_index":17602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 317.0886 Da; putative annotation: N/A; putative formula: C20H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.175,"smiles":null,"spectrum_id":"CCMSLIB00017240734","spectrum_index":17603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-15-ketoprostaglandin D1 (delta mass: 188.0839 Da; putative annotation: N/A; putative formula: C12H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.332,"smiles":null,"spectrum_id":"CCMSLIB00017240736","spectrum_index":17604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 48.0357 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.372,"smiles":null,"spectrum_id":"CCMSLIB00017240738","spectrum_index":17605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 30.0082 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.126,"smiles":null,"spectrum_id":"CCMSLIB00017240740","spectrum_index":17606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dihydroxy-5Z,8Z,14Z-eicosatrienoic acid (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017240743","spectrum_index":17607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 36.9681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.247,"smiles":null,"spectrum_id":"CCMSLIB00017240744","spectrum_index":17608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 347.3183 Da; putative annotation: N/A; putative formula: C23H41NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.555,"smiles":null,"spectrum_id":"CCMSLIB00017240747","spectrum_index":17609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 98.0214 Da; putative annotation: N/A; putative formula: C2H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017240748","spectrum_index":17610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dimethyl (R)-(+)-malate (delta mass: 277.1677 Da; putative annotation: N/A; putative formula: C16H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.228,"smiles":null,"spectrum_id":"CCMSLIB00017240751","spectrum_index":17611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(11)-Dehydromanogenin (delta mass: 162.0538 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.349,"smiles":null,"spectrum_id":"CCMSLIB00017240752","spectrum_index":17612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1-Pyrrolidinylcarbonyl)piperidine (delta mass: 175.0638 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.213,"smiles":null,"spectrum_id":"CCMSLIB00017240754","spectrum_index":17613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017240756","spectrum_index":17614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-His (delta mass: 113.0838 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.193,"smiles":null,"spectrum_id":"CCMSLIB00017240758","spectrum_index":17615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,13.alpha.)-7-Oxopimara-8,15-dien-18-oic acid (delta mass: 67.0634 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.275,"smiles":null,"spectrum_id":"CCMSLIB00017240760","spectrum_index":17616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-5-Hydroxylysine (delta mass: 43.0023 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.11,"smiles":null,"spectrum_id":"CCMSLIB00017240762","spectrum_index":17617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 71.0163 Da; putative annotation: N/A; putative formula: C6HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017240765","spectrum_index":17618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 78.1302 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.195,"smiles":null,"spectrum_id":"CCMSLIB00017240766","spectrum_index":17619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 523.2036 Da; putative annotation: N/A; putative formula: C22H33N7O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.264,"smiles":null,"spectrum_id":"CCMSLIB00017240769","spectrum_index":17620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 300.0518 Da; putative annotation: N/A; putative formula: C12H17N2OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.237,"smiles":null,"spectrum_id":"CCMSLIB00017240770","spectrum_index":17621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 14.014 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.246,"smiles":null,"spectrum_id":"CCMSLIB00017240773","spectrum_index":17622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 244.1283 Da; putative annotation: N/A; putative formula: C8H16N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.204,"smiles":null,"spectrum_id":"CCMSLIB00017240775","spectrum_index":17623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-(3-Hydroxy-2,2,5a-trimethyl-7-methylidenedecahydro-1-benzoxepin-6-yl)ethyl)-2,2,5a,7-tetramethyldecahydro-1-benzoxepine-3,4,6-triol (delta mass: 152.099 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.483,"smiles":null,"spectrum_id":"CCMSLIB00017240777","spectrum_index":17624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 358.2507 Da; putative annotation: N/A; putative formula: C23H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.483,"smiles":null,"spectrum_id":"CCMSLIB00017240780","spectrum_index":17625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 266.0644 Da; putative annotation: N/A; putative formula: C12H15N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.333,"smiles":null,"spectrum_id":"CCMSLIB00017240781","spectrum_index":17626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 693.4664 Da; putative annotation: N/A; putative formula: C35H67NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":970.683,"smiles":null,"spectrum_id":"CCMSLIB00017240783","spectrum_index":17627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jasmonoyl-S-Isoleucine CollisionEnergy:102040 (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.228,"smiles":null,"spectrum_id":"CCMSLIB00017240786","spectrum_index":17628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 92.0594 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.26,"smiles":null,"spectrum_id":"CCMSLIB00017240787","spectrum_index":17629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 121.0544 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.26,"smiles":null,"spectrum_id":"CCMSLIB00017240790","spectrum_index":17630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 258.1193 Da; putative annotation: N/A; putative formula: C15H18N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.16,"smiles":null,"spectrum_id":"CCMSLIB00017240791","spectrum_index":17631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 406.0338 Da; putative annotation: N/A; putative formula: C22H6N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.292,"smiles":null,"spectrum_id":"CCMSLIB00017240794","spectrum_index":17632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 17.0844 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.16,"smiles":null,"spectrum_id":"CCMSLIB00017240795","spectrum_index":17633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-hydroxybutyl)-3,5,5-trimethylcyclohex-3-en-1-ol (delta mass: 225.121 Da; putative annotation: N/A; putative formula: C12H21NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.306,"smiles":null,"spectrum_id":"CCMSLIB00017240798","spectrum_index":17634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 35.7494 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.263,"smiles":null,"spectrum_id":"CCMSLIB00017240799","spectrum_index":17635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethoxy)benzaldehyde (delta mass: 46.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.115,"smiles":null,"spectrum_id":"CCMSLIB00017240802","spectrum_index":17636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Chlorophenyl)guanidine (delta mass: 46.0303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.078,"smiles":null,"spectrum_id":"CCMSLIB00017240803","spectrum_index":17637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid; AIF: CE0; MS2Dec (delta mass: 42.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.14,"smiles":null,"spectrum_id":"CCMSLIB00017240805","spectrum_index":17638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 122.1081 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.34,"smiles":null,"spectrum_id":"CCMSLIB00017240807","spectrum_index":17639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 455.1625 Da; putative annotation: N/A; putative formula: C21H31NO6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.233,"smiles":null,"spectrum_id":"CCMSLIB00017240810","spectrum_index":17640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid (delta mass: 165.0486 Da; putative annotation: N/A; putative formula: C4H12N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.144,"smiles":null,"spectrum_id":"CCMSLIB00017240811","spectrum_index":17641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C20:3 (delta mass: 581.4851 Da; putative annotation: N/A; putative formula: C36H63N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.77,"smiles":null,"spectrum_id":"CCMSLIB00017240813","spectrum_index":17642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.253,"smiles":null,"spectrum_id":"CCMSLIB00017240816","spectrum_index":17643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 25-Hydroxycholesterol (delta mass: 122.0354 Da; putative annotation: N/A; putative formula: CH7N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.393,"smiles":null,"spectrum_id":"CCMSLIB00017240817","spectrum_index":17644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 382.1998 Da; putative annotation: N/A; putative formula: C21H34O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.248,"smiles":null,"spectrum_id":"CCMSLIB00017240820","spectrum_index":17645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinamine (delta mass: 131.0946 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.212,"smiles":null,"spectrum_id":"CCMSLIB00017240821","spectrum_index":17646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Hydroxy-15-kauren-19-oic acid (delta mass: 114.0831 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.31,"smiles":null,"spectrum_id":"CCMSLIB00017240824","spectrum_index":17647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"5,6-DIHYDROURACIL\"\" (delta mass: 32.0257 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.076,"smiles":null,"spectrum_id":"CCMSLIB00017240825","spectrum_index":17648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 239.0125 Da; putative annotation: N/A; putative formula: C8HN9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.099,"smiles":null,"spectrum_id":"CCMSLIB00017240828","spectrum_index":17649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 190.4192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.5,"smiles":null,"spectrum_id":"CCMSLIB00017240830","spectrum_index":17650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 172.0509 Da; putative annotation: N/A; putative formula: C5H9N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.132,"smiles":null,"spectrum_id":"CCMSLIB00017240832","spectrum_index":17651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 1124.283 Da; putative annotation: N/A; putative formula: C57H48N4O21)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1346.38,"smiles":null,"spectrum_id":"CCMSLIB00017240835","spectrum_index":17652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 739.4026 Da; putative annotation: N/A; putative formula: C52H53NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1049.52,"smiles":null,"spectrum_id":"CCMSLIB00017240837","spectrum_index":17653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 57.0287 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.204,"smiles":null,"spectrum_id":"CCMSLIB00017240839","spectrum_index":17654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-cis-Retinol (delta mass: 78.0315 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.268,"smiles":null,"spectrum_id":"CCMSLIB00017240841","spectrum_index":17655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 118.0784 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.274,"smiles":null,"spectrum_id":"CCMSLIB00017240843","spectrum_index":17656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 35.093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.148,"smiles":null,"spectrum_id":"CCMSLIB00017240845","spectrum_index":17657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Linoleoylglycerol from NIST14 (delta mass: 144.1144 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.399,"smiles":null,"spectrum_id":"CCMSLIB00017240847","spectrum_index":17658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 52.0305 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.21,"smiles":null,"spectrum_id":"CCMSLIB00017240849","spectrum_index":17659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fucosterol (delta mass: 419.1616 Da; putative annotation: N/A; putative formula: C18H29NO8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.539,"smiles":null,"spectrum_id":"CCMSLIB00017240852","spectrum_index":17660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 406.1479 Da; putative annotation: N/A; putative formula: C20H27N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.24,"smiles":null,"spectrum_id":"CCMSLIB00017240853","spectrum_index":17661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norephedrine (delta mass: 51.995 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017240856","spectrum_index":17662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ305901 Imidacloprid-guanidine|Desnitro-imidacloprid|1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-1H-imidazol-2-amine (delta mass: 120.0352 Da; putative annotation: N/A; putative formula: C3H8N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.11,"smiles":null,"spectrum_id":"CCMSLIB00017240857","spectrum_index":17663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 42.0471 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.269,"smiles":null,"spectrum_id":"CCMSLIB00017240860","spectrum_index":17664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5S)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one (delta mass: 24.0001 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017240861","spectrum_index":17665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 149.0331 Da; putative annotation: N/A; putative formula: C5H11NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.172,"smiles":null,"spectrum_id":"CCMSLIB00017240864","spectrum_index":17666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 841.4788 Da; putative annotation: N/A; putative formula: C52H59N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1004.54,"smiles":null,"spectrum_id":"CCMSLIB00017240866","spectrum_index":17667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .gamma.-Linolenoyl ethanolamide (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.295,"smiles":null,"spectrum_id":"CCMSLIB00017240868","spectrum_index":17668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4,8,12-Trimethylcyclotetradeca-3,7,11-trien-1-yl)propan-2-ol (delta mass: 16.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.299,"smiles":null,"spectrum_id":"CCMSLIB00017240870","spectrum_index":17669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 62.0004 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017240872","spectrum_index":17670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 28.0312 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":100.112,"smiles":null,"spectrum_id":"CCMSLIB00017240874","spectrum_index":17671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.4]nonane-2,4-dione (delta mass: 626.4982 Da; putative annotation: N/A; putative formula: C35H70N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.58,"smiles":null,"spectrum_id":"CCMSLIB00017240876","spectrum_index":17672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 488.341 Da; putative annotation: N/A; putative formula: C25H44N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.428,"smiles":null,"spectrum_id":"CCMSLIB00017240879","spectrum_index":17673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 361.2456 Da; putative annotation: N/A; putative formula: C22H37NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.472,"smiles":null,"spectrum_id":"CCMSLIB00017240880","spectrum_index":17674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 220.183 Da; putative annotation: N/A; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.285,"smiles":null,"spectrum_id":"CCMSLIB00017240883","spectrum_index":17675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chaulmoogric Acid (delta mass: 36.0218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.269,"smiles":null,"spectrum_id":"CCMSLIB00017240884","spectrum_index":17676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-hydroxybenzoate (delta mass: 325.2619 Da; putative annotation: N/A; putative formula: C19H35NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.316,"smiles":null,"spectrum_id":"CCMSLIB00017240887","spectrum_index":17677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 347.2037 Da; putative annotation: N/A; putative formula: C27H25NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.29,"smiles":null,"spectrum_id":"CCMSLIB00017240888","spectrum_index":17678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 70.9849 Da; putative annotation: N/A; putative formula: C2HNS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.217,"smiles":null,"spectrum_id":"CCMSLIB00017240891","spectrum_index":17679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 104.1032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.33,"smiles":null,"spectrum_id":"CCMSLIB00017240893","spectrum_index":17680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 54.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.28,"smiles":null,"spectrum_id":"CCMSLIB00017240895","spectrum_index":17681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 88.0719 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.33,"smiles":null,"spectrum_id":"CCMSLIB00017240897","spectrum_index":17682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(phenylmethoxy)-2H-3,4,5,6-tetrahydropyra n-3-yl]acetamide CollisionEnergy:102040\"\" (delta mass: 167.0492 Da; putative annotation: N/A; putative formula: C8H10NOP)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.193,"smiles":null,"spectrum_id":"CCMSLIB00017240899","spectrum_index":17683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 129.0519 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.127,"smiles":null,"spectrum_id":"CCMSLIB00017240901","spectrum_index":17684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 140.0625 Da; putative annotation: N/A; putative formula: C11H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.123,"smiles":null,"spectrum_id":"CCMSLIB00017240903","spectrum_index":17685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 28.0312 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.191,"smiles":null,"spectrum_id":"CCMSLIB00017240905","spectrum_index":17686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 45.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.139,"smiles":null,"spectrum_id":"CCMSLIB00017240908","spectrum_index":17687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-3-carbaldehyde (delta mass: 13.999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.05,"smiles":null,"spectrum_id":"CCMSLIB00017240909","spectrum_index":17688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 90.0835 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017240912","spectrum_index":17689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 108.1295 Da; putative annotation: N/A; putative formula: C9H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.262,"smiles":null,"spectrum_id":"CCMSLIB00017240913","spectrum_index":17690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 405.1718 Da; putative annotation: N/A; putative formula: C22H24N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.213,"smiles":null,"spectrum_id":"CCMSLIB00017240916","spectrum_index":17691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heraclenol (delta mass: 98.0426 Da; putative annotation: N/A; putative formula: H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.145,"smiles":null,"spectrum_id":"CCMSLIB00017240917","spectrum_index":17692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Dec-9-enylpentanedioic acid (delta mass: 36.0361 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.227,"smiles":null,"spectrum_id":"CCMSLIB00017240920","spectrum_index":17693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 94.0782 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.201,"smiles":null,"spectrum_id":"CCMSLIB00017240921","spectrum_index":17694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 729.2529 Da; putative annotation: N/A; putative formula: C51H31N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1073.44,"smiles":null,"spectrum_id":"CCMSLIB00017240924","spectrum_index":17695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 17.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.097,"smiles":null,"spectrum_id":"CCMSLIB00017240925","spectrum_index":17696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C22:6 (delta mass: 100.0723 Da; putative annotation: N/A; putative formula: C6H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.341,"smiles":null,"spectrum_id":"CCMSLIB00017240928","spectrum_index":17697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 168.1147 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.285,"smiles":null,"spectrum_id":"CCMSLIB00017240929","spectrum_index":17698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 60.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.145,"smiles":null,"spectrum_id":"CCMSLIB00017240931","spectrum_index":17699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexanone, 2-(ethylamino)-2-phenyl- (delta mass: 238.9509 Da; putative annotation: N/A; putative formula: C5HN7O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.105,"smiles":null,"spectrum_id":"CCMSLIB00017240933","spectrum_index":17700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 122.0368 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.133,"smiles":null,"spectrum_id":"CCMSLIB00017240935","spectrum_index":17701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 64.9552 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.018,"smiles":null,"spectrum_id":"CCMSLIB00017240937","spectrum_index":17702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 401.2266 Da; putative annotation: N/A; putative formula: C19H36N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.292,"smiles":null,"spectrum_id":"CCMSLIB00017240939","spectrum_index":17703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrachcinidine (delta mass: 174.0521 Da; putative annotation: N/A; putative formula: C4H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.248,"smiles":null,"spectrum_id":"CCMSLIB00017240941","spectrum_index":17704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycodeoxycholic acid (delta mass: 176.1086 Da; putative annotation: N/A; putative formula: C7H17N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.43,"smiles":null,"spectrum_id":"CCMSLIB00017240943","spectrum_index":17705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,3-Tetramethylbicyclo[2.2.1]heptan-2-ol (delta mass: 42.0114 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.17,"smiles":null,"spectrum_id":"CCMSLIB00017240945","spectrum_index":17706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 25.9811 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.115,"smiles":null,"spectrum_id":"CCMSLIB00017240948","spectrum_index":17707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 123.0092 Da; putative annotation: N/A; putative formula: C2H6NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.278,"smiles":null,"spectrum_id":"CCMSLIB00017240950","spectrum_index":17708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D3 (delta mass: 74.045 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.386,"smiles":null,"spectrum_id":"CCMSLIB00017240952","spectrum_index":17709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 179.0794 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.256,"smiles":null,"spectrum_id":"CCMSLIB00017240954","spectrum_index":17710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 144.0427 Da; putative annotation: N/A; putative formula: C7H12O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.306,"smiles":null,"spectrum_id":"CCMSLIB00017240956","spectrum_index":17711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(hydroxymethyl)-4,9a-dimethyl-2,7,8,9-tetrahydro-1H-benzo[7]annulen-3-one (delta mass: 26.0154 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017240959","spectrum_index":17712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 26.0155 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.185,"smiles":null,"spectrum_id":"CCMSLIB00017240960","spectrum_index":17713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 178.1153 Da; putative annotation: N/A; putative formula: C15H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.353,"smiles":null,"spectrum_id":"CCMSLIB00017240963","spectrum_index":17714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxycodone (delta mass: 170.1019 Da; putative annotation: N/A; putative formula: C4H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.241,"smiles":null,"spectrum_id":"CCMSLIB00017240964","spectrum_index":17715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinanethromboxane A2 (delta mass: 125.0835 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.388,"smiles":null,"spectrum_id":"CCMSLIB00017240967","spectrum_index":17716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 155.1678 Da; putative annotation: N/A; putative formula: C10H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.249,"smiles":null,"spectrum_id":"CCMSLIB00017240968","spectrum_index":17717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.,16.alpha.-diol-17-one (delta mass: 60.0359 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.247,"smiles":null,"spectrum_id":"CCMSLIB00017240970","spectrum_index":17718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 147.0895 Da; putative annotation: N/A; putative formula: C6H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.155,"smiles":null,"spectrum_id":"CCMSLIB00017240972","spectrum_index":17719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU162308 Codeine|(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-ol (delta mass: 21.0081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.168,"smiles":null,"spectrum_id":"CCMSLIB00017240975","spectrum_index":17720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 244.0715 Da; putative annotation: N/A; putative formula: C3H8N12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.132,"smiles":null,"spectrum_id":"CCMSLIB00017240976","spectrum_index":17721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisabolol CollisionEnergy:205060 (delta mass: 27.0115 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.217,"smiles":null,"spectrum_id":"CCMSLIB00017240979","spectrum_index":17722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 110.0369 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017240980","spectrum_index":17723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 25.0034 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.084,"smiles":null,"spectrum_id":"CCMSLIB00017240983","spectrum_index":17724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.087,"smiles":null,"spectrum_id":"CCMSLIB00017240984","spectrum_index":17725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 229.0739 Da; putative annotation: N/A; putative formula: C13H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.15,"smiles":null,"spectrum_id":"CCMSLIB00017240987","spectrum_index":17726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Resibufogenin (delta mass: 130.0689 Da; putative annotation: N/A; putative formula: C4H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.306,"smiles":null,"spectrum_id":"CCMSLIB00017240988","spectrum_index":17727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 118.0631 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017240991","spectrum_index":17728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 156.0578 Da; putative annotation: N/A; putative formula: C11H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.107,"smiles":null,"spectrum_id":"CCMSLIB00017240993","spectrum_index":17729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 110.0501 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.131,"smiles":null,"spectrum_id":"CCMSLIB00017240995","spectrum_index":17730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxybenzoic acid (delta mass: 117.034 Da; putative annotation: N/A; putative formula: C4H8NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.099,"smiles":null,"spectrum_id":"CCMSLIB00017240997","spectrum_index":17731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 13.0317 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.123,"smiles":null,"spectrum_id":"CCMSLIB00017241000","spectrum_index":17732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 9.8066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.898,"smiles":null,"spectrum_id":"CCMSLIB00017241001","spectrum_index":17733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 14.9957 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.097,"smiles":null,"spectrum_id":"CCMSLIB00017241004","spectrum_index":17734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301321 Ethylbeta-carboline (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.117,"smiles":null,"spectrum_id":"CCMSLIB00017241005","spectrum_index":17735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 373.2976 Da; putative annotation: N/A; putative formula: C24H39NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.389,"smiles":null,"spectrum_id":"CCMSLIB00017241008","spectrum_index":17736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 17.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.127,"smiles":null,"spectrum_id":"CCMSLIB00017241009","spectrum_index":17737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 110.0946 Da; putative annotation: N/A; putative formula: C5H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.139,"smiles":null,"spectrum_id":"CCMSLIB00017241012","spectrum_index":17738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Gln (delta mass: 111.032 Da; putative annotation: D-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.177,"smiles":null,"spectrum_id":"CCMSLIB00017241013","spectrum_index":17739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Gly-Leu (delta mass: 113.0839 Da; putative annotation: Massbank:PB000396 Isoleucine|2-amino-3-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.229,"smiles":null,"spectrum_id":"CCMSLIB00017241016","spectrum_index":17740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid from NIST14 (delta mass: 278.2246 Da; putative annotation: 9(10)-Epoxy-12Z-octadecenoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.451,"smiles":null,"spectrum_id":"CCMSLIB00017241017","spectrum_index":17741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 264.2465 Da; putative annotation: trans-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.379,"smiles":null,"spectrum_id":"CCMSLIB00017241020","spectrum_index":17742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spirodionic acid (delta mass: 264.1359 Da; putative annotation: 4-(2,7-Dihydroxy-6-methylheptan-2-yl)-3-hydroxybenzoic acid; putative formula: C15H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.279,"smiles":null,"spectrum_id":"CCMSLIB00017241021","spectrum_index":17743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 350.0897 Da; putative annotation: (Phenoxymethyl)penicilloic acid; putative formula: C16H18N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.201,"smiles":null,"spectrum_id":"CCMSLIB00017241024","spectrum_index":17744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 310.2141 Da; putative annotation: (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.425,"smiles":null,"spectrum_id":"CCMSLIB00017241025","spectrum_index":17745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Prolylphenylalanine (delta mass: 226.097 Da; putative annotation: Pro-Glu; putative formula: C10H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.236,"smiles":null,"spectrum_id":"CCMSLIB00017241028","spectrum_index":17746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 152.1198 Da; putative annotation: (R)-(+)-Citronellic acid; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.357,"smiles":null,"spectrum_id":"CCMSLIB00017241029","spectrum_index":17747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 332.2355 Da; putative annotation: 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid; putative formula: C21H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.462,"smiles":null,"spectrum_id":"CCMSLIB00017241031","spectrum_index":17748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 132.0946 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.431,"smiles":null,"spectrum_id":"CCMSLIB00017241033","spectrum_index":17749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 147.0688 Da; putative annotation: 2-Hydroxy-N-phenylpropanamide; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017241036","spectrum_index":17750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 280.0945 Da; putative annotation: 2-O-(Phenylacetyl)-.beta.-D-glucopyranose; putative formula: C14H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.155,"smiles":null,"spectrum_id":"CCMSLIB00017241037","spectrum_index":17751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Chlorophenyl)-1H-pyrazol-5-amine (delta mass: 120.042 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.09,"smiles":null,"spectrum_id":"CCMSLIB00017241040","spectrum_index":17752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 99.0403 Da; putative annotation: N/A; putative formula: C3H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.1,"smiles":null,"spectrum_id":"CCMSLIB00017241041","spectrum_index":17753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethyl-4-hydroxybenzaldehyde (delta mass: 35.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.113,"smiles":null,"spectrum_id":"CCMSLIB00017241044","spectrum_index":17754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 182.1459 Da; putative annotation: N/A; putative formula: C15H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.201,"smiles":null,"spectrum_id":"CCMSLIB00017241045","spectrum_index":17755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bellericagenin B (delta mass: 51.0308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.378,"smiles":null,"spectrum_id":"CCMSLIB00017241048","spectrum_index":17756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 157.1062 Da; putative annotation: N/A; putative formula: C4H11N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.62,"smiles":null,"spectrum_id":"CCMSLIB00017241049","spectrum_index":17757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 88.0674 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.315,"smiles":null,"spectrum_id":"CCMSLIB00017241051","spectrum_index":17758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 13.8709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.082,"smiles":null,"spectrum_id":"CCMSLIB00017241053","spectrum_index":17759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-nitro- (delta mass: 106.0883 Da; putative annotation: N/A; putative formula: C7H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.248,"smiles":null,"spectrum_id":"CCMSLIB00017241056","spectrum_index":17760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Putative (3-hydroxyheptadecanoyl)glycine (delta mass: 458.2932 Da; putative annotation: N/A; putative formula: C30H38N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.573,"smiles":null,"spectrum_id":"CCMSLIB00017241057","spectrum_index":17761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 101.0111 Da; putative annotation: N/A; putative formula: C3H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.113,"smiles":null,"spectrum_id":"CCMSLIB00017241060","spectrum_index":17762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Docosenoic acid (delta mass: 54.0472 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.373,"smiles":null,"spectrum_id":"CCMSLIB00017241061","spectrum_index":17763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 288.0831 Da; putative annotation: N/A; putative formula: C9H8N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.232,"smiles":null,"spectrum_id":"CCMSLIB00017241064","spectrum_index":17764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 103.048 Da; putative annotation: N/A; putative formula: CH5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.4,"smiles":null,"spectrum_id":"CCMSLIB00017241065","spectrum_index":17765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norharmane (delta mass: 31.0521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.128,"smiles":null,"spectrum_id":"CCMSLIB00017241068","spectrum_index":17766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 85.0275 Da; putative annotation: N/A; putative formula: C2H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.14,"smiles":null,"spectrum_id":"CCMSLIB00017241070","spectrum_index":17767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7E)-11-Hydroxy-4,5,8,13,13-pentamethyl-3-(2-methylpropyl)-3,3a,4,6a,9,10,11,11a,14a,15-decahydro-1H-[1,3]dioxolo[9,10]oxacyclododecino[2,3-d]isoindole-1,16(2H)-dione (delta mass: 118.0795 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.38,"smiles":null,"spectrum_id":"CCMSLIB00017241072","spectrum_index":17768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1.alpha.,2.alpha.,3.beta.,5.Xi.,9.Xi.,13.Xi.,14.Xi.,18.Xi.)-1,2,3,22,23,29-Hexahydroxy-13,27-cycloolean-11-en-28-oic acid (delta mass: 82.0493 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.376,"smiles":null,"spectrum_id":"CCMSLIB00017241075","spectrum_index":17769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 649.5268 Da; putative annotation: N/A; putative formula: C39H71NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.754,"smiles":null,"spectrum_id":"CCMSLIB00017241076","spectrum_index":17770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 113.9989 Da; putative annotation: N/A; putative formula: C3H3N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.106,"smiles":null,"spectrum_id":"CCMSLIB00017241079","spectrum_index":17771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 101.0418 Da; putative annotation: N/A; putative formula: C3H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.143,"smiles":null,"spectrum_id":"CCMSLIB00017241080","spectrum_index":17772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 91.1001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.311,"smiles":null,"spectrum_id":"CCMSLIB00017241083","spectrum_index":17773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 492.5931 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.674,"smiles":null,"spectrum_id":"CCMSLIB00017241084","spectrum_index":17774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 221.0356 Da; putative annotation: N/A; putative formula: C7H11NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.122,"smiles":null,"spectrum_id":"CCMSLIB00017241087","spectrum_index":17775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-[4-(Dimethylamino)benzylidene]-1,3-dihydro-2H-indol-2-one (delta mass: 17.9831 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017241088","spectrum_index":17776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 179.0227 Da; putative annotation: N/A; putative formula: C9H9NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.291,"smiles":null,"spectrum_id":"CCMSLIB00017241091","spectrum_index":17777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 260.2143 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.285,"smiles":null,"spectrum_id":"CCMSLIB00017241092","spectrum_index":17778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 234.824 Da; putative annotation: N/A; putative formula: CHNO-1S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.91,"smiles":null,"spectrum_id":"CCMSLIB00017241095","spectrum_index":17779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 18.0654 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.137,"smiles":null,"spectrum_id":"CCMSLIB00017241096","spectrum_index":17780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.279,"smiles":null,"spectrum_id":"CCMSLIB00017241099","spectrum_index":17781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385743-01_C67H108O33_beta-D-Xylopyranose, O-beta-D-xylopyranosyl-(1->3)-O-alpha-L-arabinopyranosyl-(1->4)-O-6-deoxy-3-O-[(2S,3R,4R)-tetrahydro-3,4-dihydroxy-4-(hydroxymethyl)-2-furanyl]-alpha-L-mannopyranosyl-(1->2)-1-O-[(3beta,5xi,9xi,16alpha)-3-[(6-O-alpha-L-arabinopyranosyl-beta-D-glucopyranosyl)oxy]-16-hydroxy-28-oxoolean-12-en-28-yl]- (delta mass: 192.0395 Da; putative annotation: N/A; putative formula: C6H4N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1633.72,"smiles":null,"spectrum_id":"CCMSLIB00017241101","spectrum_index":17782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4'-Ethenyl-2'-hydroxy-1,4',4a-trimethyl-5-oxospiro[2,3,4,7,8,8a-hexahydronaphthalene-6,1'-cyclopentane]-1-carboxylic acid (delta mass: 694.3237 Da; putative annotation: N/A; putative formula: C38H46N8OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1029.55,"smiles":null,"spectrum_id":"CCMSLIB00017241103","spectrum_index":17783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347828-02_C24H37NO5_(7E)-11,12,13-Trihydroxy-3-isobutyl-4,5,8-trimethyl-3,3a,4,6a,9,10,11,12,13,14-decahydro-1H-cycloundeca[d]isoindole-1,15(2H)-dione (delta mass: 358.1739 Da; putative annotation: N/A; putative formula: C16H26N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.448,"smiles":null,"spectrum_id":"CCMSLIB00017241105","spectrum_index":17784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3aS,6S,7R,8aR)-8-Hydroxy-6,8-dimethyl-3-methylidenehexahydro-3'H-spiro[cyclohepta[b]furan-7,2'-furan]-2,5'(3H,4'H)-dione (delta mass: 261.1385 Da; putative annotation: N/A; putative formula: C16H15N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.277,"smiles":null,"spectrum_id":"CCMSLIB00017241107","spectrum_index":17785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cysmethynil (delta mass: 73.0923 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.351,"smiles":null,"spectrum_id":"CCMSLIB00017241109","spectrum_index":17786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 8.4294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.5,"smiles":null,"spectrum_id":"CCMSLIB00017241111","spectrum_index":17787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 539.5118 Da; putative annotation: N/A; putative formula: C34H69NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.65,"smiles":null,"spectrum_id":"CCMSLIB00017241113","spectrum_index":17788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 100.1767 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.237,"smiles":null,"spectrum_id":"CCMSLIB00017241116","spectrum_index":17789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.107,"smiles":null,"spectrum_id":"CCMSLIB00017241117","spectrum_index":17790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017241120","spectrum_index":17791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-methoxybenzoic acid (delta mass: 134.048 Da; putative annotation: N/A; putative formula: C7H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.113,"smiles":null,"spectrum_id":"CCMSLIB00017241121","spectrum_index":17792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 172.127 Da; putative annotation: N/A; putative formula: C10H20S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.354,"smiles":null,"spectrum_id":"CCMSLIB00017241124","spectrum_index":17793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dehydrocoelenterazine (delta mass: 191.0692 Da; putative annotation: N/A; putative formula: C9H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.219,"smiles":null,"spectrum_id":"CCMSLIB00017241125","spectrum_index":17794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 203.0798 Da; putative annotation: N/A; putative formula: C3H10N9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.171,"smiles":null,"spectrum_id":"CCMSLIB00017241127","spectrum_index":17795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Thr (delta mass: 111.0318 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.14,"smiles":null,"spectrum_id":"CCMSLIB00017241129","spectrum_index":17796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE\"\" (delta mass: 171.0525 Da; putative annotation: N/A; putative formula: C7H9NO4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.154,"smiles":null,"spectrum_id":"CCMSLIB00017241131","spectrum_index":17797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 228.054 Da; putative annotation: N/A; putative formula: C5H8N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.14,"smiles":null,"spectrum_id":"CCMSLIB00017241134","spectrum_index":17798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 114.9579 Da; putative annotation: N/A; putative formula: CH-2N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.039,"smiles":null,"spectrum_id":"CCMSLIB00017241135","spectrum_index":17799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 280.2076 Da; putative annotation: N/A; putative formula: C16H29N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.268,"smiles":null,"spectrum_id":"CCMSLIB00017241138","spectrum_index":17800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 155.0946 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.233,"smiles":null,"spectrum_id":"CCMSLIB00017241139","spectrum_index":17801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 268.0365 Da; putative annotation: N/A; putative formula: C7H12N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.16,"smiles":null,"spectrum_id":"CCMSLIB00017241142","spectrum_index":17802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 667.5413 Da; putative annotation: N/A; putative formula: C40H69N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.752,"smiles":null,"spectrum_id":"CCMSLIB00017241143","spectrum_index":17803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 72.021 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.118,"smiles":null,"spectrum_id":"CCMSLIB00017241146","spectrum_index":17804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 8.0463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.096,"smiles":null,"spectrum_id":"CCMSLIB00017241149","spectrum_index":17805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethylbenzoic acid (delta mass: 8.0281 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.104,"smiles":null,"spectrum_id":"CCMSLIB00017241150","spectrum_index":17806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 644.18 Da; putative annotation: N/A; putative formula: C24H36O20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1028.33,"smiles":null,"spectrum_id":"CCMSLIB00017241152","spectrum_index":17807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 119.1054 Da; putative annotation: N/A; putative formula: H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.156,"smiles":null,"spectrum_id":"CCMSLIB00017241154","spectrum_index":17808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 482.4486 Da; putative annotation: N/A; putative formula: C34H58O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.592,"smiles":null,"spectrum_id":"CCMSLIB00017241156","spectrum_index":17809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 181.1554 Da; putative annotation: N/A; putative formula: C10H19N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.21,"smiles":null,"spectrum_id":"CCMSLIB00017241158","spectrum_index":17810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 50.0517 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.294,"smiles":null,"spectrum_id":"CCMSLIB00017241161","spectrum_index":17811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017241162","spectrum_index":17812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 201.042 Da; putative annotation: N/A; putative formula: C5H8N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.117,"smiles":null,"spectrum_id":"CCMSLIB00017241165","spectrum_index":17813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 42.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.143,"smiles":null,"spectrum_id":"CCMSLIB00017241166","spectrum_index":17814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 62.0611 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.403,"smiles":null,"spectrum_id":"CCMSLIB00017241169","spectrum_index":17815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 116.0994 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.441,"smiles":null,"spectrum_id":"CCMSLIB00017241170","spectrum_index":17816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heneicosapentaenoic acid (delta mass: 94.0825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.33,"smiles":null,"spectrum_id":"CCMSLIB00017241173","spectrum_index":17817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 42.011 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017241174","spectrum_index":17818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (25S)-7-Dafachronic acid (delta mass: 43.9874 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.308,"smiles":null,"spectrum_id":"CCMSLIB00017241177","spectrum_index":17819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 191.115 Da; putative annotation: N/A; putative formula: C8H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.316,"smiles":null,"spectrum_id":"CCMSLIB00017241178","spectrum_index":17820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxycholesterol (delta mass: 39.9629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.32,"smiles":null,"spectrum_id":"CCMSLIB00017241181","spectrum_index":17821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid (delta mass: 152.0538 Da; putative annotation: N/A; putative formula: C2H8N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.149,"smiles":null,"spectrum_id":"CCMSLIB00017241182","spectrum_index":17822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 352.0238 Da; putative annotation: N/A; putative formula: C12H12N6OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.122,"smiles":null,"spectrum_id":"CCMSLIB00017241184","spectrum_index":17823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxydodecanoic acid (delta mass: 52.0676 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.247,"smiles":null,"spectrum_id":"CCMSLIB00017241186","spectrum_index":17824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 40.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.113,"smiles":null,"spectrum_id":"CCMSLIB00017241189","spectrum_index":17825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-3-piperidinamine (delta mass: 50.0272 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.145,"smiles":null,"spectrum_id":"CCMSLIB00017241191","spectrum_index":17826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 271.117 Da; putative annotation: N/A; putative formula: C11H17N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.196,"smiles":null,"spectrum_id":"CCMSLIB00017241193","spectrum_index":17827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Isolongifolol (delta mass: 46.0062 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.212,"smiles":null,"spectrum_id":"CCMSLIB00017241195","spectrum_index":17828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 391.3449 Da; putative annotation: N/A; putative formula: C25H45NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.535,"smiles":null,"spectrum_id":"CCMSLIB00017241197","spectrum_index":17829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369609 Salicylic acid|2-hydroxybenzoic acid (delta mass: 67.0435 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.083,"smiles":null,"spectrum_id":"CCMSLIB00017241199","spectrum_index":17830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Putative (3-hydroxyhexadecanoyl)glycine (aka Commendamide) (delta mass: 269.2685 Da; putative annotation: N/A; putative formula: C13H31N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.532,"smiles":null,"spectrum_id":"CCMSLIB00017241202","spectrum_index":17831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 189.0475 Da; putative annotation: N/A; putative formula: C8H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.16,"smiles":null,"spectrum_id":"CCMSLIB00017241204","spectrum_index":17832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 86.0377 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.317,"smiles":null,"spectrum_id":"CCMSLIB00017241206","spectrum_index":17833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 132.0382 Da; putative annotation: N/A; putative formula: C4H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.098,"smiles":null,"spectrum_id":"CCMSLIB00017241209","spectrum_index":17834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 178.1006 Da; putative annotation: N/A; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.312,"smiles":null,"spectrum_id":"CCMSLIB00017241210","spectrum_index":17835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 111.1857 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.281,"smiles":null,"spectrum_id":"CCMSLIB00017241213","spectrum_index":17836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine methyl ester (delta mass: 84.0576 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.132,"smiles":null,"spectrum_id":"CCMSLIB00017241214","spectrum_index":17837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16.alpha.-Hydroxypregnenolone (delta mass: 17.0274 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.27,"smiles":null,"spectrum_id":"CCMSLIB00017241217","spectrum_index":17838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 41.8768 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.921,"smiles":null,"spectrum_id":"CCMSLIB00017241218","spectrum_index":17839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12S-Hydroxy-5Z,8E,10E-heptadecatrienoic acid (delta mass: 72.0355 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.247,"smiles":null,"spectrum_id":"CCMSLIB00017241221","spectrum_index":17840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 645.3739 Da; putative annotation: N/A; putative formula: C33H51N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.503,"smiles":null,"spectrum_id":"CCMSLIB00017241222","spectrum_index":17841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 280.1714 Da; putative annotation: N/A; putative formula: C14H24N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.278,"smiles":null,"spectrum_id":"CCMSLIB00017241225","spectrum_index":17842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSAMINE (delta mass: 146.5115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.598,"smiles":null,"spectrum_id":"CCMSLIB00017241226","spectrum_index":17843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Val (delta mass: 115.0265 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.16,"smiles":null,"spectrum_id":"CCMSLIB00017241228","spectrum_index":17844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 100.0525 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017241230","spectrum_index":17845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dichlorokynurenic acid (delta mass: 17.1196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017241233","spectrum_index":17846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 276.1146 Da; putative annotation: N/A; putative formula: C11H20N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.19,"smiles":null,"spectrum_id":"CCMSLIB00017241234","spectrum_index":17847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.284,"smiles":null,"spectrum_id":"CCMSLIB00017241236","spectrum_index":17848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyoctadecanoic acid (delta mass: 324.3026 Da; putative annotation: N/A; putative formula: C21H40O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.576,"smiles":null,"spectrum_id":"CCMSLIB00017241238","spectrum_index":17849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-Gentiobiose (delta mass: 133.0738 Da; putative annotation: N/A; putative formula: C5H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.197,"smiles":null,"spectrum_id":"CCMSLIB00017241241","spectrum_index":17850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 158.1103 Da; putative annotation: N/A; putative formula: C12H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.197,"smiles":null,"spectrum_id":"CCMSLIB00017241242","spectrum_index":17851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-tryptophan CollisionEnergy:102040 (delta mass: 56.0633 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.171,"smiles":null,"spectrum_id":"CCMSLIB00017241245","spectrum_index":17852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 396.114 Da; putative annotation: N/A; putative formula: C13H16N8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.175,"smiles":null,"spectrum_id":"CCMSLIB00017241246","spectrum_index":17853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 144.0422 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.149,"smiles":null,"spectrum_id":"CCMSLIB00017241249","spectrum_index":17854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 322.1416 Da; putative annotation: N/A; putative formula: C17H22O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.291,"smiles":null,"spectrum_id":"CCMSLIB00017241251","spectrum_index":17855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 35.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.191,"smiles":null,"spectrum_id":"CCMSLIB00017241253","spectrum_index":17856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ricinoleic acid methyl ester (delta mass: 144.13 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.404,"smiles":null,"spectrum_id":"CCMSLIB00017241255","spectrum_index":17857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 80.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.32,"smiles":null,"spectrum_id":"CCMSLIB00017241257","spectrum_index":17858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 180.0609 Da; putative annotation: N/A; putative formula: C10H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.136,"smiles":null,"spectrum_id":"CCMSLIB00017241259","spectrum_index":17859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid from NIST14 (delta mass: 68.0032 Da; putative annotation: N/A; putative formula: C7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.23,"smiles":null,"spectrum_id":"CCMSLIB00017241261","spectrum_index":17860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 137.0585 Da; putative annotation: N/A; putative formula: C6H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.119,"smiles":null,"spectrum_id":"CCMSLIB00017241264","spectrum_index":17861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 13.0569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017241266","spectrum_index":17862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of b-Eudesmol (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.227,"smiles":null,"spectrum_id":"CCMSLIB00017241268","spectrum_index":17863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-hydroxybenzo(a)pyrene (delta mass: 154.1939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.29,"smiles":null,"spectrum_id":"CCMSLIB00017241271","spectrum_index":17864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 457.3051 Da; putative annotation: N/A; putative formula: C25H39N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.365,"smiles":null,"spectrum_id":"CCMSLIB00017241272","spectrum_index":17865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 88.052 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.143,"smiles":null,"spectrum_id":"CCMSLIB00017241275","spectrum_index":17866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 74.0578 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.155,"smiles":null,"spectrum_id":"CCMSLIB00017241276","spectrum_index":17867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 144.0963 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.323,"smiles":null,"spectrum_id":"CCMSLIB00017241279","spectrum_index":17868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenoxyethanol (delta mass: 83.0189 Da; putative annotation: N/A; putative formula: C4H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.094,"smiles":null,"spectrum_id":"CCMSLIB00017241281","spectrum_index":17869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 118.0445 Da; putative annotation: N/A; putative formula: C5H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.131,"smiles":null,"spectrum_id":"CCMSLIB00017241283","spectrum_index":17870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 802.259 Da; putative annotation: N/A; putative formula: C44H43N4O7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1307.44,"smiles":null,"spectrum_id":"CCMSLIB00017241285","spectrum_index":17871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 380.2078 Da; putative annotation: N/A; putative formula: C16H33N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.256,"smiles":null,"spectrum_id":"CCMSLIB00017241288","spectrum_index":17872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 23.0166 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.161,"smiles":null,"spectrum_id":"CCMSLIB00017241289","spectrum_index":17873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:102040 (delta mass: 213.2073 Da; putative annotation: N/A; putative formula: C9H23N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.475,"smiles":null,"spectrum_id":"CCMSLIB00017241292","spectrum_index":17874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 87.0411 Da; putative annotation: N/A; putative formula: C2H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.179,"smiles":null,"spectrum_id":"CCMSLIB00017241294","spectrum_index":17875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidine (delta mass: 44.025 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.205,"smiles":null,"spectrum_id":"CCMSLIB00017241296","spectrum_index":17876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 73.0282 Da; putative annotation: N/A; putative formula: CH3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.146,"smiles":null,"spectrum_id":"CCMSLIB00017241298","spectrum_index":17877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 592.3748 Da; putative annotation: N/A; putative formula: C34H44N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.654,"smiles":null,"spectrum_id":"CCMSLIB00017241300","spectrum_index":17878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 74.8214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.96,"smiles":null,"spectrum_id":"CCMSLIB00017241302","spectrum_index":17879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 509.3576 Da; putative annotation: N/A; putative formula: C36H48NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.418,"smiles":null,"spectrum_id":"CCMSLIB00017241304","spectrum_index":17880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-aminopurine (delta mass: 158.0472 Da; putative annotation: N/A; putative formula: C3H7N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.104,"smiles":null,"spectrum_id":"CCMSLIB00017241307","spectrum_index":17881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 139.0631 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.134,"smiles":null,"spectrum_id":"CCMSLIB00017241308","spectrum_index":17882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 938.5159 Da; putative annotation: N/A; putative formula: C45H70N12O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1101.58,"smiles":null,"spectrum_id":"CCMSLIB00017241310","spectrum_index":17883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1109.5488 Da; putative annotation: N/A; putative formula: C58H83N3O16S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1272.61,"smiles":null,"spectrum_id":"CCMSLIB00017241312","spectrum_index":17884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 566.8366 Da; putative annotation: N/A; putative formula: C3H11NO20P6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.934,"smiles":null,"spectrum_id":"CCMSLIB00017241314","spectrum_index":17885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 670.5121 Da; putative annotation: N/A; putative formula: C42H66N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":947.728,"smiles":null,"spectrum_id":"CCMSLIB00017241316","spectrum_index":17886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 577.51 Da; putative annotation: N/A; putative formula: C35H68N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":858.758,"smiles":null,"spectrum_id":"CCMSLIB00017241318","spectrum_index":17887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 259.1785 Da; putative annotation: N/A; putative formula: C13H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.249,"smiles":null,"spectrum_id":"CCMSLIB00017241320","spectrum_index":17888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vanillic acid (delta mass: 178.0821 Da; putative annotation: N/A; putative formula: C11H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.132,"smiles":null,"spectrum_id":"CCMSLIB00017241323","spectrum_index":17889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hexadecyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine (delta mass: 48.0291 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.588,"smiles":null,"spectrum_id":"CCMSLIB00017241325","spectrum_index":17890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 110.1095 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.352,"smiles":null,"spectrum_id":"CCMSLIB00017241327","spectrum_index":17891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1(4H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-6-hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl- (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017241329","spectrum_index":17892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 163.1574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.254,"smiles":null,"spectrum_id":"CCMSLIB00017241331","spectrum_index":17893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.159,"smiles":null,"spectrum_id":"CCMSLIB00017241333","spectrum_index":17894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 195.1621 Da; putative annotation: N/A; putative formula: C12H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.478,"smiles":null,"spectrum_id":"CCMSLIB00017241335","spectrum_index":17895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dimethyl-1,3-benzenediol (delta mass: 9.9848 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.06,"smiles":null,"spectrum_id":"CCMSLIB00017241337","spectrum_index":17896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 10.0097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.117,"smiles":null,"spectrum_id":"CCMSLIB00017241339","spectrum_index":17897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Acetamidocoumarin (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.061,"smiles":null,"spectrum_id":"CCMSLIB00017241341","spectrum_index":17898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 45.9017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.04,"smiles":null,"spectrum_id":"CCMSLIB00017241343","spectrum_index":17899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 72.0209 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.133,"smiles":null,"spectrum_id":"CCMSLIB00017241345","spectrum_index":17900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Azepan-1-ylaniline (delta mass: 45.0104 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.165,"smiles":null,"spectrum_id":"CCMSLIB00017241348","spectrum_index":17901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 77.0481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017241349","spectrum_index":17902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Didodecyl 3,3'-thiodipropionate oxide from NIST14 - Hydroxylated variant ? (delta mass: 575.4574 Da; putative annotation: N/A; putative formula: C32H65NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1106.87,"smiles":null,"spectrum_id":"CCMSLIB00017241352","spectrum_index":17903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-propanoic acid (delta mass: 320.1375 Da; putative annotation: N/A; putative formula: C18H27O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.224,"smiles":null,"spectrum_id":"CCMSLIB00017241353","spectrum_index":17904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 96.0572 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.289,"smiles":null,"spectrum_id":"CCMSLIB00017241356","spectrum_index":17905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid (delta mass: 102.0312 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.185,"smiles":null,"spectrum_id":"CCMSLIB00017241357","spectrum_index":17906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 125.0567 Da; putative annotation: N/A; putative formula: CH3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017241360","spectrum_index":17907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 53.0468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.399,"smiles":null,"spectrum_id":"CCMSLIB00017241362","spectrum_index":17908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 75.0579 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.139,"smiles":null,"spectrum_id":"CCMSLIB00017241364","spectrum_index":17909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyethoxy)phenol (delta mass: 174.0315 Da; putative annotation: N/A; putative formula: C10H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.102,"smiles":null,"spectrum_id":"CCMSLIB00017241367","spectrum_index":17910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 218.1235 Da; putative annotation: N/A; putative formula: C14H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.267,"smiles":null,"spectrum_id":"CCMSLIB00017241368","spectrum_index":17911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zizanoic acid (delta mass: 88.0158 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.185,"smiles":null,"spectrum_id":"CCMSLIB00017241371","spectrum_index":17912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tibolone (delta mass: 99.0896 Da; putative annotation: N/A; putative formula: C3H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.306,"smiles":null,"spectrum_id":"CCMSLIB00017241373","spectrum_index":17913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(6-Methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-furaldehyde (delta mass: 269.0602 Da; putative annotation: N/A; putative formula: C15H12NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.109,"smiles":null,"spectrum_id":"CCMSLIB00017241375","spectrum_index":17914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(6-Methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-furaldehyde (delta mass: 151.0557 Da; putative annotation: N/A; putative formula: C8H10NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.104,"smiles":null,"spectrum_id":"CCMSLIB00017241378","spectrum_index":17915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 732.2804 Da; putative annotation: N/A; putative formula: C42H44N4O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":991.403,"smiles":null,"spectrum_id":"CCMSLIB00017241379","spectrum_index":17916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 192.0794 Da; putative annotation: N/A; putative formula: C12H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.175,"smiles":null,"spectrum_id":"CCMSLIB00017241382","spectrum_index":17917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 34.0076 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.094,"smiles":null,"spectrum_id":"CCMSLIB00017241383","spectrum_index":17918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyquinuclidine-3-carbonitrile (delta mass: 44.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.17,"smiles":null,"spectrum_id":"CCMSLIB00017241386","spectrum_index":17919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 311.2463 Da; putative annotation: N/A; putative formula: C18H33NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.614,"smiles":null,"spectrum_id":"CCMSLIB00017241387","spectrum_index":17920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 32.1046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.231,"smiles":null,"spectrum_id":"CCMSLIB00017241389","spectrum_index":17921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 16.1121 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.144,"smiles":null,"spectrum_id":"CCMSLIB00017241391","spectrum_index":17922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 109.0885 Da; putative annotation: N/A; putative formula: C7H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.138,"smiles":null,"spectrum_id":"CCMSLIB00017241393","spectrum_index":17923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 115.074 Da; putative annotation: N/A; putative formula: C4H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.139,"smiles":null,"spectrum_id":"CCMSLIB00017241395","spectrum_index":17924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 15.8675 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.964,"smiles":null,"spectrum_id":"CCMSLIB00017241397","spectrum_index":17925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 130.024 Da; putative annotation: N/A; putative formula: CH2N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.204,"smiles":null,"spectrum_id":"CCMSLIB00017241399","spectrum_index":17926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017241402","spectrum_index":17927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 alcohol (delta mass: 90.0867 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.355,"smiles":null,"spectrum_id":"CCMSLIB00017241403","spectrum_index":17928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 272.1515 Da; putative annotation: N/A; putative formula: C16H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.306,"smiles":null,"spectrum_id":"CCMSLIB00017241405","spectrum_index":17929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 102.0409 Da; putative annotation: N/A; putative formula: C3H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.085,"smiles":null,"spectrum_id":"CCMSLIB00017241407","spectrum_index":17930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxychromanone (delta mass: 46.0763 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.131,"smiles":null,"spectrum_id":"CCMSLIB00017241410","spectrum_index":17931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 116.0657 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.287,"smiles":null,"spectrum_id":"CCMSLIB00017241411","spectrum_index":17932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 100.7888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.885,"smiles":null,"spectrum_id":"CCMSLIB00017241414","spectrum_index":17933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 76.0668 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.121,"smiles":null,"spectrum_id":"CCMSLIB00017241415","spectrum_index":17934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Imidazol-1-ylmethyl)benzoic acid (delta mass: 16.0917 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.173,"smiles":null,"spectrum_id":"CCMSLIB00017241418","spectrum_index":17935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 92.0021 Da; putative annotation: N/A; putative formula: C2H5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.307,"smiles":null,"spectrum_id":"CCMSLIB00017241420","spectrum_index":17936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 10.0571 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.122,"smiles":null,"spectrum_id":"CCMSLIB00017241422","spectrum_index":17937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 731.5555 Da; putative annotation: N/A; putative formula: C51H74NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.616,"smiles":null,"spectrum_id":"CCMSLIB00017241424","spectrum_index":17938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 311.1295 Da; putative annotation: N/A; putative formula: C16H18N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.216,"smiles":null,"spectrum_id":"CCMSLIB00017241426","spectrum_index":17939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 114.0815 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.428,"smiles":null,"spectrum_id":"CCMSLIB00017241428","spectrum_index":17940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 (delta mass: 52.0658 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.604,"smiles":null,"spectrum_id":"CCMSLIB00017241430","spectrum_index":17941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 339.2418 Da; putative annotation: N/A; putative formula: C20H37NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.484,"smiles":null,"spectrum_id":"CCMSLIB00017241433","spectrum_index":17942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Lauramidopropyl betaine|3-(Dodecanoylamino)propyl(carboxymethyl)dimethylammonium|carboxymethyl-[3-(dodecanoylamino)propyl]-dimethylazanium (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.358,"smiles":null,"spectrum_id":"CCMSLIB00017241434","spectrum_index":17943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 128.1207 Da; putative annotation: N/A; putative formula: C8H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.223,"smiles":null,"spectrum_id":"CCMSLIB00017241437","spectrum_index":17944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 27.0114 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.114,"smiles":null,"spectrum_id":"CCMSLIB00017241439","spectrum_index":17945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 102.0108 Da; putative annotation: N/A; putative formula: C7H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.082,"smiles":null,"spectrum_id":"CCMSLIB00017241441","spectrum_index":17946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 413.6749 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.746,"smiles":null,"spectrum_id":"CCMSLIB00017241444","spectrum_index":17947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 14.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.3,"smiles":null,"spectrum_id":"CCMSLIB00017241446","spectrum_index":17948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis,cis-9,12-Octadecadien-1-ol (delta mass: 215.1421 Da; putative annotation: N/A; putative formula: C13H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.41,"smiles":null,"spectrum_id":"CCMSLIB00017241448","spectrum_index":17949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 36.0235 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.224,"smiles":null,"spectrum_id":"CCMSLIB00017241450","spectrum_index":17950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 116.0988 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.31,"smiles":null,"spectrum_id":"CCMSLIB00017241452","spectrum_index":17951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lycorine (delta mass: 17.017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.14,"smiles":null,"spectrum_id":"CCMSLIB00017241455","spectrum_index":17952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-4-yl)-N-(3-methoxypropyl)-1,2,4-oxadiazole-5-carboxamide (delta mass: 14.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.141,"smiles":null,"spectrum_id":"CCMSLIB00017241456","spectrum_index":17953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 38.0465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.148,"smiles":null,"spectrum_id":"CCMSLIB00017241459","spectrum_index":17954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017241461","spectrum_index":17955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.076,"smiles":null,"spectrum_id":"CCMSLIB00017241463","spectrum_index":17956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 142.0989 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.242,"smiles":null,"spectrum_id":"CCMSLIB00017241466","spectrum_index":17957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,3S)-3-hydroxy-1-octenyl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5E)- (delta mass: 489.3098 Da; putative annotation: N/A; putative formula: C29H47NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.563,"smiles":null,"spectrum_id":"CCMSLIB00017241467","spectrum_index":17958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F1.alpha. (delta mass: 86.0492 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.313,"smiles":null,"spectrum_id":"CCMSLIB00017241470","spectrum_index":17959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 190.8976 Da; putative annotation: N/A; putative formula: HNO5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.0,"smiles":null,"spectrum_id":"CCMSLIB00017241471","spectrum_index":17960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12,13-Dihydroxy-9Z-octadecenoic acid (delta mass: 63.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.322,"smiles":null,"spectrum_id":"CCMSLIB00017241474","spectrum_index":17961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 37.9789 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.07,"smiles":null,"spectrum_id":"CCMSLIB00017241475","spectrum_index":17962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 85.0298 Da; putative annotation: N/A; putative formula: C7H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.257,"smiles":null,"spectrum_id":"CCMSLIB00017241478","spectrum_index":17963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 108.0577 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.123,"smiles":null,"spectrum_id":"CCMSLIB00017241479","spectrum_index":17964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 142.042 Da; putative annotation: N/A; putative formula: C10H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.196,"smiles":null,"spectrum_id":"CCMSLIB00017241481","spectrum_index":17965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Allylphenoxy)acetic acid (delta mass: 88.0164 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017241483","spectrum_index":17966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 383.1953 Da; putative annotation: N/A; putative formula: C20H33NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.266,"smiles":null,"spectrum_id":"CCMSLIB00017241486","spectrum_index":17967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 192.1515 Da; putative annotation: N/A; putative formula: C13H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.28,"smiles":null,"spectrum_id":"CCMSLIB00017241487","spectrum_index":17968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 26.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.146,"smiles":null,"spectrum_id":"CCMSLIB00017241490","spectrum_index":17969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 178.1069 Da; putative annotation: N/A; putative formula: C5H14N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.209,"smiles":null,"spectrum_id":"CCMSLIB00017241492","spectrum_index":17970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 102.0304 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.2,"smiles":null,"spectrum_id":"CCMSLIB00017241494","spectrum_index":17971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Undecanoic acid (delta mass: 84.0937 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.263,"smiles":null,"spectrum_id":"CCMSLIB00017241496","spectrum_index":17972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 67.0261 Da; putative annotation: N/A; putative formula: CHN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.237,"smiles":null,"spectrum_id":"CCMSLIB00017241499","spectrum_index":17973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 72.0216 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.118,"smiles":null,"spectrum_id":"CCMSLIB00017241501","spectrum_index":17974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 176.0301 Da; putative annotation: N/A; putative formula: C3H8N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.169,"smiles":null,"spectrum_id":"CCMSLIB00017241503","spectrum_index":17975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 73.1915 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.319,"smiles":null,"spectrum_id":"CCMSLIB00017241505","spectrum_index":17976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 131.06 Da; putative annotation: N/A; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.125,"smiles":null,"spectrum_id":"CCMSLIB00017241507","spectrum_index":17977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Pro-Lys (delta mass: 155.0956 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.314,"smiles":null,"spectrum_id":"CCMSLIB00017241510","spectrum_index":17978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE0; MS2Dec (delta mass: 226.1943 Da; putative annotation: N/A; putative formula: C14H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.255,"smiles":null,"spectrum_id":"CCMSLIB00017241511","spectrum_index":17979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 28.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.128,"smiles":null,"spectrum_id":"CCMSLIB00017241514","spectrum_index":17980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 76.9936 Da; putative annotation: N/A; putative formula: CH3NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.074,"smiles":null,"spectrum_id":"CCMSLIB00017241515","spectrum_index":17981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 973.3993 Da; putative annotation: N/A; putative formula: C67H51N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1154.47,"smiles":null,"spectrum_id":"CCMSLIB00017241518","spectrum_index":17982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 701.2175 Da; putative annotation: N/A; putative formula: C44H27N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.278,"smiles":null,"spectrum_id":"CCMSLIB00017241519","spectrum_index":17983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 133.9907 Da; putative annotation: N/A; putative formula: CH2N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.033,"smiles":null,"spectrum_id":"CCMSLIB00017241522","spectrum_index":17984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 253.1157 Da; putative annotation: N/A; putative formula: C9H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.285,"smiles":null,"spectrum_id":"CCMSLIB00017241523","spectrum_index":17985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 63.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.306,"smiles":null,"spectrum_id":"CCMSLIB00017241526","spectrum_index":17986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 102.0829 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.294,"smiles":null,"spectrum_id":"CCMSLIB00017241527","spectrum_index":17987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-1,4a-dimethyl-9-oxo-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 106.0415 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.263,"smiles":null,"spectrum_id":"CCMSLIB00017241530","spectrum_index":17988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arsubin (delta mass: 265.1676 Da; putative annotation: N/A; putative formula: C15H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.316,"smiles":null,"spectrum_id":"CCMSLIB00017241531","spectrum_index":17989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tuberonic acid (delta mass: 38.0155 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017241533","spectrum_index":17990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 70.0052 Da; putative annotation: N/A; putative formula: C3H2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.07,"smiles":null,"spectrum_id":"CCMSLIB00017241535","spectrum_index":17991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenol (delta mass: 130.0414 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.112,"smiles":null,"spectrum_id":"CCMSLIB00017241538","spectrum_index":17992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzaldehyde (delta mass: 134.0515 Da; putative annotation: N/A; putative formula: C4H10N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.091,"smiles":null,"spectrum_id":"CCMSLIB00017241539","spectrum_index":17993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 180.0789 Da; putative annotation: N/A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.264,"smiles":null,"spectrum_id":"CCMSLIB00017241542","spectrum_index":17994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 98.0344 Da; putative annotation: N/A; putative formula: CH2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.079,"smiles":null,"spectrum_id":"CCMSLIB00017241543","spectrum_index":17995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Galactosyl-N-stearoylsphingosine (delta mass: 453.1492 Da; putative annotation: N/A; putative formula: C28H24NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1181.75,"smiles":null,"spectrum_id":"CCMSLIB00017241546","spectrum_index":17996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(4-Methoxyphenyl)ethyl]-3-methyl-2-butenamide (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.16,"smiles":null,"spectrum_id":"CCMSLIB00017241547","spectrum_index":17997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aleuretic Acid (delta mass: 106.078 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.31,"smiles":null,"spectrum_id":"CCMSLIB00017241550","spectrum_index":17998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 134.109 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017241551","spectrum_index":17999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 100.0675 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.289,"smiles":null,"spectrum_id":"CCMSLIB00017241554","spectrum_index":18000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 273.0487 Da; putative annotation: N/A; putative formula: C16H13Cl2NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.13,"smiles":null,"spectrum_id":"CCMSLIB00017241555","spectrum_index":18001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 110.0211 Da; putative annotation: N/A; putative formula: C3H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.175,"smiles":null,"spectrum_id":"CCMSLIB00017241557","spectrum_index":18002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 623.1847 Da; putative annotation: N/A; putative formula: C26H29N11O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.244,"smiles":null,"spectrum_id":"CCMSLIB00017241559","spectrum_index":18003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 276.1835 Da; putative annotation: N/A; putative formula: C16H24N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.259,"smiles":null,"spectrum_id":"CCMSLIB00017241561","spectrum_index":18004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 28.017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.14,"smiles":null,"spectrum_id":"CCMSLIB00017241563","spectrum_index":18005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYBENZOATE (delta mass: 98.04 Da; putative annotation: N/A; putative formula: C4H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.079,"smiles":null,"spectrum_id":"CCMSLIB00017241566","spectrum_index":18006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-6-ol, 1-(4-methoxyphenyl)-2-methyl-3-nitro- (delta mass: 362.1489 Da; putative annotation: N/A; putative formula: C19H26N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.252,"smiles":null,"spectrum_id":"CCMSLIB00017241567","spectrum_index":18007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine D (delta mass: 286.089 Da; putative annotation: N/A; putative formula: C14H14N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.27,"smiles":null,"spectrum_id":"CCMSLIB00017241570","spectrum_index":18008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.202,"smiles":null,"spectrum_id":"CCMSLIB00017241571","spectrum_index":18009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-O-((2.alpha.,3.beta.,5.Xi.,9.Xi.,18.Xi.,19.alpha.)-2,3,19-Trihydroxy-28-oxoolean-12-en-28-yl)-.beta.-D-glucopyranose (delta mass: 66.0477 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.458,"smiles":null,"spectrum_id":"CCMSLIB00017241574","spectrum_index":18010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 175.5846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.739,"smiles":null,"spectrum_id":"CCMSLIB00017241575","spectrum_index":18011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 278.089 Da; putative annotation: N/A; putative formula: C10H6N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.192,"smiles":null,"spectrum_id":"CCMSLIB00017241577","spectrum_index":18012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 170.1053 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.176,"smiles":null,"spectrum_id":"CCMSLIB00017241579","spectrum_index":18013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 545.1913 Da; putative annotation: N/A; putative formula: C28H27N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1212.42,"smiles":null,"spectrum_id":"CCMSLIB00017241581","spectrum_index":18014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Ketoprostaglandin F1.alpha. (delta mass: 17.0273 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.27,"smiles":null,"spectrum_id":"CCMSLIB00017241583","spectrum_index":18015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidinol (delta mass: 282.2551 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.435,"smiles":null,"spectrum_id":"CCMSLIB00017241585","spectrum_index":18016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 146.0941 Da; putative annotation: N/A; putative formula: C7H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.16,"smiles":null,"spectrum_id":"CCMSLIB00017241587","spectrum_index":18017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.268,"smiles":null,"spectrum_id":"CCMSLIB00017241589","spectrum_index":18018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 44.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.165,"smiles":null,"spectrum_id":"CCMSLIB00017241591","spectrum_index":18019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methoxycarbonyl)but-3-enoic acid (delta mass: 177.0637 Da; putative annotation: N/A; putative formula: C6H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.113,"smiles":null,"spectrum_id":"CCMSLIB00017241593","spectrum_index":18020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 80.0627 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.274,"smiles":null,"spectrum_id":"CCMSLIB00017241595","spectrum_index":18021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 201.1002 Da; putative annotation: N/A; putative formula: C9H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.166,"smiles":null,"spectrum_id":"CCMSLIB00017241597","spectrum_index":18022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-8-(phenacylthio)-3,7-dihydropurin-6-one (delta mass: 117.0275 Da; putative annotation: N/A; putative formula: CH3N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.098,"smiles":null,"spectrum_id":"CCMSLIB00017241599","spectrum_index":18023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 516.2132 Da; putative annotation: N/A; putative formula: C28H24N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.362,"smiles":null,"spectrum_id":"CCMSLIB00017241602","spectrum_index":18024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Arabinose (delta mass: 116.0617 Da; putative annotation: N/A; putative formula: C3H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017241603","spectrum_index":18025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 247.1573 Da; putative annotation: N/A; putative formula: C15H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.222,"smiles":null,"spectrum_id":"CCMSLIB00017241606","spectrum_index":18026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 178.085 Da; putative annotation: N/A; putative formula: C8H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.166,"smiles":null,"spectrum_id":"CCMSLIB00017241607","spectrum_index":18027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 16.0428 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.097,"smiles":null,"spectrum_id":"CCMSLIB00017241609","spectrum_index":18028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-2,5-Dimethoxyphenethylamine (delta mass: 59.0113 Da; putative annotation: N/A; putative formula: HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.09,"smiles":null,"spectrum_id":"CCMSLIB00017241611","spectrum_index":18029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 411.738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.809,"smiles":null,"spectrum_id":"CCMSLIB00017241614","spectrum_index":18030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 96.0936 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.347,"smiles":null,"spectrum_id":"CCMSLIB00017241615","spectrum_index":18031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 540.136 Da; putative annotation: N/A; putative formula: C38H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.177,"smiles":null,"spectrum_id":"CCMSLIB00017241617","spectrum_index":18032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 104.0109 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.05,"smiles":null,"spectrum_id":"CCMSLIB00017241619","spectrum_index":18033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Genipin (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.091,"smiles":null,"spectrum_id":"CCMSLIB00017241621","spectrum_index":18034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 435.4006 Da; putative annotation: N/A; putative formula: C27H53N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.448,"smiles":null,"spectrum_id":"CCMSLIB00017241623","spectrum_index":18035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 78.0222 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.207,"smiles":null,"spectrum_id":"CCMSLIB00017241626","spectrum_index":18036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 27.0542 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.141,"smiles":null,"spectrum_id":"CCMSLIB00017241628","spectrum_index":18037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 152.0401 Da; putative annotation: N/A; putative formula: C7H8N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.105,"smiles":null,"spectrum_id":"CCMSLIB00017241629","spectrum_index":18038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 264.1937 Da; putative annotation: N/A; putative formula: C14H24N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.28,"smiles":null,"spectrum_id":"CCMSLIB00017241632","spectrum_index":18039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 125.1088 Da; putative annotation: N/A; putative formula: C5H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.211,"smiles":null,"spectrum_id":"CCMSLIB00017241635","spectrum_index":18040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 50.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.123,"smiles":null,"spectrum_id":"CCMSLIB00017241636","spectrum_index":18041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 224.2144 Da; putative annotation: N/A; putative formula: C15H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.322,"smiles":null,"spectrum_id":"CCMSLIB00017241638","spectrum_index":18042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.071,"smiles":null,"spectrum_id":"CCMSLIB00017241640","spectrum_index":18043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-C18:1 (delta mass: 282.2623 Da; putative annotation: N/A; putative formula: C13H30N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.568,"smiles":null,"spectrum_id":"CCMSLIB00017241643","spectrum_index":18044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 103.0451 Da; putative annotation: N/A; putative formula: C4H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.122,"smiles":null,"spectrum_id":"CCMSLIB00017241644","spectrum_index":18045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Sitosterol (delta mass: 357.1639 Da; putative annotation: N/A; putative formula: C16H28N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.557,"smiles":null,"spectrum_id":"CCMSLIB00017241647","spectrum_index":18046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000697723-01! (delta mass: 98.0718 Da; putative annotation: N/A; putative formula: C2H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.189,"smiles":null,"spectrum_id":"CCMSLIB00017241649","spectrum_index":18047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 128.0984 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017241651","spectrum_index":18048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-C10:0 (delta mass: 128.0838 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.296,"smiles":null,"spectrum_id":"CCMSLIB00017241653","spectrum_index":18049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 104.0669 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.144,"smiles":null,"spectrum_id":"CCMSLIB00017241655","spectrum_index":18050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 82.0258 Da; putative annotation: N/A; putative formula: C5H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.08,"smiles":null,"spectrum_id":"CCMSLIB00017241657","spectrum_index":18051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 168.1141 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.211,"smiles":null,"spectrum_id":"CCMSLIB00017241659","spectrum_index":18052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 252.0421 Da; putative annotation: N/A; putative formula: C15H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.166,"smiles":null,"spectrum_id":"CCMSLIB00017241662","spectrum_index":18053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzoic acid (delta mass: 58.0207 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.06,"smiles":null,"spectrum_id":"CCMSLIB00017241663","spectrum_index":18054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 76.0521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017241666","spectrum_index":18055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 94.0832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.31,"smiles":null,"spectrum_id":"CCMSLIB00017241667","spectrum_index":18056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 373.1903 Da; putative annotation: N/A; putative formula: C22H23N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.256,"smiles":null,"spectrum_id":"CCMSLIB00017241669","spectrum_index":18057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 398.1434 Da; putative annotation: N/A; putative formula: C16H30O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.18,"smiles":null,"spectrum_id":"CCMSLIB00017241671","spectrum_index":18058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 369.1651 Da; putative annotation: N/A; putative formula: C15H23N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.434,"smiles":null,"spectrum_id":"CCMSLIB00017241673","spectrum_index":18059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 104.0448 Da; putative annotation: N/A; putative formula: H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.199,"smiles":null,"spectrum_id":"CCMSLIB00017241675","spectrum_index":18060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 157.0164 Da; putative annotation: N/A; putative formula: C9H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017241677","spectrum_index":18061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Methyl-1-piperazinyl)butanoic acid (delta mass: 123.0434 Da; putative annotation: N/A; putative formula: C5H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.188,"smiles":null,"spectrum_id":"CCMSLIB00017241679","spectrum_index":18062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 231.1469 Da; putative annotation: N/A; putative formula: C11H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.218,"smiles":null,"spectrum_id":"CCMSLIB00017241682","spectrum_index":18063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 210.0529 Da; putative annotation: N/A; putative formula: C10H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.092,"smiles":null,"spectrum_id":"CCMSLIB00017241683","spectrum_index":18064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-4-(methoxymethyl)coumarin (delta mass: 644.1902 Da; putative annotation: N/A; putative formula: C36H36O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":851.255,"smiles":null,"spectrum_id":"CCMSLIB00017241686","spectrum_index":18065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 174.089 Da; putative annotation: N/A; putative formula: C8H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.176,"smiles":null,"spectrum_id":"CCMSLIB00017241687","spectrum_index":18066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 306.1175 Da; putative annotation: N/A; putative formula: C10H18N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.204,"smiles":null,"spectrum_id":"CCMSLIB00017241690","spectrum_index":18067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 111.0589 Da; putative annotation: N/A; putative formula: C6H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.427,"smiles":null,"spectrum_id":"CCMSLIB00017241691","spectrum_index":18068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinoresinol (delta mass: 411.1882 Da; putative annotation: N/A; putative formula: C25H25N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.337,"smiles":null,"spectrum_id":"CCMSLIB00017241693","spectrum_index":18069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 23.016 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.181,"smiles":null,"spectrum_id":"CCMSLIB00017241696","spectrum_index":18070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 866.3254 Da; putative annotation: N/A; putative formula: C60H42N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1047.4,"smiles":null,"spectrum_id":"CCMSLIB00017241697","spectrum_index":18071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PETROSELINIC ACID (delta mass: 224.2507 Da; putative annotation: N/A; putative formula: C16H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.514,"smiles":null,"spectrum_id":"CCMSLIB00017241700","spectrum_index":18072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 52.0332 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.26,"smiles":null,"spectrum_id":"CCMSLIB00017241702","spectrum_index":18073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrograpanin (delta mass: 34.0207 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.247,"smiles":null,"spectrum_id":"CCMSLIB00017241704","spectrum_index":18074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 92.0131 Da; putative annotation: N/A; putative formula: C3N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.1,"smiles":null,"spectrum_id":"CCMSLIB00017241706","spectrum_index":18075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 71.0704 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.24,"smiles":null,"spectrum_id":"CCMSLIB00017241708","spectrum_index":18076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avermitilol (delta mass: 48.0344 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.24,"smiles":null,"spectrum_id":"CCMSLIB00017241710","spectrum_index":18077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylimbricatolic acid (delta mass: 80.0616 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.33,"smiles":null,"spectrum_id":"CCMSLIB00017241712","spectrum_index":18078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Hydroxynorethindrone (delta mass: 81.0792 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.275,"smiles":null,"spectrum_id":"CCMSLIB00017241714","spectrum_index":18079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 171.09 Da; putative annotation: N/A; putative formula: C8H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.15,"smiles":null,"spectrum_id":"CCMSLIB00017241716","spectrum_index":18080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine 6-phosphate (delta mass: 72.0277 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.081,"smiles":null,"spectrum_id":"CCMSLIB00017241719","spectrum_index":18081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 26.0139 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.09,"smiles":null,"spectrum_id":"CCMSLIB00017241721","spectrum_index":18082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 88.0582 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.155,"smiles":null,"spectrum_id":"CCMSLIB00017241723","spectrum_index":18083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ilicic acid (delta mass: 144.1302 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017241726","spectrum_index":18084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 108.0938 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.279,"smiles":null,"spectrum_id":"CCMSLIB00017241727","spectrum_index":18085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Abietic acid (delta mass: 45.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.3,"smiles":null,"spectrum_id":"CCMSLIB00017241730","spectrum_index":18086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 29.9584 Da; putative annotation: N/A; putative formula: C15H24N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.148,"smiles":null,"spectrum_id":"CCMSLIB00017241731","spectrum_index":18087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,6,7,11b-Hexahydro-2H-pyrazino[2,1-a]isoquinoline (delta mass: 45.0501 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.189,"smiles":null,"spectrum_id":"CCMSLIB00017241734","spectrum_index":18088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7-Triazacyclononane (delta mass: 146.1529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.287,"smiles":null,"spectrum_id":"CCMSLIB00017241735","spectrum_index":18089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 204.0654 Da; putative annotation: N/A; putative formula: C9H18O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.152,"smiles":null,"spectrum_id":"CCMSLIB00017241738","spectrum_index":18090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dimethyl-1,3-benzenediol (delta mass: 39.0334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.109,"smiles":null,"spectrum_id":"CCMSLIB00017241740","spectrum_index":18091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 238.2304 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.338,"smiles":null,"spectrum_id":"CCMSLIB00017241742","spectrum_index":18092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 151.084 Da; putative annotation: N/A; putative formula: H10N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.181,"smiles":null,"spectrum_id":"CCMSLIB00017241744","spectrum_index":18093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 64.0676 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.227,"smiles":null,"spectrum_id":"CCMSLIB00017241746","spectrum_index":18094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)acetamide (delta mass: 18.0182 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.136,"smiles":null,"spectrum_id":"CCMSLIB00017241747","spectrum_index":18095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 181.0737 Da; putative annotation: N/A; putative formula: C9H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.144,"smiles":null,"spectrum_id":"CCMSLIB00017241750","spectrum_index":18096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-methyl-4-methylidene-7-(propan-2-yl)-1,2,3,3a,4,5,6,8a-octahydroazulen-1-ol (delta mass: 265.08 Da; putative annotation: N/A; putative formula: C9H15NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.27,"smiles":null,"spectrum_id":"CCMSLIB00017241752","spectrum_index":18097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .DELTA.2-Androstene-1.alpha.,17.beta.-diol acetate (delta mass: 106.0786 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.321,"smiles":null,"spectrum_id":"CCMSLIB00017241754","spectrum_index":18098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 381.2878 Da; putative annotation: N/A; putative formula: C22H39NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.504,"smiles":null,"spectrum_id":"CCMSLIB00017241757","spectrum_index":18099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F1.alpha. alcohol (delta mass: 80.0676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.352,"smiles":null,"spectrum_id":"CCMSLIB00017241758","spectrum_index":18100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 78.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.149,"smiles":null,"spectrum_id":"CCMSLIB00017241761","spectrum_index":18101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 145.1113 Da; putative annotation: N/A; putative formula: C7H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.411,"smiles":null,"spectrum_id":"CCMSLIB00017241762","spectrum_index":18102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-Butaprost (delta mass: 114.0892 Da; putative annotation: N/A; putative formula: C4H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.384,"smiles":null,"spectrum_id":"CCMSLIB00017241765","spectrum_index":18103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 106.0548 Da; putative annotation: N/A; putative formula: C6H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.146,"smiles":null,"spectrum_id":"CCMSLIB00017241767","spectrum_index":18104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrotachysterol (delta mass: 160.1252 Da; putative annotation: N/A; putative formula: C12H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.487,"smiles":null,"spectrum_id":"CCMSLIB00017241769","spectrum_index":18105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of QuinicAcid (delta mass: 170.1096 Da; putative annotation: N/A; putative formula: C13H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017241771","spectrum_index":18106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Epoxyeicosa-5(Z)-enoic acid (delta mass: 444.3663 Da; putative annotation: N/A; putative formula: C27H48N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.64,"smiles":null,"spectrum_id":"CCMSLIB00017241773","spectrum_index":18107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Epoxyeicosa-5(Z)-enoic acid (delta mass: 415.3287 Da; putative annotation: N/A; putative formula: C20H37N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.602,"smiles":null,"spectrum_id":"CCMSLIB00017241776","spectrum_index":18108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxygypsogenic acid (delta mass: 138.0892 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.426,"smiles":null,"spectrum_id":"CCMSLIB00017241777","spectrum_index":18109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 169.074 Da; putative annotation: N/A; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.16,"smiles":null,"spectrum_id":"CCMSLIB00017241780","spectrum_index":18110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 16.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.113,"smiles":null,"spectrum_id":"CCMSLIB00017241782","spectrum_index":18111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 121.0203 Da; putative annotation: N/A; putative formula: C3H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.247,"smiles":null,"spectrum_id":"CCMSLIB00017241784","spectrum_index":18112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 78.0823 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.33,"smiles":null,"spectrum_id":"CCMSLIB00017241787","spectrum_index":18113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 88.02 Da; putative annotation: N/A; putative formula: CH4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.086,"smiles":null,"spectrum_id":"CCMSLIB00017241789","spectrum_index":18114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Isopropylpiperazine (delta mass: 41.0148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017241791","spectrum_index":18115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 73.9829 Da; putative annotation: N/A; putative formula: C2H2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.08,"smiles":null,"spectrum_id":"CCMSLIB00017241793","spectrum_index":18116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 74.0518 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.294,"smiles":null,"spectrum_id":"CCMSLIB00017241795","spectrum_index":18117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,17-Dihydroxy-7-kauranone (delta mass: 48.0355 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.278,"smiles":null,"spectrum_id":"CCMSLIB00017241798","spectrum_index":18118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 100.052 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.127,"smiles":null,"spectrum_id":"CCMSLIB00017241799","spectrum_index":18119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 22(S)-Hydroxycholesterol (delta mass: 157.109 Da; putative annotation: N/A; putative formula: C8H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.466,"smiles":null,"spectrum_id":"CCMSLIB00017241802","spectrum_index":18120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 258.224 Da; putative annotation: N/A; putative formula: C13H30N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.311,"smiles":null,"spectrum_id":"CCMSLIB00017241804","spectrum_index":18121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(2E,6E,10E)-9,12-Dihydroxy-6,10-dimethyldodeca-2,6,10-trien-2-yl]-5-methyl-2,3-dihydropyran-6-one (delta mass: 48.0363 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.258,"smiles":null,"spectrum_id":"CCMSLIB00017241806","spectrum_index":18122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 69.0207 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.096,"smiles":null,"spectrum_id":"CCMSLIB00017241808","spectrum_index":18123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homogentisic acid (delta mass: 50.0518 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.101,"smiles":null,"spectrum_id":"CCMSLIB00017241810","spectrum_index":18124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxybenzoate (delta mass: 30.0106 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.081,"smiles":null,"spectrum_id":"CCMSLIB00017241812","spectrum_index":18125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 85.0163 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017241815","spectrum_index":18126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 54.0312 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.274,"smiles":null,"spectrum_id":"CCMSLIB00017241817","spectrum_index":18127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylcyclohexaneacetic acid (delta mass: 365.1275 Da; putative annotation: N/A; putative formula: C22H15N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.25,"smiles":null,"spectrum_id":"CCMSLIB00017241819","spectrum_index":18128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,,3S,5Z)-3-hydroxy-1,5-octadien-1-yl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5Z)- (delta mass: 52.0327 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.27,"smiles":null,"spectrum_id":"CCMSLIB00017241821","spectrum_index":18129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy-4(15),11(13)-eudesmadien-12,6-olide (delta mass: 88.0164 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.165,"smiles":null,"spectrum_id":"CCMSLIB00017241823","spectrum_index":18130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 179.1153 Da; putative annotation: N/A; putative formula: C8H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.16,"smiles":null,"spectrum_id":"CCMSLIB00017241825","spectrum_index":18131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 48.0364 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.274,"smiles":null,"spectrum_id":"CCMSLIB00017241827","spectrum_index":18132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylchromone-2-carboxylic acid (delta mass: 71.0734 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.123,"smiles":null,"spectrum_id":"CCMSLIB00017241830","spectrum_index":18133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 625.9486 Da; putative annotation: N/A; putative formula: C15H30O8S9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.051,"smiles":null,"spectrum_id":"CCMSLIB00017241831","spectrum_index":18134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.107,"smiles":null,"spectrum_id":"CCMSLIB00017241834","spectrum_index":18135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 316.0951 Da; putative annotation: N/A; putative formula: C9H22N2O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.155,"smiles":null,"spectrum_id":"CCMSLIB00017241835","spectrum_index":18136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 80.0634 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017241838","spectrum_index":18137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Norepinephrine from NIST14 (delta mass: 94.9923 Da; putative annotation: N/A; putative formula: C4H2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.073,"smiles":null,"spectrum_id":"CCMSLIB00017241839","spectrum_index":18138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-1-piperazinyl)acetic acid (delta mass: 43.0304 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.143,"smiles":null,"spectrum_id":"CCMSLIB00017241842","spectrum_index":18139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 48.0364 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.102,"smiles":null,"spectrum_id":"CCMSLIB00017241844","spectrum_index":18140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 96.0406 Da; putative annotation: N/A; putative formula: C6H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.116,"smiles":null,"spectrum_id":"CCMSLIB00017241846","spectrum_index":18141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dihydroxy-5Z,8Z,11Z-eicosatrienoic acid (delta mass: 86.0517 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017241848","spectrum_index":18142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 44.0607 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.1,"smiles":null,"spectrum_id":"CCMSLIB00017241850","spectrum_index":18143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 92.0472 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.269,"smiles":null,"spectrum_id":"CCMSLIB00017241853","spectrum_index":18144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 264.1107 Da; putative annotation: N/A; putative formula: C13H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.237,"smiles":null,"spectrum_id":"CCMSLIB00017241854","spectrum_index":18145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 178.0631 Da; putative annotation: Dihydroisoferulic acid; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017241857","spectrum_index":18146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Leu (delta mass: 113.0844 Da; putative annotation: 2-Amino-2-ethylbutanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017241859","spectrum_index":18147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 146.0365 Da; putative annotation: ReSpect:PT104510 4-Coumaric acid|trans-4-hydroxycinnamic acid|(E)-3-(4-hydroxyphenyl)prop-2-enoic acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.128,"smiles":null,"spectrum_id":"CCMSLIB00017241861","spectrum_index":18148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epinephrine (delta mass: 160.0524 Da; putative annotation: Methyl 4-hydroxycinnamate; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.149,"smiles":null,"spectrum_id":"CCMSLIB00017241864","spectrum_index":18149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 310.2446 Da; putative annotation: NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match]; putative formula: C19H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.466,"smiles":null,"spectrum_id":"CCMSLIB00017241865","spectrum_index":18150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 310.2497 Da; putative annotation: Spectral Match to Monopalmitolein (9c) from NIST14; putative formula: C19H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.513,"smiles":null,"spectrum_id":"CCMSLIB00017241868","spectrum_index":18151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Acetyl-2-methoxyphenoxy)acetic acid (delta mass: 136.0529 Da; putative annotation: 2-(2-Hydroxyethoxy)phenol; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.129,"smiles":null,"spectrum_id":"CCMSLIB00017241870","spectrum_index":18152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 126.0311 Da; putative annotation: 3-Methyl-2-pentenedioic acid; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017241872","spectrum_index":18153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 286.1927 Da; putative annotation: h_266_oxandrolone_m3; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.316,"smiles":null,"spectrum_id":"CCMSLIB00017241874","spectrum_index":18154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 294.255 Da; putative annotation: Ricinoleic acid methyl ester; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.482,"smiles":null,"spectrum_id":"CCMSLIB00017241876","spectrum_index":18155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8(9)-Epoxy-5Z,11Z,14Z-eicosatrienoic acid (delta mass: 314.2249 Da; putative annotation: .DELTA.2-Androstene-1.alpha.,17.beta.-diol acetate; putative formula: C21H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.467,"smiles":null,"spectrum_id":"CCMSLIB00017241879","spectrum_index":18156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 260.213 Da; putative annotation: Pinolenic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.435,"smiles":null,"spectrum_id":"CCMSLIB00017241881","spectrum_index":18157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380791-01!methyl 3,7,8-trihydroxy-3-methyl-10-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylate (delta mass: 286.043 Da; putative annotation: Dihydrorobinetin; putative formula: C15H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.119,"smiles":null,"spectrum_id":"CCMSLIB00017241883","spectrum_index":18158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 298.1931 Da; putative annotation: 12-Oxopimara-9(11),15-dien-18-oic acid; putative formula: C20H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.404,"smiles":null,"spectrum_id":"CCMSLIB00017241885","spectrum_index":18159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ricinoleic acid methyl ester (delta mass: 150.1404 Da; putative annotation: (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol; putative formula: C11H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.414,"smiles":null,"spectrum_id":"CCMSLIB00017241887","spectrum_index":18160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 178.0992 Da; putative annotation: Loliolide; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.383,"smiles":null,"spectrum_id":"CCMSLIB00017241889","spectrum_index":18161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 483.2829 Da; putative annotation: GKK 1032B; putative formula: C32H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.494,"smiles":null,"spectrum_id":"CCMSLIB00017241891","spectrum_index":18162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 223.0675 Da; putative annotation: 1,3-Dihydroxy-10-methylacridone; putative formula: C14H9NO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.138,"smiles":null,"spectrum_id":"CCMSLIB00017241893","spectrum_index":18163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 266.2616 Da; putative annotation: stearic acid CollisionEnergy:205060; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.488,"smiles":null,"spectrum_id":"CCMSLIB00017241895","spectrum_index":18164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 190.1354 Da; putative annotation: 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017241897","spectrum_index":18165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 336.2062 Da; putative annotation: 9.alpha.-Fluoro-17.alpha.-methyl-4-androstene-3.alpha.,6.beta.,11.beta.,17.beta.-tetrol; putative formula: C20H29FO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.313,"smiles":null,"spectrum_id":"CCMSLIB00017241899","spectrum_index":18166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 84.0206 Da; putative annotation: Succinic semialdehyde; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.087,"smiles":null,"spectrum_id":"CCMSLIB00017241901","spectrum_index":18167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 725.5223 Da; putative annotation: Spectral Match to 1-Stearoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine from NIST14; putative formula: C41H76NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1078.79,"smiles":null,"spectrum_id":"CCMSLIB00017241903","spectrum_index":18168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 76.0673 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017241906","spectrum_index":18169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 312.0487 Da; putative annotation: N/A; putative formula: C16H13N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.14,"smiles":null,"spectrum_id":"CCMSLIB00017241907","spectrum_index":18170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 123.0529 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.102,"smiles":null,"spectrum_id":"CCMSLIB00017241910","spectrum_index":18171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 112.0863 Da; putative annotation: N/A; putative formula: C3H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.136,"smiles":null,"spectrum_id":"CCMSLIB00017241911","spectrum_index":18172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 198.0139 Da; putative annotation: N/A; putative formula: C12H6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.095,"smiles":null,"spectrum_id":"CCMSLIB00017241914","spectrum_index":18173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sarcosine ethyl ester (delta mass: 130.0633 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.15,"smiles":null,"spectrum_id":"CCMSLIB00017241915","spectrum_index":18174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP017301 Kaempferol-3-glucoside|Astragalin|5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one (delta mass: 132.0372 Da; putative annotation: N/A; putative formula: C4H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.145,"smiles":null,"spectrum_id":"CCMSLIB00017241918","spectrum_index":18175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 171.0929 Da; putative annotation: N/A; putative formula: C7H14N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.195,"smiles":null,"spectrum_id":"CCMSLIB00017241920","spectrum_index":18176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 612.3028 Da; putative annotation: N/A; putative formula: C45H40O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":921.545,"smiles":null,"spectrum_id":"CCMSLIB00017241922","spectrum_index":18177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 124.0522 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.289,"smiles":null,"spectrum_id":"CCMSLIB00017241924","spectrum_index":18178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 87.9249 Da; putative annotation: N/A; putative formula: CH-2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.001,"smiles":null,"spectrum_id":"CCMSLIB00017241926","spectrum_index":18179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(1H-Benzimidazol-2-yl)-4-fluorobenzamide (delta mass: 145.083 Da; putative annotation: N/A; putative formula: C5H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.171,"smiles":null,"spectrum_id":"CCMSLIB00017241929","spectrum_index":18180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid from NIST14 (delta mass: 305.2557 Da; putative annotation: N/A; putative formula: C20H35NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.482,"smiles":null,"spectrum_id":"CCMSLIB00017241930","spectrum_index":18181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-trans-Prostaglandin E3 (delta mass: 56.0256 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.242,"smiles":null,"spectrum_id":"CCMSLIB00017241933","spectrum_index":18182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 847.3186 Da; putative annotation: N/A; putative formula: C45H49N7O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1010.38,"smiles":null,"spectrum_id":"CCMSLIB00017241934","spectrum_index":18183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 105.2133 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.352,"smiles":null,"spectrum_id":"CCMSLIB00017241937","spectrum_index":18184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Retinoic acid (delta mass: 66.0469 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.263,"smiles":null,"spectrum_id":"CCMSLIB00017241939","spectrum_index":18185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 98.0929 Da; putative annotation: N/A; putative formula: C4H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.191,"smiles":null,"spectrum_id":"CCMSLIB00017241941","spectrum_index":18186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 227.0698 Da; putative annotation: N/A; putative formula: C12H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.156,"smiles":null,"spectrum_id":"CCMSLIB00017241944","spectrum_index":18187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.16,"smiles":null,"spectrum_id":"CCMSLIB00017241946","spectrum_index":18188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 71.0373 Da; putative annotation: N/A; putative formula: C3H5NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.124,"smiles":null,"spectrum_id":"CCMSLIB00017241947","spectrum_index":18189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 61.0253 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.252,"smiles":null,"spectrum_id":"CCMSLIB00017241950","spectrum_index":18190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017241951","spectrum_index":18191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleanolic acid methyl ester (delta mass: 172.13 Da; putative annotation: N/A; putative formula: C3H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.513,"smiles":null,"spectrum_id":"CCMSLIB00017241954","spectrum_index":18192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 271.2513 Da; putative annotation: N/A; putative formula: C16H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.509,"smiles":null,"spectrum_id":"CCMSLIB00017241956","spectrum_index":18193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 144.0934 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.44,"smiles":null,"spectrum_id":"CCMSLIB00017241958","spectrum_index":18194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-15-Tetracosenoic acid (delta mass: 82.0781 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.435,"smiles":null,"spectrum_id":"CCMSLIB00017241960","spectrum_index":18195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9E,11E-Octadecadienoic acid (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.242,"smiles":null,"spectrum_id":"CCMSLIB00017241962","spectrum_index":18196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 17.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.253,"smiles":null,"spectrum_id":"CCMSLIB00017241965","spectrum_index":18197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311155 Vanillic acid (not validated) (delta mass: 96.0574 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017241967","spectrum_index":18198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Acetylhistidine (delta mass: 55.0423 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.13,"smiles":null,"spectrum_id":"CCMSLIB00017241969","spectrum_index":18199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homogentisic acid (delta mass: 24.0365 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.086,"smiles":null,"spectrum_id":"CCMSLIB00017241971","spectrum_index":18200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 509.3372 Da; putative annotation: N/A; putative formula: C29H43N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.611,"smiles":null,"spectrum_id":"CCMSLIB00017241974","spectrum_index":18201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 286.1253 Da; putative annotation: N/A; putative formula: C15H18N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.28,"smiles":null,"spectrum_id":"CCMSLIB00017241975","spectrum_index":18202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 444.2505 Da; putative annotation: N/A; putative formula: C20H37N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.311,"smiles":null,"spectrum_id":"CCMSLIB00017241978","spectrum_index":18203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 172.1215 Da; putative annotation: N/A; putative formula: C8H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.245,"smiles":null,"spectrum_id":"CCMSLIB00017241979","spectrum_index":18204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 138.0317 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.165,"smiles":null,"spectrum_id":"CCMSLIB00017241982","spectrum_index":18205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 80.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.294,"smiles":null,"spectrum_id":"CCMSLIB00017241984","spectrum_index":18206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 96.0577 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.29,"smiles":null,"spectrum_id":"CCMSLIB00017241986","spectrum_index":18207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 84.0932 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017241988","spectrum_index":18208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017241990","spectrum_index":18209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 147.0685 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.245,"smiles":null,"spectrum_id":"CCMSLIB00017241992","spectrum_index":18210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-5-phenyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-one (delta mass: 61.0125 Da; putative annotation: N/A; putative formula: H3N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.091,"smiles":null,"spectrum_id":"CCMSLIB00017241994","spectrum_index":18211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 158.0368 Da; putative annotation: N/A; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.086,"smiles":null,"spectrum_id":"CCMSLIB00017241996","spectrum_index":18212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 147.9057 Da; putative annotation: N/A; putative formula: C3HO-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.966,"smiles":null,"spectrum_id":"CCMSLIB00017241998","spectrum_index":18213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Adamantyl)pyrrolidine (delta mass: 104.0468 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.237,"smiles":null,"spectrum_id":"CCMSLIB00017242000","spectrum_index":18214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 385.2831 Da; putative annotation: N/A; putative formula: C21H39NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.494,"smiles":null,"spectrum_id":"CCMSLIB00017242002","spectrum_index":18215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-8-Methyl-6-nonenoic acid (delta mass: 36.0361 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.174,"smiles":null,"spectrum_id":"CCMSLIB00017242004","spectrum_index":18216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 34.0166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.16,"smiles":null,"spectrum_id":"CCMSLIB00017242006","spectrum_index":18217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 516.1632 Da; putative annotation: N/A; putative formula: C26H28O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.255,"smiles":null,"spectrum_id":"CCMSLIB00017242008","spectrum_index":18218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 48.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.08,"smiles":null,"spectrum_id":"CCMSLIB00017242010","spectrum_index":18219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-methyl-4-methylidene-7-(propan-2-yl)-1,2,3,3a,4,5,6,8a-octahydroazulen-1-ol (delta mass: 181.1464 Da; putative annotation: N/A; putative formula: C11H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.336,"smiles":null,"spectrum_id":"CCMSLIB00017242012","spectrum_index":18220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 35.0377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.52,"smiles":null,"spectrum_id":"CCMSLIB00017242014","spectrum_index":18221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 99.4988 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.564,"smiles":null,"spectrum_id":"CCMSLIB00017242017","spectrum_index":18222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid, 4-(7,8,9,10-tetrahydro-5,7,7,10,10-pentamethyl-5H-benzo[e]naphtho[2,3-b][1,4]diazepin-13-yl)- (delta mass: 382.2256 Da; putative annotation: N/A; putative formula: C23H30N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":821.464,"smiles":null,"spectrum_id":"CCMSLIB00017242018","spectrum_index":18223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 51.0935 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.148,"smiles":null,"spectrum_id":"CCMSLIB00017242021","spectrum_index":18224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 653.55 Da; putative annotation: N/A; putative formula: C41H71N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.766,"smiles":null,"spectrum_id":"CCMSLIB00017242022","spectrum_index":18225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 231.0455 Da; putative annotation: N/A; putative formula: C2H9N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.147,"smiles":null,"spectrum_id":"CCMSLIB00017242025","spectrum_index":18226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 503.1843 Da; putative annotation: N/A; putative formula: C31H25N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.255,"smiles":null,"spectrum_id":"CCMSLIB00017242027","spectrum_index":18227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-3-Methyl-5-(1,2,5,5-tetramethyl-7-oxo-3,4,4a,6-tetrahydro-2H-naphthalen-1-yl)pent-2-enoic acid (delta mass: 132.0944 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017242029","spectrum_index":18228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"25-Acetoxy-3b-hydroxy-20(S),24(R)-epoxydammarane\"\" (delta mass: 84.0213 Da; putative annotation: N/A; putative formula: C4H4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.431,"smiles":null,"spectrum_id":"CCMSLIB00017242031","spectrum_index":18229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 310.2354 Da; putative annotation: N/A; putative formula: C19H36O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.331,"smiles":null,"spectrum_id":"CCMSLIB00017242033","spectrum_index":18230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 69.945 Da; putative annotation: N/A; putative formula: C2H-1O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.084,"smiles":null,"spectrum_id":"CCMSLIB00017242036","spectrum_index":18231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 97.9768 Da; putative annotation: N/A; putative formula: CH-1N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.224,"smiles":null,"spectrum_id":"CCMSLIB00017242037","spectrum_index":18232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 792.4599 Da; putative annotation: N/A; putative formula: C50H64O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":955.52,"smiles":null,"spectrum_id":"CCMSLIB00017242040","spectrum_index":18233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4-(Difluoromethoxy)-3-methoxyphenyl]methanamine (delta mass: 45.0405 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.124,"smiles":null,"spectrum_id":"CCMSLIB00017242041","spectrum_index":18234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sebacic acid monomethyl ester (delta mass: 43.0426 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.186,"smiles":null,"spectrum_id":"CCMSLIB00017242044","spectrum_index":18235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzoic acid (delta mass: 29.0667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.106,"smiles":null,"spectrum_id":"CCMSLIB00017242045","spectrum_index":18236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-pyruvic acid (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.087,"smiles":null,"spectrum_id":"CCMSLIB00017242048","spectrum_index":18237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 161.057 Da; putative annotation: N/A; putative formula: C4H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.092,"smiles":null,"spectrum_id":"CCMSLIB00017242049","spectrum_index":18238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 315.2404 Da; putative annotation: N/A; putative formula: C17H33NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.364,"smiles":null,"spectrum_id":"CCMSLIB00017242052","spectrum_index":18239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 339.1529 Da; putative annotation: N/A; putative formula: C13H25NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.354,"smiles":null,"spectrum_id":"CCMSLIB00017242053","spectrum_index":18240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Teusalvin C (delta mass: 275.1002 Da; putative annotation: N/A; putative formula: C11H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.28,"smiles":null,"spectrum_id":"CCMSLIB00017242055","spectrum_index":18241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 602.2205 Da; putative annotation: N/A; putative formula: C40H30N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.302,"smiles":null,"spectrum_id":"CCMSLIB00017242057","spectrum_index":18242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 60.0209 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.227,"smiles":null,"spectrum_id":"CCMSLIB00017242059","spectrum_index":18243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 35.0434 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017242061","spectrum_index":18244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 130.0996 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.223,"smiles":null,"spectrum_id":"CCMSLIB00017242064","spectrum_index":18245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 160.0212 Da; putative annotation: N/A; putative formula: C7H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.066,"smiles":null,"spectrum_id":"CCMSLIB00017242066","spectrum_index":18246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 461.3342 Da; putative annotation: N/A; putative formula: C28H49NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.394,"smiles":null,"spectrum_id":"CCMSLIB00017242068","spectrum_index":18247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 106.0271 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.134,"smiles":null,"spectrum_id":"CCMSLIB00017242070","spectrum_index":18248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 39.9941 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017242072","spectrum_index":18249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 320.2697 Da; putative annotation: N/A; putative formula: C17H32N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.517,"smiles":null,"spectrum_id":"CCMSLIB00017242074","spectrum_index":18250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-[bisbenzylamino]-1-(4-hydroxy-3-methoxyphenyl)ethan-1-one, chloride CollisionEnergy:102040\"\" (delta mass: 18.0164 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.191,"smiles":null,"spectrum_id":"CCMSLIB00017242076","spectrum_index":18251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 172.1818 Da; putative annotation: N/A; putative formula: C7H20N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.341,"smiles":null,"spectrum_id":"CCMSLIB00017242078","spectrum_index":18252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxycodone (delta mass: 200.1115 Da; putative annotation: N/A; putative formula: C14H17O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.25,"smiles":null,"spectrum_id":"CCMSLIB00017242081","spectrum_index":18253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10-Hydroxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl) (Z)-2-methylbut-2-enoate (delta mass: 148.0578 Da; putative annotation: N/A; putative formula: C6H14P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.191,"smiles":null,"spectrum_id":"CCMSLIB00017242082","spectrum_index":18254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 220.1238 Da; putative annotation: N/A; putative formula: C11H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.236,"smiles":null,"spectrum_id":"CCMSLIB00017242085","spectrum_index":18255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 789.3546 Da; putative annotation: N/A; putative formula: C36H51N7O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.426,"smiles":null,"spectrum_id":"CCMSLIB00017242086","spectrum_index":18256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 72.03 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017242089","spectrum_index":18257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOATE - 40.0 eV (delta mass: 60.022 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.077,"smiles":null,"spectrum_id":"CCMSLIB00017242090","spectrum_index":18258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 31.0461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.132,"smiles":null,"spectrum_id":"CCMSLIB00017242093","spectrum_index":18259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-2-hydroxybenzoic acid (delta mass: 64.031 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.065,"smiles":null,"spectrum_id":"CCMSLIB00017242094","spectrum_index":18260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 96.0332 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.114,"smiles":null,"spectrum_id":"CCMSLIB00017242097","spectrum_index":18261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Deoxylactucin (delta mass: 42.0091 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.121,"smiles":null,"spectrum_id":"CCMSLIB00017242099","spectrum_index":18262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 343.1224 Da; putative annotation: N/A; putative formula: C23H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.167,"smiles":null,"spectrum_id":"CCMSLIB00017242101","spectrum_index":18263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 277.0768 Da; putative annotation: N/A; putative formula: C16H12N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.131,"smiles":null,"spectrum_id":"CCMSLIB00017242103","spectrum_index":18264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 62.0002 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.06,"smiles":null,"spectrum_id":"CCMSLIB00017242105","spectrum_index":18265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 319.1625 Da; putative annotation: N/A; putative formula: C14H25NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.233,"smiles":null,"spectrum_id":"CCMSLIB00017242107","spectrum_index":18266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 112.1889 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.237,"smiles":null,"spectrum_id":"CCMSLIB00017242109","spectrum_index":18267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-L-.gamma.-Glutamyl-L-leucine (delta mass: 70.0419 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.186,"smiles":null,"spectrum_id":"CCMSLIB00017242111","spectrum_index":18268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannose 6-phosphate (delta mass: 312.2315 Da; putative annotation: N/A; putative formula: C19H28N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.268,"smiles":null,"spectrum_id":"CCMSLIB00017242113","spectrum_index":18269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 107.0722 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.201,"smiles":null,"spectrum_id":"CCMSLIB00017242115","spectrum_index":18270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 283.091 Da; putative annotation: N/A; putative formula: C12H18N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.37,"smiles":null,"spectrum_id":"CCMSLIB00017242117","spectrum_index":18271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 659.4962 Da; putative annotation: N/A; putative formula: C41H65N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.556,"smiles":null,"spectrum_id":"CCMSLIB00017242120","spectrum_index":18272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 246.1181 Da; putative annotation: N/A; putative formula: C6H14N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.262,"smiles":null,"spectrum_id":"CCMSLIB00017242122","spectrum_index":18273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 120.0972 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.345,"smiles":null,"spectrum_id":"CCMSLIB00017242123","spectrum_index":18274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 104.0299 Da; putative annotation: N/A; putative formula: C4H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.241,"smiles":null,"spectrum_id":"CCMSLIB00017242126","spectrum_index":18275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 232.1093 Da; putative annotation: N/A; putative formula: C8H17N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.18,"smiles":null,"spectrum_id":"CCMSLIB00017242127","spectrum_index":18276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Adamantyl)pyrrolidine (delta mass: 256.1157 Da; putative annotation: N/A; putative formula: C12H21N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.306,"smiles":null,"spectrum_id":"CCMSLIB00017242130","spectrum_index":18277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 16.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.253,"smiles":null,"spectrum_id":"CCMSLIB00017242132","spectrum_index":18278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstenetriol (delta mass: 146.0688 Da; putative annotation: N/A; putative formula: C5H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.296,"smiles":null,"spectrum_id":"CCMSLIB00017242134","spectrum_index":18279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodeca-2(E),4(E)-dienoic acid (delta mass: 50.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.191,"smiles":null,"spectrum_id":"CCMSLIB00017242136","spectrum_index":18280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.289,"smiles":null,"spectrum_id":"CCMSLIB00017242139","spectrum_index":18281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Didodecyl 3,3'-thiodipropionate oxide from NIST14 - Hydroxylated variant ? (delta mass: 44.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.466,"smiles":null,"spectrum_id":"CCMSLIB00017242141","spectrum_index":18282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxybenzoic acid (delta mass: 70.0778 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017242143","spectrum_index":18283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 163.0249 Da; putative annotation: N/A; putative formula: C4HN7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.085,"smiles":null,"spectrum_id":"CCMSLIB00017242145","spectrum_index":18284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 102.0846 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.332,"smiles":null,"spectrum_id":"CCMSLIB00017242147","spectrum_index":18285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 126.0856 Da; putative annotation: N/A; putative formula: C8H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.323,"smiles":null,"spectrum_id":"CCMSLIB00017242149","spectrum_index":18286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 8.9892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.076,"smiles":null,"spectrum_id":"CCMSLIB00017242151","spectrum_index":18287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 117.1432 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.229,"smiles":null,"spectrum_id":"CCMSLIB00017242153","spectrum_index":18288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-[4-(Dimethylamino)benzylidene]-1,3-dihydro-2H-indol-2-one (delta mass: 242.1565 Da; putative annotation: N/A; putative formula: C11H22N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.29,"smiles":null,"spectrum_id":"CCMSLIB00017242155","spectrum_index":18289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 135.0757 Da; putative annotation: N/A; putative formula: C2H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.167,"smiles":null,"spectrum_id":"CCMSLIB00017242158","spectrum_index":18290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 505.2003 Da; putative annotation: N/A; putative formula: C24H35N5OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.448,"smiles":null,"spectrum_id":"CCMSLIB00017242159","spectrum_index":18291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminophenol (delta mass: 35.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.096,"smiles":null,"spectrum_id":"CCMSLIB00017242162","spectrum_index":18292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,7,10,13,16,19-Docosahexaenoic acid (delta mass: 112.0724 Da; putative annotation: N/A; putative formula: C7H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.32,"smiles":null,"spectrum_id":"CCMSLIB00017242163","spectrum_index":18293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 270.1793 Da; putative annotation: N/A; putative formula: C11H22N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.281,"smiles":null,"spectrum_id":"CCMSLIB00017242166","spectrum_index":18294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 260.0288 Da; putative annotation: N/A; putative formula: C9H12N2O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.11,"smiles":null,"spectrum_id":"CCMSLIB00017242167","spectrum_index":18295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 314.0764 Da; putative annotation: N/A; putative formula: C13H10N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.137,"smiles":null,"spectrum_id":"CCMSLIB00017242170","spectrum_index":18296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 56.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.119,"smiles":null,"spectrum_id":"CCMSLIB00017242171","spectrum_index":18297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 56.099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.143,"smiles":null,"spectrum_id":"CCMSLIB00017242174","spectrum_index":18298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstan-4,6-diene-17.beta.-ol-3-one (delta mass: 72.0424 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.243,"smiles":null,"spectrum_id":"CCMSLIB00017242175","spectrum_index":18299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl morpholine-2-carboxylate (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.123,"smiles":null,"spectrum_id":"CCMSLIB00017242178","spectrum_index":18300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 291.1687 Da; putative annotation: N/A; putative formula: C14H29NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.229,"smiles":null,"spectrum_id":"CCMSLIB00017242179","spectrum_index":18301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 82.042 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017242182","spectrum_index":18302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12S-Hydroxy-5Z,8E,10E-heptadecatrienoic acid (delta mass: 32.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017242183","spectrum_index":18303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 162.5574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.66,"smiles":null,"spectrum_id":"CCMSLIB00017242186","spectrum_index":18304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloro-4-fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 18.0026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.035,"smiles":null,"spectrum_id":"CCMSLIB00017242187","spectrum_index":18305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 226.0624 Da; putative annotation: N/A; putative formula: C9H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.165,"smiles":null,"spectrum_id":"CCMSLIB00017242190","spectrum_index":18306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 72.0364 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.268,"smiles":null,"spectrum_id":"CCMSLIB00017242192","spectrum_index":18307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chaulmoogric Acid (delta mass: 31.9692 Da; putative annotation: N/A; putative formula: S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.217,"smiles":null,"spectrum_id":"CCMSLIB00017242194","spectrum_index":18308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 181.016 Da; putative annotation: N/A; putative formula: C3H7N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.546,"smiles":null,"spectrum_id":"CCMSLIB00017242196","spectrum_index":18309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl 2-(aminomethyl)phenylcarbamate (delta mass: 72.0953 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.239,"smiles":null,"spectrum_id":"CCMSLIB00017242199","spectrum_index":18310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 49.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.28,"smiles":null,"spectrum_id":"CCMSLIB00017242201","spectrum_index":18311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 37.9455 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.0,"smiles":null,"spectrum_id":"CCMSLIB00017242203","spectrum_index":18312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethan CollisionEnergy:102040 (delta mass: 55.0305 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.179,"smiles":null,"spectrum_id":"CCMSLIB00017242205","spectrum_index":18313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Dihydrotestosterone (delta mass: 148.0881 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017242207","spectrum_index":18314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 117.078 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.138,"smiles":null,"spectrum_id":"CCMSLIB00017242208","spectrum_index":18315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S)-2-amino-3-(4-methoxyphenyl)propanoic acid CollisionEnergy:205060 (delta mass: 408.1622 Da; putative annotation: N/A; putative formula: C22H24N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.259,"smiles":null,"spectrum_id":"CCMSLIB00017242211","spectrum_index":18316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 50.0589 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.212,"smiles":null,"spectrum_id":"CCMSLIB00017242212","spectrum_index":18317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Hydroxybutorphanol (delta mass: 145.0741 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.296,"smiles":null,"spectrum_id":"CCMSLIB00017242215","spectrum_index":18318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-(3,4-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 47.0334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.156,"smiles":null,"spectrum_id":"CCMSLIB00017242217","spectrum_index":18319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 738.2908 Da; putative annotation: N/A; putative formula: C33H42N10O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":997.413,"smiles":null,"spectrum_id":"CCMSLIB00017242219","spectrum_index":18320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lotusine (delta mass: 737.3693 Da; putative annotation: N/A; putative formula: C41H56NO9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1051.54,"smiles":null,"spectrum_id":"CCMSLIB00017242221","spectrum_index":18321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 60.0207 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.08,"smiles":null,"spectrum_id":"CCMSLIB00017242223","spectrum_index":18322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 70.0 eV (delta mass: 78.0352 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.138,"smiles":null,"spectrum_id":"CCMSLIB00017242226","spectrum_index":18323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 50.0552 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.126,"smiles":null,"spectrum_id":"CCMSLIB00017242227","spectrum_index":18324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 122.073 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.153,"smiles":null,"spectrum_id":"CCMSLIB00017242230","spectrum_index":18325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 106.0266 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017242231","spectrum_index":18326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 88.5087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.584,"smiles":null,"spectrum_id":"CCMSLIB00017242234","spectrum_index":18327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 254.1721 Da; putative annotation: N/A; putative formula: C15H28O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.253,"smiles":null,"spectrum_id":"CCMSLIB00017242235","spectrum_index":18328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 112.9999 Da; putative annotation: N/A; putative formula: N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017242237","spectrum_index":18329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 202.102 Da; putative annotation: N/A; putative formula: C12H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.151,"smiles":null,"spectrum_id":"CCMSLIB00017242239","spectrum_index":18330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 64.031 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.232,"smiles":null,"spectrum_id":"CCMSLIB00017242241","spectrum_index":18331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine ethyl ester (delta mass: 27.04 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.184,"smiles":null,"spectrum_id":"CCMSLIB00017242243","spectrum_index":18332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((5R,8S,8aS)-3,8-Dimethyl-2-oxo-1,2,4,5,6,7,8,8a-octahydroazulen-5-yl)prop-2-enoic acid (delta mass: 14.0178 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.166,"smiles":null,"spectrum_id":"CCMSLIB00017242246","spectrum_index":18333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 95.0384 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.114,"smiles":null,"spectrum_id":"CCMSLIB00017242247","spectrum_index":18334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Epiandrographolide (delta mass: 116.099 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.316,"smiles":null,"spectrum_id":"CCMSLIB00017242250","spectrum_index":18335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-HYDANTOIN (delta mass: 50.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.092,"smiles":null,"spectrum_id":"CCMSLIB00017242251","spectrum_index":18336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 76.0676 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.326,"smiles":null,"spectrum_id":"CCMSLIB00017242254","spectrum_index":18337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 123.0897 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.311,"smiles":null,"spectrum_id":"CCMSLIB00017242255","spectrum_index":18338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 365.1319 Da; putative annotation: N/A; putative formula: C27H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.171,"smiles":null,"spectrum_id":"CCMSLIB00017242258","spectrum_index":18339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C17:1 (delta mass: 286.2507 Da; putative annotation: N/A; putative formula: C17H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.52,"smiles":null,"spectrum_id":"CCMSLIB00017242259","spectrum_index":18340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1h-indole-3-butanoic acid (delta mass: 10.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.155,"smiles":null,"spectrum_id":"CCMSLIB00017242262","spectrum_index":18341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 108.0569 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.2,"smiles":null,"spectrum_id":"CCMSLIB00017242263","spectrum_index":18342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 193.0386 Da; putative annotation: N/A; putative formula: C9H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.162,"smiles":null,"spectrum_id":"CCMSLIB00017242266","spectrum_index":18343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 102.0831 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.331,"smiles":null,"spectrum_id":"CCMSLIB00017242267","spectrum_index":18344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-methoxybutanoic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.076,"smiles":null,"spectrum_id":"CCMSLIB00017242270","spectrum_index":18345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 73.9296 Da; putative annotation: N/A; putative formula: CH-2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.99,"smiles":null,"spectrum_id":"CCMSLIB00017242271","spectrum_index":18346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Oxocleroda-3,13-dien-15-oic acid (delta mass: 35.0378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.265,"smiles":null,"spectrum_id":"CCMSLIB00017242274","spectrum_index":18347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-4-Hydroxy-L-proline (delta mass: 72.0213 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017242275","spectrum_index":18348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 314.253 Da; putative annotation: N/A; putative formula: C22H35O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.324,"smiles":null,"spectrum_id":"CCMSLIB00017242278","spectrum_index":18349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,11E,13E)-18-(2,6-Dioxopiperidin-4-yl)-9-hydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11,13-tetraenoic acid (delta mass: 50.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.337,"smiles":null,"spectrum_id":"CCMSLIB00017242281","spectrum_index":18350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 474.3819 Da; putative annotation: N/A; putative formula: C29H50N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.537,"smiles":null,"spectrum_id":"CCMSLIB00017242282","spectrum_index":18351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltopentaose from NIST14 (delta mass: 149.0482 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":978.33,"smiles":null,"spectrum_id":"CCMSLIB00017242284","spectrum_index":18352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Adamantyl)-N'-butylthiourea (delta mass: 54.0534 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.242,"smiles":null,"spectrum_id":"CCMSLIB00017242286","spectrum_index":18353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 52.0667 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.549,"smiles":null,"spectrum_id":"CCMSLIB00017242288","spectrum_index":18354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 198.1287 Da; putative annotation: N/A; putative formula: C10H19N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.263,"smiles":null,"spectrum_id":"CCMSLIB00017242290","spectrum_index":18355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 125.9627 Da; putative annotation: N/A; putative formula: CH2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.06,"smiles":null,"spectrum_id":"CCMSLIB00017242293","spectrum_index":18356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Succinyl-L-homoserine (delta mass: 45.9874 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.069,"smiles":null,"spectrum_id":"CCMSLIB00017242294","spectrum_index":18357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 27.0473 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.171,"smiles":null,"spectrum_id":"CCMSLIB00017242297","spectrum_index":18358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 177.0272 Da; putative annotation: N/A; putative formula: C5H7NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.087,"smiles":null,"spectrum_id":"CCMSLIB00017242298","spectrum_index":18359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 26.0159 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.065,"smiles":null,"spectrum_id":"CCMSLIB00017242301","spectrum_index":18360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,9a,9b-octahydrobenzo[g][1]benzofuran-2-one (delta mass: 96.9841 Da; putative annotation: N/A; putative formula: CH-1N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.148,"smiles":null,"spectrum_id":"CCMSLIB00017242302","spectrum_index":18361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 523.3893 Da; putative annotation: N/A; putative formula: C24H49N11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.574,"smiles":null,"spectrum_id":"CCMSLIB00017242305","spectrum_index":18362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 106.0411 Da; putative annotation: N/A; putative formula: CH7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.138,"smiles":null,"spectrum_id":"CCMSLIB00017242308","spectrum_index":18363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 64.066 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.251,"smiles":null,"spectrum_id":"CCMSLIB00017242309","spectrum_index":18364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 59.0373 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.227,"smiles":null,"spectrum_id":"CCMSLIB00017242312","spectrum_index":18365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 267.183 Da; putative annotation: N/A; putative formula: C15H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.321,"smiles":null,"spectrum_id":"CCMSLIB00017242313","spectrum_index":18366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 254.0974 Da; putative annotation: N/A; putative formula: C15H15N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.231,"smiles":null,"spectrum_id":"CCMSLIB00017242315","spectrum_index":18367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 176.1172 Da; putative annotation: N/A; putative formula: C8H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.198,"smiles":null,"spectrum_id":"CCMSLIB00017242317","spectrum_index":18368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurenoic acid (delta mass: 13.0312 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.263,"smiles":null,"spectrum_id":"CCMSLIB00017242320","spectrum_index":18369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Muricholic acid (delta mass: 78.0833 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.378,"smiles":null,"spectrum_id":"CCMSLIB00017242321","spectrum_index":18370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 87.0314 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.091,"smiles":null,"spectrum_id":"CCMSLIB00017242324","spectrum_index":18371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.107,"smiles":null,"spectrum_id":"CCMSLIB00017242325","spectrum_index":18372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 203.0801 Da; putative annotation: N/A; putative formula: C9H17NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.249,"smiles":null,"spectrum_id":"CCMSLIB00017242328","spectrum_index":18373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 97.0168 Da; putative annotation: N/A; putative formula: C4H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.155,"smiles":null,"spectrum_id":"CCMSLIB00017242329","spectrum_index":18374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 338.0848 Da; putative annotation: N/A; putative formula: C10H6N14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.437,"smiles":null,"spectrum_id":"CCMSLIB00017242331","spectrum_index":18375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 88.7887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.86,"smiles":null,"spectrum_id":"CCMSLIB00017242333","spectrum_index":18376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexadecylmethylglycerol (delta mass: 56.0632 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.384,"smiles":null,"spectrum_id":"CCMSLIB00017242336","spectrum_index":18377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.144,"smiles":null,"spectrum_id":"CCMSLIB00017242337","spectrum_index":18378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-5-carboxylic acid (delta mass: 168.1618 Da; putative annotation: N/A; putative formula: C10H20N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.217,"smiles":null,"spectrum_id":"CCMSLIB00017242340","spectrum_index":18379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 240.1156 Da; putative annotation: N/A; putative formula: C9H16N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.191,"smiles":null,"spectrum_id":"CCMSLIB00017242341","spectrum_index":18380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 212.0216 Da; putative annotation: N/A; putative formula: C3H8N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.056,"smiles":null,"spectrum_id":"CCMSLIB00017242344","spectrum_index":18381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 149.085 Da; putative annotation: N/A; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.177,"smiles":null,"spectrum_id":"CCMSLIB00017242345","spectrum_index":18382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 68.0621 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.273,"smiles":null,"spectrum_id":"CCMSLIB00017242348","spectrum_index":18383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dicyclohexyl(hydroxy)acetic acid (delta mass: 36.036 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017242349","spectrum_index":18384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 50.0496 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.328,"smiles":null,"spectrum_id":"CCMSLIB00017242351","spectrum_index":18385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 648.2792 Da; putative annotation: N/A; putative formula: C44H41O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.32,"smiles":null,"spectrum_id":"CCMSLIB00017242353","spectrum_index":18386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 514.1899 Da; putative annotation: N/A; putative formula: C26H26N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.25,"smiles":null,"spectrum_id":"CCMSLIB00017242355","spectrum_index":18387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 12.0364 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.118,"smiles":null,"spectrum_id":"CCMSLIB00017242357","spectrum_index":18388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 79.9566 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.22,"smiles":null,"spectrum_id":"CCMSLIB00017242360","spectrum_index":18389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 94.0777 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.346,"smiles":null,"spectrum_id":"CCMSLIB00017242361","spectrum_index":18390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of stearic acid CollisionEnergy:205060 (delta mass: 56.025 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.304,"smiles":null,"spectrum_id":"CCMSLIB00017242364","spectrum_index":18391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Methylphenyl)-1,3-benzoxazol-5-amine (delta mass: 127.0383 Da; putative annotation: N/A; putative formula: C4H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.141,"smiles":null,"spectrum_id":"CCMSLIB00017242365","spectrum_index":18392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 384.1275 Da; putative annotation: N/A; putative formula: C15H28O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.219,"smiles":null,"spectrum_id":"CCMSLIB00017242368","spectrum_index":18393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 211.0688 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.296,"smiles":null,"spectrum_id":"CCMSLIB00017242369","spectrum_index":18394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactarolide A (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.181,"smiles":null,"spectrum_id":"CCMSLIB00017242372","spectrum_index":18395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.211,"smiles":null,"spectrum_id":"CCMSLIB00017242373","spectrum_index":18396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anabasine (delta mass: 100.0607 Da; putative annotation: N/A; putative formula: H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.184,"smiles":null,"spectrum_id":"CCMSLIB00017242376","spectrum_index":18397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 80.0627 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.305,"smiles":null,"spectrum_id":"CCMSLIB00017242377","spectrum_index":18398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 241.0718 Da; putative annotation: N/A; putative formula: C7H16NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.122,"smiles":null,"spectrum_id":"CCMSLIB00017242380","spectrum_index":18399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 95.0749 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.172,"smiles":null,"spectrum_id":"CCMSLIB00017242381","spectrum_index":18400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 136.0523 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.186,"smiles":null,"spectrum_id":"CCMSLIB00017242384","spectrum_index":18401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-8,11,14-Eicosatrienoic acid (delta mass: 74.06 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.323,"smiles":null,"spectrum_id":"CCMSLIB00017242385","spectrum_index":18402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 355.1763 Da; putative annotation: N/A; putative formula: C14H30NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.247,"smiles":null,"spectrum_id":"CCMSLIB00017242388","spectrum_index":18403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 256.0499 Da; putative annotation: N/A; putative formula: C14H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.11,"smiles":null,"spectrum_id":"CCMSLIB00017242389","spectrum_index":18404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Hydroxytestosterone (delta mass: 147.1259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.337,"smiles":null,"spectrum_id":"CCMSLIB00017242392","spectrum_index":18405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 422.3403 Da; putative annotation: N/A; putative formula: C27H50O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.442,"smiles":null,"spectrum_id":"CCMSLIB00017242393","spectrum_index":18406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,4-Dihydroxyphenyl)-6,7-dihydroxy-2-naphthalenecarboxylic acid (delta mass: 411.1378 Da; putative annotation: N/A; putative formula: C21H17N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.208,"smiles":null,"spectrum_id":"CCMSLIB00017242395","spectrum_index":18407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 256.1622 Da; putative annotation: N/A; putative formula: C13H26N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.264,"smiles":null,"spectrum_id":"CCMSLIB00017242397","spectrum_index":18408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 58.0055 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.118,"smiles":null,"spectrum_id":"CCMSLIB00017242400","spectrum_index":18409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 201.0631 Da; putative annotation: N/A; putative formula: C8H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.165,"smiles":null,"spectrum_id":"CCMSLIB00017242401","spectrum_index":18410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 123.1411 Da; putative annotation: N/A; putative formula: C9H17NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.227,"smiles":null,"spectrum_id":"CCMSLIB00017242404","spectrum_index":18411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 129.0758 Da; putative annotation: N/A; putative formula: C2H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.183,"smiles":null,"spectrum_id":"CCMSLIB00017242405","spectrum_index":18412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C20:3 (delta mass: 555.473 Da; putative annotation: N/A; putative formula: C30H61N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":919.758,"smiles":null,"spectrum_id":"CCMSLIB00017242408","spectrum_index":18413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 98.0005 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.081,"smiles":null,"spectrum_id":"CCMSLIB00017242409","spectrum_index":18414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-(-)-Nopol CollisionEnergy:102040 (delta mass: 295.1994 Da; putative annotation: N/A; putative formula: C17H31NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.342,"smiles":null,"spectrum_id":"CCMSLIB00017242412","spectrum_index":18415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 203.1517 Da; putative annotation: N/A; putative formula: C10H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.264,"smiles":null,"spectrum_id":"CCMSLIB00017242413","spectrum_index":18416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 196.2205 Da; putative annotation: N/A; putative formula: C14H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.297,"smiles":null,"spectrum_id":"CCMSLIB00017242415","spectrum_index":18417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzaldehyde (delta mass: 150.0312 Da; putative annotation: N/A; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.07,"smiles":null,"spectrum_id":"CCMSLIB00017242417","spectrum_index":18418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 443.145 Da; putative annotation: N/A; putative formula: C21H25N5O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.325,"smiles":null,"spectrum_id":"CCMSLIB00017242420","spectrum_index":18419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 144.9899 Da; putative annotation: N/A; putative formula: C6H-1N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.05,"smiles":null,"spectrum_id":"CCMSLIB00017242422","spectrum_index":18420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 131.0942 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.181,"smiles":null,"spectrum_id":"CCMSLIB00017242425","spectrum_index":18421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 146.0368 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017242426","spectrum_index":18422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.092,"smiles":null,"spectrum_id":"CCMSLIB00017242429","spectrum_index":18423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(R)-4-((3R,5R,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-6-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid\"\" (delta mass: 60.0218 Da; putative annotation: N/A; putative formula: C2H4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.306,"smiles":null,"spectrum_id":"CCMSLIB00017242430","spectrum_index":18424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-hydroxybutyl)-3,5,5-trimethylcyclohex-3-en-1-ol (delta mass: 197.0897 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.275,"smiles":null,"spectrum_id":"CCMSLIB00017242433","spectrum_index":18425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-palmitoyl-rac-glycerol (delta mass: 17.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.555,"smiles":null,"spectrum_id":"CCMSLIB00017242434","spectrum_index":18426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE\"\" (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017242437","spectrum_index":18427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4,8,12-Trimethylcyclotetradeca-3,7,11-trien-1-yl)propan-2-ol (delta mass: 385.3572 Da; putative annotation: N/A; putative formula: C24H43N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.625,"smiles":null,"spectrum_id":"CCMSLIB00017242438","spectrum_index":18428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 244.1483 Da; putative annotation: N/A; putative formula: C15H21N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.37,"smiles":null,"spectrum_id":"CCMSLIB00017242441","spectrum_index":18429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclooctatin (delta mass: 102.0819 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.34,"smiles":null,"spectrum_id":"CCMSLIB00017242442","spectrum_index":18430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 122.1068 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.37,"smiles":null,"spectrum_id":"CCMSLIB00017242445","spectrum_index":18431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 158.1463 Da; putative annotation: N/A; putative formula: C13H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.342,"smiles":null,"spectrum_id":"CCMSLIB00017242448","spectrum_index":18432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S,9aR)-octahydro-1H-quinolizin-1-yl)methanamine (delta mass: 44.0267 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.197,"smiles":null,"spectrum_id":"CCMSLIB00017242449","spectrum_index":18433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 114.0893 Da; putative annotation: N/A; putative formula: C4H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.473,"smiles":null,"spectrum_id":"CCMSLIB00017242452","spectrum_index":18434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 282.2564 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.316,"smiles":null,"spectrum_id":"CCMSLIB00017242453","spectrum_index":18435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-(1,2,4a,5-Tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoic acid (delta mass: 108.0514 Da; putative annotation: N/A; putative formula: C7H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.278,"smiles":null,"spectrum_id":"CCMSLIB00017242455","spectrum_index":18436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 67.0785 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.176,"smiles":null,"spectrum_id":"CCMSLIB00017242457","spectrum_index":18437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allantoin CollisionEnergy:102040 (delta mass: 40.924 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.975,"smiles":null,"spectrum_id":"CCMSLIB00017242460","spectrum_index":18438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 487.2763 Da; putative annotation: N/A; putative formula: C29H45NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.336,"smiles":null,"spectrum_id":"CCMSLIB00017242461","spectrum_index":18439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 517.9111 Da; putative annotation: N/A; putative formula: C15H6N10S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.008,"smiles":null,"spectrum_id":"CCMSLIB00017242464","spectrum_index":18440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Deoxypyridoxine (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017242465","spectrum_index":18441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 77.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.259,"smiles":null,"spectrum_id":"CCMSLIB00017242467","spectrum_index":18442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(benzimidazol-2-ylthiomethyl)-4-methoxybenzaldehyde CollisionEnergy:102040 (delta mass: 204.0232 Da; putative annotation: N/A; putative formula: C3H4N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.108,"smiles":null,"spectrum_id":"CCMSLIB00017242469","spectrum_index":18443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxypimara-8(14),15-dien-18-oic acid (delta mass: 74.0617 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.289,"smiles":null,"spectrum_id":"CCMSLIB00017242472","spectrum_index":18444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Azelaic acid from NIST14 (delta mass: 187.1204 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.233,"smiles":null,"spectrum_id":"CCMSLIB00017242473","spectrum_index":18445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 147.0529 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.119,"smiles":null,"spectrum_id":"CCMSLIB00017242475","spectrum_index":18446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 146.0238 Da; putative annotation: N/A; putative formula: C4H7N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.09,"smiles":null,"spectrum_id":"CCMSLIB00017242477","spectrum_index":18447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 24.0357 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017242480","spectrum_index":18448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxytryptamine (delta mass: 197.1357 Da; putative annotation: N/A; putative formula: C10H19N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.254,"smiles":null,"spectrum_id":"CCMSLIB00017242481","spectrum_index":18449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2-1-glyceryl ester (delta mass: 76.0678 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.337,"smiles":null,"spectrum_id":"CCMSLIB00017242483","spectrum_index":18450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 234.2342 Da; putative annotation: N/A; putative formula: C17H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017242485","spectrum_index":18451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxy-3,5-dimethoxybenzoic acid (delta mass: 178.0844 Da; putative annotation: N/A; putative formula: C7H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.145,"smiles":null,"spectrum_id":"CCMSLIB00017242488","spectrum_index":18452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-indol-3-yl)ethanamine (delta mass: 26.9758 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.083,"smiles":null,"spectrum_id":"CCMSLIB00017242489","spectrum_index":18453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 133.0734 Da; putative annotation: N/A; putative formula: C5H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.206,"smiles":null,"spectrum_id":"CCMSLIB00017242492","spectrum_index":18454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 59.0736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.128,"smiles":null,"spectrum_id":"CCMSLIB00017242494","spectrum_index":18455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycerol 1-myristate (delta mass: 436.2149 Da; putative annotation: N/A; putative formula: C29H28N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.468,"smiles":null,"spectrum_id":"CCMSLIB00017242496","spectrum_index":18456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 413.3502 Da; putative annotation: N/A; putative formula: C24H47NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.421,"smiles":null,"spectrum_id":"CCMSLIB00017242498","spectrum_index":18457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 925.364 Da; putative annotation: N/A; putative formula: C36H63NO26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1147.46,"smiles":null,"spectrum_id":"CCMSLIB00017242500","spectrum_index":18458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Methyl-3-oxo-2,5,6,7,8,8a-hexahydro-1H-naphthalen-1-yl)propanoic acid (delta mass: 54.0463 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017242502","spectrum_index":18459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-3-ylmethanamine (delta mass: 51.9917 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.079,"smiles":null,"spectrum_id":"CCMSLIB00017242505","spectrum_index":18460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 106.0419 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.144,"smiles":null,"spectrum_id":"CCMSLIB00017242507","spectrum_index":18461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.3,"smiles":null,"spectrum_id":"CCMSLIB00017242509","spectrum_index":18462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 234.0679 Da; putative annotation: N/A; putative formula: C16H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.139,"smiles":null,"spectrum_id":"CCMSLIB00017242511","spectrum_index":18463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heptadecasphinganine (delta mass: 242.0187 Da; putative annotation: N/A; putative formula: C9H2N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.308,"smiles":null,"spectrum_id":"CCMSLIB00017242513","spectrum_index":18464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,15-Labdanediol (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.336,"smiles":null,"spectrum_id":"CCMSLIB00017242515","spectrum_index":18465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 288.0844 Da; putative annotation: N/A; putative formula: C12H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.123,"smiles":null,"spectrum_id":"CCMSLIB00017242517","spectrum_index":18466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(2E,6E,10E)-9,12-Dihydroxy-6,10-dimethyldodeca-2,6,10-trien-2-yl]-5-methyl-2,3-dihydropyran-6-one (delta mass: 72.0458 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.267,"smiles":null,"spectrum_id":"CCMSLIB00017242519","spectrum_index":18467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 361.7714 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.831,"smiles":null,"spectrum_id":"CCMSLIB00017242521","spectrum_index":18468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. 1,9-lactone (delta mass: 35.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.274,"smiles":null,"spectrum_id":"CCMSLIB00017242523","spectrum_index":18469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 34.0053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017242525","spectrum_index":18470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 545.4284 Da; putative annotation: N/A; putative formula: C27H51N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.499,"smiles":null,"spectrum_id":"CCMSLIB00017242528","spectrum_index":18471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desoxypipradrol (delta mass: 480.1767 Da; putative annotation: N/A; putative formula: C24H28N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.351,"smiles":null,"spectrum_id":"CCMSLIB00017242529","spectrum_index":18472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Adamantanol (delta mass: 247.193 Da; putative annotation: N/A; putative formula: C10H26N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.32,"smiles":null,"spectrum_id":"CCMSLIB00017242532","spectrum_index":18473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid CollisionEnergy:102040 (delta mass: 71.0371 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.123,"smiles":null,"spectrum_id":"CCMSLIB00017242533","spectrum_index":18474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":117.139,"smiles":null,"spectrum_id":"CCMSLIB00017242536","spectrum_index":18475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 565.4198 Da; putative annotation: N/A; putative formula: C40H56NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.511,"smiles":null,"spectrum_id":"CCMSLIB00017242537","spectrum_index":18476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Paxitriol (delta mass: 257.1271 Da; putative annotation: N/A; putative formula: C13H23NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.391,"smiles":null,"spectrum_id":"CCMSLIB00017242540","spectrum_index":18477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 40.0311 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.2,"smiles":null,"spectrum_id":"CCMSLIB00017242541","spectrum_index":18478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydroprostaglandin F2.alpha. (delta mass: 50.0157 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.279,"smiles":null,"spectrum_id":"CCMSLIB00017242544","spectrum_index":18479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Dihydrotestosterone (delta mass: 88.0678 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.3,"smiles":null,"spectrum_id":"CCMSLIB00017242545","spectrum_index":18480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 16.0161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.076,"smiles":null,"spectrum_id":"CCMSLIB00017242548","spectrum_index":18481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 387.2541 Da; putative annotation: N/A; putative formula: C20H38NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.523,"smiles":null,"spectrum_id":"CCMSLIB00017242549","spectrum_index":18482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 75.1138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.241,"smiles":null,"spectrum_id":"CCMSLIB00017242552","spectrum_index":18483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol (delta mass: 162.0532 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.186,"smiles":null,"spectrum_id":"CCMSLIB00017242553","spectrum_index":18484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylpentadecanoic acid (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.294,"smiles":null,"spectrum_id":"CCMSLIB00017242556","spectrum_index":18485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 175.0883 Da; putative annotation: N/A; putative formula: C6H14N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.155,"smiles":null,"spectrum_id":"CCMSLIB00017242557","spectrum_index":18486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-bis(ethoxycarbonyl)-4-methyl-1,3-phenylenediamine (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.16,"smiles":null,"spectrum_id":"CCMSLIB00017242560","spectrum_index":18487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Aminodecanoic acid (delta mass: 38.0518 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.216,"smiles":null,"spectrum_id":"CCMSLIB00017242561","spectrum_index":18488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[(2,5,5,8a-Tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol (delta mass: 80.0625 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.315,"smiles":null,"spectrum_id":"CCMSLIB00017242563","spectrum_index":18489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 517.3615 Da; putative annotation: N/A; putative formula: C27H51NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.588,"smiles":null,"spectrum_id":"CCMSLIB00017242565","spectrum_index":18490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to trans-EKODE-(E)-Ib from NIST14 (delta mass: 15.9949 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.217,"smiles":null,"spectrum_id":"CCMSLIB00017242568","spectrum_index":18491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 86.073 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.169,"smiles":null,"spectrum_id":"CCMSLIB00017242569","spectrum_index":18492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 87.0279 Da; putative annotation: N/A; putative formula: C2H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.129,"smiles":null,"spectrum_id":"CCMSLIB00017242572","spectrum_index":18493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000511 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 50.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017242573","spectrum_index":18494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 304.1136 Da; putative annotation: N/A; putative formula: C17H20O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.21,"smiles":null,"spectrum_id":"CCMSLIB00017242576","spectrum_index":18495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 147.0891 Da; putative annotation: N/A; putative formula: C6H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.321,"smiles":null,"spectrum_id":"CCMSLIB00017242577","spectrum_index":18496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydromorphine (delta mass: 127.0515 Da; putative annotation: N/A; putative formula: C8H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.211,"smiles":null,"spectrum_id":"CCMSLIB00017242580","spectrum_index":18497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 70.0426 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.145,"smiles":null,"spectrum_id":"CCMSLIB00017242581","spectrum_index":18498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methylephedrine (delta mass: 231.9456 Da; putative annotation: N/A; putative formula: C3H7O6P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.084,"smiles":null,"spectrum_id":"CCMSLIB00017242584","spectrum_index":18499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzenemethanol (delta mass: 275.1988 Da; putative annotation: N/A; putative formula: C16H25N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.279,"smiles":null,"spectrum_id":"CCMSLIB00017242585","spectrum_index":18500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 71.0735 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.207,"smiles":null,"spectrum_id":"CCMSLIB00017242588","spectrum_index":18501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 109.0395 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.143,"smiles":null,"spectrum_id":"CCMSLIB00017242589","spectrum_index":18502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 73.0054 Da; putative annotation: N/A; putative formula: C4H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017242592","spectrum_index":18503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 77.0267 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017242593","spectrum_index":18504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 79.0267 Da; putative annotation: N/A; putative formula: C2HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.248,"smiles":null,"spectrum_id":"CCMSLIB00017242596","spectrum_index":18505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 234.0974 Da; putative annotation: N/A; putative formula: C8H18N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.163,"smiles":null,"spectrum_id":"CCMSLIB00017242597","spectrum_index":18506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 285.2157 Da; putative annotation: N/A; putative formula: C13H27N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.5,"smiles":null,"spectrum_id":"CCMSLIB00017242600","spectrum_index":18507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,19,22,25,28,31-Tetratriacontahexaenoic acid, (all-Z)- (delta mass: 148.1262 Da; putative annotation: N/A; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.562,"smiles":null,"spectrum_id":"CCMSLIB00017242601","spectrum_index":18508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 71.0015 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.098,"smiles":null,"spectrum_id":"CCMSLIB00017242604","spectrum_index":18509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin H1 (delta mass: 88.0721 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.32,"smiles":null,"spectrum_id":"CCMSLIB00017242605","spectrum_index":18510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 261.0206 Da; putative annotation: N/A; putative formula: C11H7N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.06,"smiles":null,"spectrum_id":"CCMSLIB00017242608","spectrum_index":18511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 46.0149 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.042,"smiles":null,"spectrum_id":"CCMSLIB00017242609","spectrum_index":18512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Limaprost (delta mass: 92.0623 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.326,"smiles":null,"spectrum_id":"CCMSLIB00017242612","spectrum_index":18513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 284.2706 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.476,"smiles":null,"spectrum_id":"CCMSLIB00017242614","spectrum_index":18514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 126.0837 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.326,"smiles":null,"spectrum_id":"CCMSLIB00017242616","spectrum_index":18515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110101 Terbutaline|5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol (delta mass: 175.3562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.5,"smiles":null,"spectrum_id":"CCMSLIB00017242618","spectrum_index":18516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 167.055 Da; putative annotation: N/A; putative formula: C4H5N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.141,"smiles":null,"spectrum_id":"CCMSLIB00017242620","spectrum_index":18517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 76.0671 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.289,"smiles":null,"spectrum_id":"CCMSLIB00017242623","spectrum_index":18518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 78.0461 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.242,"smiles":null,"spectrum_id":"CCMSLIB00017242625","spectrum_index":18519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 66.0467 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017242627","spectrum_index":18520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 78.0462 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.252,"smiles":null,"spectrum_id":"CCMSLIB00017242629","spectrum_index":18521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androstan-3.beta.-ol (delta mass: 104.0979 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.35,"smiles":null,"spectrum_id":"CCMSLIB00017242631","spectrum_index":18522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 120.0239 Da; putative annotation: N/A; putative formula: C6H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.131,"smiles":null,"spectrum_id":"CCMSLIB00017242633","spectrum_index":18523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 10.0206 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.087,"smiles":null,"spectrum_id":"CCMSLIB00017242635","spectrum_index":18524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-2-hydroxybenzoic acid (delta mass: 23.0156 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.049,"smiles":null,"spectrum_id":"CCMSLIB00017242637","spectrum_index":18525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6.alpha.,11.beta.)-11-hydroxy-6-methylpregn-4-ene-3,20-dione (delta mass: 90.0472 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.29,"smiles":null,"spectrum_id":"CCMSLIB00017242640","spectrum_index":18526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 89.0839 Da; putative annotation: N/A; putative formula: H7N7O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.154,"smiles":null,"spectrum_id":"CCMSLIB00017242641","spectrum_index":18527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 114.0676 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.18,"smiles":null,"spectrum_id":"CCMSLIB00017242644","spectrum_index":18528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 419.2417 Da; putative annotation: N/A; putative formula: C22H33N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.307,"smiles":null,"spectrum_id":"CCMSLIB00017242645","spectrum_index":18529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 9.9794 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.18,"smiles":null,"spectrum_id":"CCMSLIB00017242648","spectrum_index":18530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 66.0479 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017242649","spectrum_index":18531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aurantiamide (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.259,"smiles":null,"spectrum_id":"CCMSLIB00017242652","spectrum_index":18532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 327.1325 Da; putative annotation: N/A; putative formula: C16H25NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.193,"smiles":null,"spectrum_id":"CCMSLIB00017242654","spectrum_index":18533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-3-ylmethanamine (delta mass: 53.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.108,"smiles":null,"spectrum_id":"CCMSLIB00017242656","spectrum_index":18534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 70.0037 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.084,"smiles":null,"spectrum_id":"CCMSLIB00017242659","spectrum_index":18535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Cyclodecadiene-1-methanol, .alpha.,.alpha.,4,8-tetramethyl- (delta mass: 186.1036 Da; putative annotation: N/A; putative formula: C7H15N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.309,"smiles":null,"spectrum_id":"CCMSLIB00017242660","spectrum_index":18536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 318.2527 Da; putative annotation: N/A; putative formula: C17H30N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.319,"smiles":null,"spectrum_id":"CCMSLIB00017242663","spectrum_index":18537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentianose (delta mass: 108.0216 Da; putative annotation: 1,3,5-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.198,"smiles":null,"spectrum_id":"CCMSLIB00017242665","spectrum_index":18538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 113.0836 Da; putative annotation: 2-Amino-2-ethylbutanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.228,"smiles":null,"spectrum_id":"CCMSLIB00017242667","spectrum_index":18539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 94.0167 Da; putative annotation: Uracil; putative formula: C4H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.087,"smiles":null,"spectrum_id":"CCMSLIB00017242669","spectrum_index":18540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 87.0681 Da; putative annotation: 2-Amino-2-methyl-1,3-propanediol; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.128,"smiles":null,"spectrum_id":"CCMSLIB00017242671","spectrum_index":18541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 316.2044 Da; putative annotation: 8-iso-Prostaglandin A2; putative formula: C20H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.416,"smiles":null,"spectrum_id":"CCMSLIB00017242674","spectrum_index":18542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 144.0417 Da; putative annotation: 3-Hydroxy-3-methylglutaric acid; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.097,"smiles":null,"spectrum_id":"CCMSLIB00017242675","spectrum_index":18543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 260.2138 Da; putative annotation: gamma-linolenic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.451,"smiles":null,"spectrum_id":"CCMSLIB00017242678","spectrum_index":18544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 238.1931 Da; putative annotation: 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol; putative formula: C15H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.378,"smiles":null,"spectrum_id":"CCMSLIB00017242681","spectrum_index":18545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 94.0773 Da; putative annotation: exo-Norborneol; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.215,"smiles":null,"spectrum_id":"CCMSLIB00017242683","spectrum_index":18546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 107.0041 Da; putative annotation: TAURINE; putative formula: C2H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.128,"smiles":null,"spectrum_id":"CCMSLIB00017242685","spectrum_index":18547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Imino-4-methylpiperidine (delta mass: 113.0837 Da; putative annotation: DL-.beta.-Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.191,"smiles":null,"spectrum_id":"CCMSLIB00017242688","spectrum_index":18548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurane-17,18-dioic acid (delta mass: 262.194 Da; putative annotation: 12S-Hydroxy-5Z,8E,10E-heptadecatrienoic acid; putative formula: C17H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.416,"smiles":null,"spectrum_id":"CCMSLIB00017242689","spectrum_index":18549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 266.26 Da; putative annotation: Isostearic acid; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.565,"smiles":null,"spectrum_id":"CCMSLIB00017242692","spectrum_index":18550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 350.2459 Da; putative annotation: Misoprostol (free acid); putative formula: C21H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.473,"smiles":null,"spectrum_id":"CCMSLIB00017242694","spectrum_index":18551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 288.2464 Da; putative annotation: 17.alpha.-Methyl-5.beta.-androstan-3.alpha.,17.beta.-diol; putative formula: C20H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.436,"smiles":null,"spectrum_id":"CCMSLIB00017242696","spectrum_index":18552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 123.1053 Da; putative annotation: 1-(Piperidin-2-yl)propan-1-one; putative formula: C8H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.181,"smiles":null,"spectrum_id":"CCMSLIB00017242698","spectrum_index":18553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 264.2462 Da; putative annotation: Oleic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.473,"smiles":null,"spectrum_id":"CCMSLIB00017242701","spectrum_index":18554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 292.2382 Da; putative annotation: 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.449,"smiles":null,"spectrum_id":"CCMSLIB00017242703","spectrum_index":18555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-yl)-N-(4-methoxyphenyl)acetamide (delta mass: 280.1268 Da; putative annotation: Toxin T2 tetrol; putative formula: C15H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.255,"smiles":null,"spectrum_id":"CCMSLIB00017242705","spectrum_index":18556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 180.0445 Da; putative annotation: Syringic Acid; putative formula: C9H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.276,"smiles":null,"spectrum_id":"CCMSLIB00017242707","spectrum_index":18557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 98.073 Da; putative annotation: 4-Methylvaleric acid; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.253,"smiles":null,"spectrum_id":"CCMSLIB00017242709","spectrum_index":18558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid from NIST14 (delta mass: 280.2426 Da; putative annotation: 6-Oxooctadecanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.469,"smiles":null,"spectrum_id":"CCMSLIB00017242711","spectrum_index":18559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 113.0842 Da; putative annotation: Ethyl 4-aminobutanoate; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.155,"smiles":null,"spectrum_id":"CCMSLIB00017242714","spectrum_index":18560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 122.1098 Da; putative annotation: trans,cis-3,6-Nonadien-1-ol; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.357,"smiles":null,"spectrum_id":"CCMSLIB00017242716","spectrum_index":18561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Octanoylsphingosine (delta mass: 66.0838 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.478,"smiles":null,"spectrum_id":"CCMSLIB00017242718","spectrum_index":18562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Syringic acid from NIST14 (delta mass: 100.0522 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017242720","spectrum_index":18563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 316.1339 Da; putative annotation: N/A; putative formula: C17H21N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.319,"smiles":null,"spectrum_id":"CCMSLIB00017242722","spectrum_index":18564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Lys (delta mass: 87.0317 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.177,"smiles":null,"spectrum_id":"CCMSLIB00017242724","spectrum_index":18565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 372.1815 Da; putative annotation: N/A; putative formula: C17H29N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.32,"smiles":null,"spectrum_id":"CCMSLIB00017242726","spectrum_index":18566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 32.029 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.056,"smiles":null,"spectrum_id":"CCMSLIB00017242729","spectrum_index":18567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 66.0469 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.315,"smiles":null,"spectrum_id":"CCMSLIB00017242731","spectrum_index":18568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ent-15-Hydroxy-8(17)-labden-2-one (delta mass: 88.0691 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.332,"smiles":null,"spectrum_id":"CCMSLIB00017242733","spectrum_index":18569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 92.0231 Da; putative annotation: N/A; putative formula: C2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.135,"smiles":null,"spectrum_id":"CCMSLIB00017242735","spectrum_index":18570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 314.2448 Da; putative annotation: N/A; putative formula: C18H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.472,"smiles":null,"spectrum_id":"CCMSLIB00017242737","spectrum_index":18571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11-Eicosatrienoic acid (delta mass: 88.0682 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.331,"smiles":null,"spectrum_id":"CCMSLIB00017242739","spectrum_index":18572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 52.0313 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017242741","spectrum_index":18573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 589.3466 Da; putative annotation: N/A; putative formula: C29H51NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.417,"smiles":null,"spectrum_id":"CCMSLIB00017242743","spectrum_index":18574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 146.1108 Da; putative annotation: N/A; putative formula: C11H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.458,"smiles":null,"spectrum_id":"CCMSLIB00017242746","spectrum_index":18575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-pentyl- (delta mass: 27.9941 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.127,"smiles":null,"spectrum_id":"CCMSLIB00017242747","spectrum_index":18576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-cis-Retinol (delta mass: 159.1259 Da; putative annotation: N/A; putative formula: C8H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.363,"smiles":null,"spectrum_id":"CCMSLIB00017242750","spectrum_index":18577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxycoumarin (delta mass: 49.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017242751","spectrum_index":18578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 437.0832 Da; putative annotation: N/A; putative formula: C25H15N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.17,"smiles":null,"spectrum_id":"CCMSLIB00017242754","spectrum_index":18579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 142.1134 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.398,"smiles":null,"spectrum_id":"CCMSLIB00017242755","spectrum_index":18580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[5-(2-Methylpropyl)-3,6-dioxopiperazin-2-yl]propanoic acid (delta mass: 44.0741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.208,"smiles":null,"spectrum_id":"CCMSLIB00017242758","spectrum_index":18581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-[4-(Dimethylamino)benzylidene]-1,3-dihydro-2H-indol-2-one (delta mass: 18.1296 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.263,"smiles":null,"spectrum_id":"CCMSLIB00017242760","spectrum_index":18582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1180.6832 Da; putative annotation: N/A; putative formula: C70H88N10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1402.78,"smiles":null,"spectrum_id":"CCMSLIB00017242762","spectrum_index":18583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 11.9893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.087,"smiles":null,"spectrum_id":"CCMSLIB00017242764","spectrum_index":18584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 181.95 Da; putative annotation: N/A; putative formula: C7H2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.01,"smiles":null,"spectrum_id":"CCMSLIB00017242766","spectrum_index":18585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 89.0479 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.27,"smiles":null,"spectrum_id":"CCMSLIB00017242768","spectrum_index":18586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 160.0842 Da; putative annotation: N/A; putative formula: C8H17O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.191,"smiles":null,"spectrum_id":"CCMSLIB00017242770","spectrum_index":18587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 219.1111 Da; putative annotation: N/A; putative formula: C9H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.171,"smiles":null,"spectrum_id":"CCMSLIB00017242773","spectrum_index":18588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 422.1493 Da; putative annotation: N/A; putative formula: C32H22O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.241,"smiles":null,"spectrum_id":"CCMSLIB00017242774","spectrum_index":18589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 394.1523 Da; putative annotation: N/A; putative formula: C14H26N4O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.233,"smiles":null,"spectrum_id":"CCMSLIB00017242777","spectrum_index":18590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384825-01_C29H42O8_Stigmast-7-ene-6,22,26-trione, 26,28-epoxy-2,3,14,20-tetrahydroxy-, (2beta,3beta,5beta,24S,25S,28R)- (delta mass: 60.0009 Da; putative annotation: N/A; putative formula: C5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.296,"smiles":null,"spectrum_id":"CCMSLIB00017242779","spectrum_index":18591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 43.0419 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.175,"smiles":null,"spectrum_id":"CCMSLIB00017242781","spectrum_index":18592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 66.9969 Da; putative annotation: N/A; putative formula: C3H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.136,"smiles":null,"spectrum_id":"CCMSLIB00017242784","spectrum_index":18593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 391.3476 Da; putative annotation: N/A; putative formula: C25H45NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.45,"smiles":null,"spectrum_id":"CCMSLIB00017242785","spectrum_index":18594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 17.9333 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.993,"smiles":null,"spectrum_id":"CCMSLIB00017242788","spectrum_index":18595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 372.1258 Da; putative annotation: N/A; putative formula: C12H23N8P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.167,"smiles":null,"spectrum_id":"CCMSLIB00017242790","spectrum_index":18596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 152.0462 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.133,"smiles":null,"spectrum_id":"CCMSLIB00017242792","spectrum_index":18597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 141.0785 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.165,"smiles":null,"spectrum_id":"CCMSLIB00017242795","spectrum_index":18598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 90.032 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.108,"smiles":null,"spectrum_id":"CCMSLIB00017242797","spectrum_index":18599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 102.0679 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.164,"smiles":null,"spectrum_id":"CCMSLIB00017242799","spectrum_index":18600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,8Z,14Z-Eicosatrienoic acid (delta mass: 389.2794 Da; putative annotation: N/A; putative formula: C21H35N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.543,"smiles":null,"spectrum_id":"CCMSLIB00017242801","spectrum_index":18601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORADRENALINE (delta mass: 32.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.107,"smiles":null,"spectrum_id":"CCMSLIB00017242803","spectrum_index":18602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 132.0648 Da; putative annotation: N/A; putative formula: C3H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.167,"smiles":null,"spectrum_id":"CCMSLIB00017242806","spectrum_index":18603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 240.1025 Da; putative annotation: N/A; putative formula: C11H17N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.366,"smiles":null,"spectrum_id":"CCMSLIB00017242807","spectrum_index":18604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 178.0614 Da; putative annotation: N/A; putative formula: C4H11N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.351,"smiles":null,"spectrum_id":"CCMSLIB00017242810","spectrum_index":18605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,7,10,13,16,19-Docosahexaenoic acid (delta mass: 285.2677 Da; putative annotation: N/A; putative formula: C17H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.515,"smiles":null,"spectrum_id":"CCMSLIB00017242812","spectrum_index":18606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 201.0096 Da; putative annotation: N/A; putative formula: C7H7NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":794.524,"smiles":null,"spectrum_id":"CCMSLIB00017242814","spectrum_index":18607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 61.0232 Da; putative annotation: N/A; putative formula: H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.1,"smiles":null,"spectrum_id":"CCMSLIB00017242816","spectrum_index":18608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 507.2116 Da; putative annotation: N/A; putative formula: C36H30NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.272,"smiles":null,"spectrum_id":"CCMSLIB00017242818","spectrum_index":18609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 14.0145 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.246,"smiles":null,"spectrum_id":"CCMSLIB00017242820","spectrum_index":18610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 181.0732 Da; putative annotation: N/A; putative formula: C9H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.133,"smiles":null,"spectrum_id":"CCMSLIB00017242822","spectrum_index":18611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxybenzoate (delta mass: 43.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.102,"smiles":null,"spectrum_id":"CCMSLIB00017242825","spectrum_index":18612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-amino-1-piperidinecarboxylate (delta mass: 141.0791 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.208,"smiles":null,"spectrum_id":"CCMSLIB00017242826","spectrum_index":18613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Methylphenyl)-1,3-benzoxazol-6-amine (delta mass: 18.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.113,"smiles":null,"spectrum_id":"CCMSLIB00017242829","spectrum_index":18614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 27.9956 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.109,"smiles":null,"spectrum_id":"CCMSLIB00017242830","spectrum_index":18615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 681.5148 Da; putative annotation: N/A; putative formula: C43H71NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":992.737,"smiles":null,"spectrum_id":"CCMSLIB00017242832","spectrum_index":18616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 164.1413 Da; putative annotation: N/A; putative formula: C9H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.227,"smiles":null,"spectrum_id":"CCMSLIB00017242834","spectrum_index":18617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Chlorophenoxy)ethanol (delta mass: 185.0736 Da; putative annotation: N/A; putative formula: C6H11N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.11,"smiles":null,"spectrum_id":"CCMSLIB00017242837","spectrum_index":18618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 518.4689 Da; putative annotation: N/A; putative formula: C34H62O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.612,"smiles":null,"spectrum_id":"CCMSLIB00017242838","spectrum_index":18619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 152.4287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.5,"smiles":null,"spectrum_id":"CCMSLIB00017242841","spectrum_index":18620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.076,"smiles":null,"spectrum_id":"CCMSLIB00017242842","spectrum_index":18621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C22:5 (delta mass: 130.1054 Da; putative annotation: N/A; putative formula: C2H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.39,"smiles":null,"spectrum_id":"CCMSLIB00017242845","spectrum_index":18622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycoursodeoxycholic acid (delta mass: 104.1086 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.43,"smiles":null,"spectrum_id":"CCMSLIB00017242846","spectrum_index":18623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 74.1273 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.175,"smiles":null,"spectrum_id":"CCMSLIB00017242849","spectrum_index":18624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 57.0215 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.082,"smiles":null,"spectrum_id":"CCMSLIB00017242850","spectrum_index":18625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 27.1777 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.253,"smiles":null,"spectrum_id":"CCMSLIB00017242853","spectrum_index":18626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Previtamin D3 (delta mass: 17.9665 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.313,"smiles":null,"spectrum_id":"CCMSLIB00017242854","spectrum_index":18627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 462.2381 Da; putative annotation: N/A; putative formula: C33H34S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.517,"smiles":null,"spectrum_id":"CCMSLIB00017242857","spectrum_index":18628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 13.0197 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.085,"smiles":null,"spectrum_id":"CCMSLIB00017242858","spectrum_index":18629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 50.0906 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.145,"smiles":null,"spectrum_id":"CCMSLIB00017242861","spectrum_index":18630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 95.9026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.967,"smiles":null,"spectrum_id":"CCMSLIB00017242862","spectrum_index":18631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 102.0689 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.134,"smiles":null,"spectrum_id":"CCMSLIB00017242865","spectrum_index":18632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311023 Feruloyl O-methyldopamine (delta mass: 207.111 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.26,"smiles":null,"spectrum_id":"CCMSLIB00017242866","spectrum_index":18633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tau-C13:0 (delta mass: 84.0939 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.299,"smiles":null,"spectrum_id":"CCMSLIB00017242869","spectrum_index":18634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 196.1287 Da; putative annotation: N/A; putative formula: C12H20S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.278,"smiles":null,"spectrum_id":"CCMSLIB00017242871","spectrum_index":18635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 68.0125 Da; putative annotation: N/A; putative formula: CN4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.115,"smiles":null,"spectrum_id":"CCMSLIB00017242873","spectrum_index":18636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 70.9288 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.067,"smiles":null,"spectrum_id":"CCMSLIB00017242875","spectrum_index":18637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 37.0564 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.143,"smiles":null,"spectrum_id":"CCMSLIB00017242877","spectrum_index":18638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 44.0372 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.118,"smiles":null,"spectrum_id":"CCMSLIB00017242880","spectrum_index":18639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 76.1101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.196,"smiles":null,"spectrum_id":"CCMSLIB00017242881","spectrum_index":18640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 265.1348 Da; putative annotation: N/A; putative formula: C11H23NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.2,"smiles":null,"spectrum_id":"CCMSLIB00017242884","spectrum_index":18641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 145.1462 Da; putative annotation: N/A; putative formula: C4H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.217,"smiles":null,"spectrum_id":"CCMSLIB00017242885","spectrum_index":18642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 35.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.316,"smiles":null,"spectrum_id":"CCMSLIB00017242888","spectrum_index":18643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Isobutyryl-4-piperidinamine (delta mass: 171.0177 Da; putative annotation: N/A; putative formula: C7H9NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.167,"smiles":null,"spectrum_id":"CCMSLIB00017242889","spectrum_index":18644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 172.0721 Da; putative annotation: N/A; putative formula: C12H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.231,"smiles":null,"spectrum_id":"CCMSLIB00017242892","spectrum_index":18645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,17,20,23,26,29-Dotriacontahexaenoic acid, (14Z,17Z,20Z,23Z,26Z,29Z)- (delta mass: 90.0307 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.435,"smiles":null,"spectrum_id":"CCMSLIB00017242893","spectrum_index":18646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385758-01!7-hydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 162.0502 Da; putative annotation: N/A; putative formula: C2H6N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.168,"smiles":null,"spectrum_id":"CCMSLIB00017242896","spectrum_index":18647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-[(2,6-Dihydroxy-2,5,5,8a-tetramethyldecalin-1-yl)methoxy]coumarin (delta mass: 120.0228 Da; putative annotation: N/A; putative formula: C6H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.255,"smiles":null,"spectrum_id":"CCMSLIB00017242897","spectrum_index":18648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,17,20,23,26,29-Dotriacontahexaenoic acid, (14Z,17Z,20Z,23Z,26Z,29Z)- (delta mass: 54.0329 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.437,"smiles":null,"spectrum_id":"CCMSLIB00017242900","spectrum_index":18649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 219.126 Da; putative annotation: N/A; putative formula: C13H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.176,"smiles":null,"spectrum_id":"CCMSLIB00017242901","spectrum_index":18650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid CollisionEnergy:205060 (delta mass: 117.9899 Da; putative annotation: N/A; putative formula: C3H2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.06,"smiles":null,"spectrum_id":"CCMSLIB00017242904","spectrum_index":18651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 266.2608 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.41,"smiles":null,"spectrum_id":"CCMSLIB00017242905","spectrum_index":18652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 217.1102 Da; putative annotation: N/A; putative formula: C13H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.222,"smiles":null,"spectrum_id":"CCMSLIB00017242908","spectrum_index":18653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 79.042 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.154,"smiles":null,"spectrum_id":"CCMSLIB00017242909","spectrum_index":18654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 297.1152 Da; putative annotation: N/A; putative formula: C21H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.156,"smiles":null,"spectrum_id":"CCMSLIB00017242912","spectrum_index":18655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-aminovaleric acid betaine (delta mass: 52.8766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.01,"smiles":null,"spectrum_id":"CCMSLIB00017242913","spectrum_index":18656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 75.0316 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.279,"smiles":null,"spectrum_id":"CCMSLIB00017242916","spectrum_index":18657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-5,8,11,14-Eicosatetraenoic acid from NIST14 (delta mass: 67.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.311,"smiles":null,"spectrum_id":"CCMSLIB00017242917","spectrum_index":18658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 100.0165 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.145,"smiles":null,"spectrum_id":"CCMSLIB00017242920","spectrum_index":18659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 387.2999 Da; putative annotation: N/A; putative formula: C22H37N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.537,"smiles":null,"spectrum_id":"CCMSLIB00017242921","spectrum_index":18660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Picrinine (delta mass: 244.2406 Da; putative annotation: N/A; putative formula: C11H28N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.411,"smiles":null,"spectrum_id":"CCMSLIB00017242924","spectrum_index":18661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyphenylacetone (delta mass: 28.0312 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017242925","spectrum_index":18662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 637.4391 Da; putative annotation: N/A; putative formula: C37H59N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.499,"smiles":null,"spectrum_id":"CCMSLIB00017242928","spectrum_index":18663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Aminobenzoic acid (delta mass: 50.0088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.064,"smiles":null,"spectrum_id":"CCMSLIB00017242930","spectrum_index":18664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 635.5451 Da; putative annotation: N/A; putative formula: C35H69N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.772,"smiles":null,"spectrum_id":"CCMSLIB00017242932","spectrum_index":18665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 200.1059 Da; putative annotation: N/A; putative formula: C11H20O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.275,"smiles":null,"spectrum_id":"CCMSLIB00017242935","spectrum_index":18666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 605.4302 Da; putative annotation: N/A; putative formula: C36H55N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.501,"smiles":null,"spectrum_id":"CCMSLIB00017242936","spectrum_index":18667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 112.0674 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.263,"smiles":null,"spectrum_id":"CCMSLIB00017242938","spectrum_index":18668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid (delta mass: 292.2043 Da; putative annotation: N/A; putative formula: C18H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.437,"smiles":null,"spectrum_id":"CCMSLIB00017242941","spectrum_index":18669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 60.0364 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.107,"smiles":null,"spectrum_id":"CCMSLIB00017242942","spectrum_index":18670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300111 11,12-Methylenedioxykopsinaline (delta mass: 59.0624 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.254,"smiles":null,"spectrum_id":"CCMSLIB00017242945","spectrum_index":18671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-6-Octadecenoic acid (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.289,"smiles":null,"spectrum_id":"CCMSLIB00017242947","spectrum_index":18672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxy-16-methoxyoctadeca-9,12-dienoic acid (delta mass: 35.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.29,"smiles":null,"spectrum_id":"CCMSLIB00017242949","spectrum_index":18673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 163.0631 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.254,"smiles":null,"spectrum_id":"CCMSLIB00017242950","spectrum_index":18674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 180.0601 Da; putative annotation: N/A; putative formula: C10H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.173,"smiles":null,"spectrum_id":"CCMSLIB00017242953","spectrum_index":18675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003180 Hordenine|4-[2-(dimethylamino)ethyl]phenol (delta mass: 248.0679 Da; putative annotation: N/A; putative formula: C7H13N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.19,"smiles":null,"spectrum_id":"CCMSLIB00017242955","spectrum_index":18676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (4R,4aS,10R,13aR)-14-hydroxy-4,13a-dimethyl-9,13-dioxo-2,3,4,4a,5,6,9,10,11,12,13,13a-dodecahydro-1H-7,10-methanobenzo[11]annulene-4-carboxylate (delta mass: 36.0375 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.238,"smiles":null,"spectrum_id":"CCMSLIB00017242957","spectrum_index":18677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetonitrile (delta mass: 103.0155 Da; putative annotation: N/A; putative formula: C5HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.091,"smiles":null,"spectrum_id":"CCMSLIB00017242960","spectrum_index":18678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 311.3173 Da; putative annotation: N/A; putative formula: C16H37N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.388,"smiles":null,"spectrum_id":"CCMSLIB00017242961","spectrum_index":18679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 13.0195 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.122,"smiles":null,"spectrum_id":"CCMSLIB00017242963","spectrum_index":18680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 85.1505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.289,"smiles":null,"spectrum_id":"CCMSLIB00017242965","spectrum_index":18681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 208.094 Da; putative annotation: N/A; putative formula: C12H18O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.175,"smiles":null,"spectrum_id":"CCMSLIB00017242968","spectrum_index":18682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Acetyl-11-keto-.beta.-boswellic acid (delta mass: 76.0225 Da; putative annotation: N/A; putative formula: H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.38,"smiles":null,"spectrum_id":"CCMSLIB00017242970","spectrum_index":18683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017242972","spectrum_index":18684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodecanedioic acid (delta mass: 70.0416 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.201,"smiles":null,"spectrum_id":"CCMSLIB00017242974","spectrum_index":18685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 473.3844 Da; putative annotation: N/A; putative formula: C26H47N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.455,"smiles":null,"spectrum_id":"CCMSLIB00017242977","spectrum_index":18686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 578.3905 Da; putative annotation: N/A; putative formula: C28H50N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.451,"smiles":null,"spectrum_id":"CCMSLIB00017242979","spectrum_index":18687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 935.5993 Da; putative annotation: N/A; putative formula: C45H81N11O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1116.67,"smiles":null,"spectrum_id":"CCMSLIB00017242981","spectrum_index":18688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 110.0828 Da; putative annotation: N/A; putative formula: C6H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.148,"smiles":null,"spectrum_id":"CCMSLIB00017242983","spectrum_index":18689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 87.0735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.15,"smiles":null,"spectrum_id":"CCMSLIB00017242985","spectrum_index":18690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 250.1746 Da; putative annotation: N/A; putative formula: C8H22N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.339,"smiles":null,"spectrum_id":"CCMSLIB00017242986","spectrum_index":18691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Fluorophenyl)azepane (delta mass: 150.073 Da; putative annotation: N/A; putative formula: C8H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.207,"smiles":null,"spectrum_id":"CCMSLIB00017242989","spectrum_index":18692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 123.0216 Da; putative annotation: N/A; putative formula: C8HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.124,"smiles":null,"spectrum_id":"CCMSLIB00017242991","spectrum_index":18693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 197.1981 Da; putative annotation: N/A; putative formula: C10H23N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.279,"smiles":null,"spectrum_id":"CCMSLIB00017242993","spectrum_index":18694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 114.1768 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.253,"smiles":null,"spectrum_id":"CCMSLIB00017242996","spectrum_index":18695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 72.0029 Da; putative annotation: N/A; putative formula: C3H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.084,"smiles":null,"spectrum_id":"CCMSLIB00017242997","spectrum_index":18696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 75.0318 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.191,"smiles":null,"spectrum_id":"CCMSLIB00017242999","spectrum_index":18697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 17.0339 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.126,"smiles":null,"spectrum_id":"CCMSLIB00017243001","spectrum_index":18698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1174.5767 Da; putative annotation: N/A; putative formula: C55H78N14O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1337.64,"smiles":null,"spectrum_id":"CCMSLIB00017243004","spectrum_index":18699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonoylglycerol (delta mass: 94.0778 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.362,"smiles":null,"spectrum_id":"CCMSLIB00017243006","spectrum_index":18700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 84.0364 Da; putative annotation: N/A; putative formula: C8H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.079,"smiles":null,"spectrum_id":"CCMSLIB00017243008","spectrum_index":18701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 10.0748 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.14,"smiles":null,"spectrum_id":"CCMSLIB00017243011","spectrum_index":18702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-((S)-1,2,3-trimethoxy-10-(((R)-4-(methylthio)-1-oxo-1-((1R,5S)-8-oxo-5,6-dihydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(2H,4H,8H)-yl)butan-2-yl)amino)-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide (delta mass: 18.0057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.306,"smiles":null,"spectrum_id":"CCMSLIB00017243013","spectrum_index":18703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-isopropylthiophenethylamine (delta mass: 16.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.169,"smiles":null,"spectrum_id":"CCMSLIB00017243015","spectrum_index":18704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zizanoic acid (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.164,"smiles":null,"spectrum_id":"CCMSLIB00017243017","spectrum_index":18705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017243020","spectrum_index":18706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZOIC ACID (delta mass: 42.0832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.122,"smiles":null,"spectrum_id":"CCMSLIB00017243021","spectrum_index":18707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 54.0467 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.268,"smiles":null,"spectrum_id":"CCMSLIB00017243024","spectrum_index":18708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 30.0826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.127,"smiles":null,"spectrum_id":"CCMSLIB00017243026","spectrum_index":18709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 85.103 Da; putative annotation: N/A; putative formula: C4H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.184,"smiles":null,"spectrum_id":"CCMSLIB00017243028","spectrum_index":18710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 242.2226 Da; putative annotation: N/A; putative formula: C11H26N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.507,"smiles":null,"spectrum_id":"CCMSLIB00017243031","spectrum_index":18711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 509.2283 Da; putative annotation: N/A; putative formula: C27H35N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.288,"smiles":null,"spectrum_id":"CCMSLIB00017243032","spectrum_index":18712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin A (delta mass: 50.0515 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.226,"smiles":null,"spectrum_id":"CCMSLIB00017243035","spectrum_index":18713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 218.131 Da; putative annotation: N/A; putative formula: C14H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.228,"smiles":null,"spectrum_id":"CCMSLIB00017243036","spectrum_index":18714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 98.0466 Da; putative annotation: N/A; putative formula: H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.122,"smiles":null,"spectrum_id":"CCMSLIB00017243039","spectrum_index":18715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 36.9965 Da; putative annotation: N/A; putative formula: C2H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.061,"smiles":null,"spectrum_id":"CCMSLIB00017243040","spectrum_index":18716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 27.0499 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.115,"smiles":null,"spectrum_id":"CCMSLIB00017243043","spectrum_index":18717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 60.0268 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.087,"smiles":null,"spectrum_id":"CCMSLIB00017243044","spectrum_index":18718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 60.0 eV (delta mass: 112.0497 Da; putative annotation: N/A; putative formula: C2H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.152,"smiles":null,"spectrum_id":"CCMSLIB00017243046","spectrum_index":18719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4a-Dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 86.0553 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.261,"smiles":null,"spectrum_id":"CCMSLIB00017243048","spectrum_index":18720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 85.0648 Da; putative annotation: N/A; putative formula: C3H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.125,"smiles":null,"spectrum_id":"CCMSLIB00017243051","spectrum_index":18721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 185.0697 Da; putative annotation: N/A; putative formula: C9H15NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.22,"smiles":null,"spectrum_id":"CCMSLIB00017243053","spectrum_index":18722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 471.3213 Da; putative annotation: N/A; putative formula: C26H41N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.621,"smiles":null,"spectrum_id":"CCMSLIB00017243055","spectrum_index":18723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 161.1035 Da; putative annotation: N/A; putative formula: C3H11N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.237,"smiles":null,"spectrum_id":"CCMSLIB00017243057","spectrum_index":18724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 58.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.138,"smiles":null,"spectrum_id":"CCMSLIB00017243058","spectrum_index":18725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 53.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.118,"smiles":null,"spectrum_id":"CCMSLIB00017243061","spectrum_index":18726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 38.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.091,"smiles":null,"spectrum_id":"CCMSLIB00017243063","spectrum_index":18727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 54.0553 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.11,"smiles":null,"spectrum_id":"CCMSLIB00017243065","spectrum_index":18728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13a-Hydroxylupanin (delta mass: 14.0198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.211,"smiles":null,"spectrum_id":"CCMSLIB00017243067","spectrum_index":18729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatinine - 40.0 eV (delta mass: 83.0007 Da; putative annotation: N/A; putative formula: C3HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.067,"smiles":null,"spectrum_id":"CCMSLIB00017243069","spectrum_index":18730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 343.2201 Da; putative annotation: N/A; putative formula: C19H29N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.275,"smiles":null,"spectrum_id":"CCMSLIB00017243072","spectrum_index":18731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 53.9694 Da; putative annotation: N/A; putative formula: CH-2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.051,"smiles":null,"spectrum_id":"CCMSLIB00017243073","spectrum_index":18732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tryptamine-C22:0 (delta mass: 45.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.489,"smiles":null,"spectrum_id":"CCMSLIB00017243076","spectrum_index":18733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 322.1207 Da; putative annotation: N/A; putative formula: C13H26N2OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.17,"smiles":null,"spectrum_id":"CCMSLIB00017243077","spectrum_index":18734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 340.1714 Da; putative annotation: N/A; putative formula: C19H32O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.315,"smiles":null,"spectrum_id":"CCMSLIB00017243080","spectrum_index":18735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Glucosamine CollisionEnergy:102040 (delta mass: 339.206 Da; putative annotation: N/A; putative formula: C19H25N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.303,"smiles":null,"spectrum_id":"CCMSLIB00017243081","spectrum_index":18736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 104.0988 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.388,"smiles":null,"spectrum_id":"CCMSLIB00017243084","spectrum_index":18737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (2Z)-2-cyano-3-(1H-indol-3-yl)prop-2-enoate (delta mass: 78.0315 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017243085","spectrum_index":18738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentadecanoic acid (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.263,"smiles":null,"spectrum_id":"CCMSLIB00017243088","spectrum_index":18739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 113.0003 Da; putative annotation: N/A; putative formula: N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017243090","spectrum_index":18740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cresotinic acid (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.076,"smiles":null,"spectrum_id":"CCMSLIB00017243092","spectrum_index":18741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.091,"smiles":null,"spectrum_id":"CCMSLIB00017243095","spectrum_index":18742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 169.0433 Da; putative annotation: N/A; putative formula: C5H7N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.125,"smiles":null,"spectrum_id":"CCMSLIB00017243096","spectrum_index":18743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:102040\"\" (delta mass: 35.037 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017243099","spectrum_index":18744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 63.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.118,"smiles":null,"spectrum_id":"CCMSLIB00017243100","spectrum_index":18745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Monoacetylmorphine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.165,"smiles":null,"spectrum_id":"CCMSLIB00017243103","spectrum_index":18746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 48.0939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.165,"smiles":null,"spectrum_id":"CCMSLIB00017243104","spectrum_index":18747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 52.068 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.274,"smiles":null,"spectrum_id":"CCMSLIB00017243107","spectrum_index":18748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 82.0785 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.284,"smiles":null,"spectrum_id":"CCMSLIB00017243108","spectrum_index":18749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP031801 2`-O-Methylguanosine|2-amino-9-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-3H-purin-6-one (delta mass: 274.1176 Da; putative annotation: N/A; putative formula: C12H14N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.232,"smiles":null,"spectrum_id":"CCMSLIB00017243111","spectrum_index":18750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 152.9979 Da; putative annotation: N/A; putative formula: C6H4NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.095,"smiles":null,"spectrum_id":"CCMSLIB00017243112","spectrum_index":18751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 80.0467 Da; putative annotation: N/A; putative formula: C3H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.227,"smiles":null,"spectrum_id":"CCMSLIB00017243115","spectrum_index":18752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 96.0576 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.295,"smiles":null,"spectrum_id":"CCMSLIB00017243117","spectrum_index":18753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)propanamide (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.16,"smiles":null,"spectrum_id":"CCMSLIB00017243119","spectrum_index":18754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phthalyl-L-tryptophan (delta mass: 9.973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.076,"smiles":null,"spectrum_id":"CCMSLIB00017243121","spectrum_index":18755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 94.0084 Da; putative annotation: N/A; putative formula: C4H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.052,"smiles":null,"spectrum_id":"CCMSLIB00017243123","spectrum_index":18756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxo-5Z,8Z,10E,14Z-eicosatetraenoic acid (delta mass: 32.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017243126","spectrum_index":18757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methylcytosine (delta mass: 58.0438 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.11,"smiles":null,"spectrum_id":"CCMSLIB00017243128","spectrum_index":18758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 328.2982 Da; putative annotation: N/A; putative formula: C20H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.364,"smiles":null,"spectrum_id":"CCMSLIB00017243130","spectrum_index":18759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 36.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.268,"smiles":null,"spectrum_id":"CCMSLIB00017243132","spectrum_index":18760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 96.0329 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.171,"smiles":null,"spectrum_id":"CCMSLIB00017243134","spectrum_index":18761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 68.0407 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.1,"smiles":null,"spectrum_id":"CCMSLIB00017243137","spectrum_index":18762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 170.1098 Da; putative annotation: N/A; putative formula: C13H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.185,"smiles":null,"spectrum_id":"CCMSLIB00017243138","spectrum_index":18763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 617.3417 Da; putative annotation: N/A; putative formula: C41H48NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.412,"smiles":null,"spectrum_id":"CCMSLIB00017243141","spectrum_index":18764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 19.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.121,"smiles":null,"spectrum_id":"CCMSLIB00017243142","spectrum_index":18765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 338.1962 Da; putative annotation: N/A; putative formula: C17H30N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.335,"smiles":null,"spectrum_id":"CCMSLIB00017243145","spectrum_index":18766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 116.0684 Da; putative annotation: N/A; putative formula: C3H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.123,"smiles":null,"spectrum_id":"CCMSLIB00017243147","spectrum_index":18767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 164.0476 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.15,"smiles":null,"spectrum_id":"CCMSLIB00017243148","spectrum_index":18768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 25.0691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.182,"smiles":null,"spectrum_id":"CCMSLIB00017243151","spectrum_index":18769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-7-methoxy-9H-pyrido[3,4-b]indol-8-yl)-2-methyl- (delta mass: 308.0871 Da; putative annotation: N/A; putative formula: C19H16O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.183,"smiles":null,"spectrum_id":"CCMSLIB00017243152","spectrum_index":18770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 20-Hydroxy-(5Z,8Z,11Z,14Z)-eicosatetraenoic acid from NIST14 (delta mass: 193.0585 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.301,"smiles":null,"spectrum_id":"CCMSLIB00017243155","spectrum_index":18771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 592.1586 Da; putative annotation: N/A; putative formula: C34H29N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":877.255,"smiles":null,"spectrum_id":"CCMSLIB00017243156","spectrum_index":18772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 80.0625 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.238,"smiles":null,"spectrum_id":"CCMSLIB00017243159","spectrum_index":18773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 106.0417 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.263,"smiles":null,"spectrum_id":"CCMSLIB00017243162","spectrum_index":18774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleanolic acid - 40.0 eV (delta mass: 146.1152 Da; putative annotation: N/A; putative formula: CH10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.483,"smiles":null,"spectrum_id":"CCMSLIB00017243163","spectrum_index":18775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperidine-1-carboximidamide (delta mass: 187.9579 Da; putative annotation: N/A; putative formula: C2N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.076,"smiles":null,"spectrum_id":"CCMSLIB00017243166","spectrum_index":18776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 40.0674 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017243167","spectrum_index":18777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 298.0684 Da; putative annotation: N/A; putative formula: C13H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.107,"smiles":null,"spectrum_id":"CCMSLIB00017243170","spectrum_index":18778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 359.2098 Da; putative annotation: N/A; putative formula: C21H29NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.29,"smiles":null,"spectrum_id":"CCMSLIB00017243171","spectrum_index":18779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 38.0517 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017243174","spectrum_index":18780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 775.2468 Da; putative annotation: N/A; putative formula: C32H45N3O17S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":997.344,"smiles":null,"spectrum_id":"CCMSLIB00017243175","spectrum_index":18781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corey PG-lactone diol (delta mass: 76.0672 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.242,"smiles":null,"spectrum_id":"CCMSLIB00017243178","spectrum_index":18782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 67.0255 Da; putative annotation: N/A; putative formula: CHN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.257,"smiles":null,"spectrum_id":"CCMSLIB00017243180","spectrum_index":18783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 66.0838 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.598,"smiles":null,"spectrum_id":"CCMSLIB00017243182","spectrum_index":18784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 86.0366 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.096,"smiles":null,"spectrum_id":"CCMSLIB00017243185","spectrum_index":18785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 467.3017 Da; putative annotation: N/A; putative formula: C22H46NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":963.641,"smiles":null,"spectrum_id":"CCMSLIB00017243186","spectrum_index":18786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1a,1b-Dihomoprostaglandin E1 (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.342,"smiles":null,"spectrum_id":"CCMSLIB00017243188","spectrum_index":18787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 123.126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.337,"smiles":null,"spectrum_id":"CCMSLIB00017243190","spectrum_index":18788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 64.9754 Da; putative annotation: N/A; putative formula: C3H-1NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.192,"smiles":null,"spectrum_id":"CCMSLIB00017243192","spectrum_index":18789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cinnamylpiperazine (delta mass: 49.0047 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.159,"smiles":null,"spectrum_id":"CCMSLIB00017243194","spectrum_index":18790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 66.0097 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.112,"smiles":null,"spectrum_id":"CCMSLIB00017243196","spectrum_index":18791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 88.025 Da; putative annotation: N/A; putative formula: C2H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.103,"smiles":null,"spectrum_id":"CCMSLIB00017243198","spectrum_index":18792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 682.3876 Da; putative annotation: N/A; putative formula: C36H54N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.474,"smiles":null,"spectrum_id":"CCMSLIB00017243200","spectrum_index":18793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 61.9999 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.086,"smiles":null,"spectrum_id":"CCMSLIB00017243202","spectrum_index":18794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Hydroxypentyl)benzene-1,3-diol (delta mass: 232.1822 Da; putative annotation: N/A; putative formula: C10H25N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.299,"smiles":null,"spectrum_id":"CCMSLIB00017243204","spectrum_index":18795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 128.0473 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.123,"smiles":null,"spectrum_id":"CCMSLIB00017243206","spectrum_index":18796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminosalicylic acid (delta mass: 70.0417 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017243209","spectrum_index":18797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 76.0259 Da; putative annotation: N/A; putative formula: CH4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.124,"smiles":null,"spectrum_id":"CCMSLIB00017243210","spectrum_index":18798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 234.1995 Da; putative annotation: N/A; putative formula: C16H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.295,"smiles":null,"spectrum_id":"CCMSLIB00017243213","spectrum_index":18799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 83.0737 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.202,"smiles":null,"spectrum_id":"CCMSLIB00017243215","spectrum_index":18800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 191.0579 Da; putative annotation: N/A; putative formula: C10H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.129,"smiles":null,"spectrum_id":"CCMSLIB00017243217","spectrum_index":18801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 252.2101 Da; putative annotation: N/A; putative formula: C2H20N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.489,"smiles":null,"spectrum_id":"CCMSLIB00017243219","spectrum_index":18802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169534-02_C14H18O9_Ethanone, 1-[4-(beta-D-glucopyranosyloxy)-2,6-dihydroxyphenyl]- (delta mass: 122.0367 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.139,"smiles":null,"spectrum_id":"CCMSLIB00017243221","spectrum_index":18803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 40.9028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.995,"smiles":null,"spectrum_id":"CCMSLIB00017243224","spectrum_index":18804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 358.2507 Da; putative annotation: N/A; putative formula: C23H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.483,"smiles":null,"spectrum_id":"CCMSLIB00017243225","spectrum_index":18805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodecanoic acid, 12-[[(cyclohexylamino)carbonyl]amino]- (delta mass: 56.0668 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.347,"smiles":null,"spectrum_id":"CCMSLIB00017243228","spectrum_index":18806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 178.1148 Da; putative annotation: N/A; putative formula: C15H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.18,"smiles":null,"spectrum_id":"CCMSLIB00017243229","spectrum_index":18807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grandiflorenic acid (delta mass: 19.0138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.23,"smiles":null,"spectrum_id":"CCMSLIB00017243232","spectrum_index":18808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 941.7174 Da; putative annotation: N/A; putative formula: C53H99NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1163.81,"smiles":null,"spectrum_id":"CCMSLIB00017243233","spectrum_index":18809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tryptamine CollisionEnergy:102040 (delta mass: 104.0621 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.169,"smiles":null,"spectrum_id":"CCMSLIB00017243236","spectrum_index":18810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 119.9796 Da; putative annotation: N/A; putative formula: C3H5OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.118,"smiles":null,"spectrum_id":"CCMSLIB00017243237","spectrum_index":18811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 78.0832 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.331,"smiles":null,"spectrum_id":"CCMSLIB00017243240","spectrum_index":18812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 165.0791 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017243243","spectrum_index":18813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(3H)-Quinazolinone, 2-(2-hydroxyphenyl)- (delta mass: 120.0503 Da; putative annotation: N/A; putative formula: C8H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.132,"smiles":null,"spectrum_id":"CCMSLIB00017243244","spectrum_index":18814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 401.6948 Da; putative annotation: N/A; putative formula: CH3O-1P13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.812,"smiles":null,"spectrum_id":"CCMSLIB00017243247","spectrum_index":18815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinanethromboxane A2 (delta mass: 130.075 Da; putative annotation: N/A; putative formula: C5H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.38,"smiles":null,"spectrum_id":"CCMSLIB00017243248","spectrum_index":18816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinic Acid (delta mass: 115.0049 Da; putative annotation: N/A; putative formula: CH2N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.076,"smiles":null,"spectrum_id":"CCMSLIB00017243251","spectrum_index":18817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 64.0307 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.268,"smiles":null,"spectrum_id":"CCMSLIB00017243252","spectrum_index":18818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 226.0593 Da; putative annotation: N/A; putative formula: C9H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.256,"smiles":null,"spectrum_id":"CCMSLIB00017243255","spectrum_index":18819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labdanolic acid (delta mass: 88.0663 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.34,"smiles":null,"spectrum_id":"CCMSLIB00017243256","spectrum_index":18820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 120.0423 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.259,"smiles":null,"spectrum_id":"CCMSLIB00017243259","spectrum_index":18821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 282.1987 Da; putative annotation: N/A; putative formula: C20H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.29,"smiles":null,"spectrum_id":"CCMSLIB00017243260","spectrum_index":18822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.154,"smiles":null,"spectrum_id":"CCMSLIB00017243263","spectrum_index":18823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 95.0733 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.186,"smiles":null,"spectrum_id":"CCMSLIB00017243265","spectrum_index":18824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 80.0479 Da; putative annotation: N/A; putative formula: C3H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.083,"smiles":null,"spectrum_id":"CCMSLIB00017243267","spectrum_index":18825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 33.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017243270","spectrum_index":18826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Allyl 3-amino-1-piperidinecarboxylate (delta mass: 46.0034 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.132,"smiles":null,"spectrum_id":"CCMSLIB00017243271","spectrum_index":18827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl morpholine-2-carboxylate (delta mass: 73.0297 Da; putative annotation: N/A; putative formula: C6H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.126,"smiles":null,"spectrum_id":"CCMSLIB00017243274","spectrum_index":18828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 65.088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.174,"smiles":null,"spectrum_id":"CCMSLIB00017243276","spectrum_index":18829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Deoxyandrographolide (delta mass: 48.0351 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.257,"smiles":null,"spectrum_id":"CCMSLIB00017243278","spectrum_index":18830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 632.9236 Da; putative annotation: N/A; putative formula: C10H16N5O17P5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.037,"smiles":null,"spectrum_id":"CCMSLIB00017243281","spectrum_index":18831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 664.8146 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.928,"smiles":null,"spectrum_id":"CCMSLIB00017243282","spectrum_index":18832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 156.0215 Da; putative annotation: N/A; putative formula: C3H4N6S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.082,"smiles":null,"spectrum_id":"CCMSLIB00017243285","spectrum_index":18833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 92.0627 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.18,"smiles":null,"spectrum_id":"CCMSLIB00017243286","spectrum_index":18834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linalool oxide (delta mass: 138.0682 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017243289","spectrum_index":18835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 85.0887 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.239,"smiles":null,"spectrum_id":"CCMSLIB00017243291","spectrum_index":18836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alphitolic acid (delta mass: 17.03 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.392,"smiles":null,"spectrum_id":"CCMSLIB00017243293","spectrum_index":18837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 264.2458 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.337,"smiles":null,"spectrum_id":"CCMSLIB00017243296","spectrum_index":18838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 353.9196 Da; putative annotation: N/A; putative formula: C11H14O-1S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017243298","spectrum_index":18839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 449.769 Da; putative annotation: N/A; putative formula: C12H2O3S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.97,"smiles":null,"spectrum_id":"CCMSLIB00017243300","spectrum_index":18840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 368.1315 Da; putative annotation: N/A; putative formula: C27H16N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.202,"smiles":null,"spectrum_id":"CCMSLIB00017243301","spectrum_index":18841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 371.4126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.473,"smiles":null,"spectrum_id":"CCMSLIB00017243304","spectrum_index":18842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 413.3502 Da; putative annotation: N/A; putative formula: C24H47NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.41,"smiles":null,"spectrum_id":"CCMSLIB00017243305","spectrum_index":18843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 898.3237 Da; putative annotation: N/A; putative formula: C70H42O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1061.38,"smiles":null,"spectrum_id":"CCMSLIB00017243308","spectrum_index":18844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 70.0271 Da; putative annotation: N/A; putative formula: CH2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.098,"smiles":null,"spectrum_id":"CCMSLIB00017243311","spectrum_index":18845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 317.0486 Da; putative annotation: N/A; putative formula: C12H16NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.14,"smiles":null,"spectrum_id":"CCMSLIB00017243312","spectrum_index":18846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 26.9461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.085,"smiles":null,"spectrum_id":"CCMSLIB00017243315","spectrum_index":18847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 899.5255 Da; putative annotation: N/A; putative formula: C47H73N5O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1080.6,"smiles":null,"spectrum_id":"CCMSLIB00017243317","spectrum_index":18848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 253.1256 Da; putative annotation: N/A; putative formula: C20H15NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.202,"smiles":null,"spectrum_id":"CCMSLIB00017243319","spectrum_index":18849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 35.9976 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.12,"smiles":null,"spectrum_id":"CCMSLIB00017243321","spectrum_index":18850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 238.2143 Da; putative annotation: N/A; putative formula: C13H26N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.321,"smiles":null,"spectrum_id":"CCMSLIB00017243323","spectrum_index":18851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 280.0362 Da; putative annotation: N/A; putative formula: C10H9N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.096,"smiles":null,"spectrum_id":"CCMSLIB00017243325","spectrum_index":18852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 54.0935 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.138,"smiles":null,"spectrum_id":"CCMSLIB00017243327","spectrum_index":18853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)propanamide (delta mass: 18.9581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.092,"smiles":null,"spectrum_id":"CCMSLIB00017243330","spectrum_index":18854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 240.1691 Da; putative annotation: N/A; putative formula: C10H20N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.212,"smiles":null,"spectrum_id":"CCMSLIB00017243332","spectrum_index":18855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 497.2863 Da; putative annotation: N/A; putative formula: C24H35N9O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.435,"smiles":null,"spectrum_id":"CCMSLIB00017243334","spectrum_index":18856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one (delta mass: 54.0467 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.263,"smiles":null,"spectrum_id":"CCMSLIB00017243337","spectrum_index":18857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 778.0327 Da; putative annotation: N/A; putative formula: C38H26N4O3S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":959.103,"smiles":null,"spectrum_id":"CCMSLIB00017243339","spectrum_index":18858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 256.1436 Da; putative annotation: N/A; putative formula: C13H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.225,"smiles":null,"spectrum_id":"CCMSLIB00017243341","spectrum_index":18859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-hydroxy-5 (6)epoxy-tetrahydrocaryophyllene (delta mass: 54.0467 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.247,"smiles":null,"spectrum_id":"CCMSLIB00017243343","spectrum_index":18860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE - 20.0 eV (delta mass: 162.0254 Da; putative annotation: N/A; putative formula: C8H6N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.127,"smiles":null,"spectrum_id":"CCMSLIB00017243346","spectrum_index":18861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyryl-carnitine; AIF; CE30; CorrDec (delta mass: 66.0467 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.201,"smiles":null,"spectrum_id":"CCMSLIB00017243348","spectrum_index":18862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 136.0367 Da; putative annotation: N/A; putative formula: C4H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017243350","spectrum_index":18863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aleuretic Acid (delta mass: 57.0214 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.254,"smiles":null,"spectrum_id":"CCMSLIB00017243353","spectrum_index":18864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-(1,2,4a,5-Tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoic acid (delta mass: 94.0788 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.306,"smiles":null,"spectrum_id":"CCMSLIB00017243354","spectrum_index":18865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 202.0938 Da; putative annotation: N/A; putative formula: C8H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.244,"smiles":null,"spectrum_id":"CCMSLIB00017243357","spectrum_index":18866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde - 40.0 eV (delta mass: 41.9403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.984,"smiles":null,"spectrum_id":"CCMSLIB00017243358","spectrum_index":18867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 60.8366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.913,"smiles":null,"spectrum_id":"CCMSLIB00017243361","spectrum_index":18868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(Hydroxymethyl)-3,8-dimethyl-2-oxooctahydro-3a,7-ethanoindene-4-carboxylic acid (delta mass: 161.0693 Da; putative annotation: N/A; putative formula: C7H15NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.228,"smiles":null,"spectrum_id":"CCMSLIB00017243362","spectrum_index":18869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 458.1541 Da; putative annotation: N/A; putative formula: C22H27N4O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.229,"smiles":null,"spectrum_id":"CCMSLIB00017243365","spectrum_index":18870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Walleminone (delta mass: 45.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.237,"smiles":null,"spectrum_id":"CCMSLIB00017243368","spectrum_index":18871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 108.0927 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.211,"smiles":null,"spectrum_id":"CCMSLIB00017243369","spectrum_index":18872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 68.0373 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.092,"smiles":null,"spectrum_id":"CCMSLIB00017243372","spectrum_index":18873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oct-7-enylpentanedioic acid (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017243374","spectrum_index":18874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 105.0426 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.093,"smiles":null,"spectrum_id":"CCMSLIB00017243376","spectrum_index":18875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethyl ester (delta mass: 48.0363 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.315,"smiles":null,"spectrum_id":"CCMSLIB00017243378","spectrum_index":18876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrosappanone A Trimethyl Ether (delta mass: 162.0528 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.207,"smiles":null,"spectrum_id":"CCMSLIB00017243380","spectrum_index":18877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 94.0766 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.46,"smiles":null,"spectrum_id":"CCMSLIB00017243383","spectrum_index":18878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19,20-Dihydroxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 96.0576 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.311,"smiles":null,"spectrum_id":"CCMSLIB00017243384","spectrum_index":18879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Dehydroperuvinine (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.144,"smiles":null,"spectrum_id":"CCMSLIB00017243387","spectrum_index":18880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-DL-SERINE - 40.0 eV (delta mass: 14.0152 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.076,"smiles":null,"spectrum_id":"CCMSLIB00017243388","spectrum_index":18881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 75.0322 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.254,"smiles":null,"spectrum_id":"CCMSLIB00017243391","spectrum_index":18882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 127.0514 Da; putative annotation: N/A; putative formula: C3H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.143,"smiles":null,"spectrum_id":"CCMSLIB00017243392","spectrum_index":18883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 9.9845 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":110.06,"smiles":null,"spectrum_id":"CCMSLIB00017243395","spectrum_index":18884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 70.0779 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.3,"smiles":null,"spectrum_id":"CCMSLIB00017243396","spectrum_index":18885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 100.0583 Da; putative annotation: N/A; putative formula: H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.28,"smiles":null,"spectrum_id":"CCMSLIB00017243399","spectrum_index":18886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 323.8056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.866,"smiles":null,"spectrum_id":"CCMSLIB00017243400","spectrum_index":18887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 63.9986 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.121,"smiles":null,"spectrum_id":"CCMSLIB00017243403","spectrum_index":18888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 313.153 Da; putative annotation: N/A; putative formula: C15H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.229,"smiles":null,"spectrum_id":"CCMSLIB00017243404","spectrum_index":18889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-(4-Hydroxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one (delta mass: 10.9909 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.092,"smiles":null,"spectrum_id":"CCMSLIB00017243407","spectrum_index":18890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 108.0942 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.305,"smiles":null,"spectrum_id":"CCMSLIB00017243409","spectrum_index":18891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 312.1106 Da; putative annotation: N/A; putative formula: C19H21PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.202,"smiles":null,"spectrum_id":"CCMSLIB00017243411","spectrum_index":18892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 74.0511 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.111,"smiles":null,"spectrum_id":"CCMSLIB00017243414","spectrum_index":18893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.,16.alpha.-diol-17-one (delta mass: 114.082 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.293,"smiles":null,"spectrum_id":"CCMSLIB00017243415","spectrum_index":18894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 78.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017243418","spectrum_index":18895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 455.2883 Da; putative annotation: N/A; putative formula: C24H41NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.348,"smiles":null,"spectrum_id":"CCMSLIB00017243419","spectrum_index":18896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-cis-Retinol (delta mass: 69.0431 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.28,"smiles":null,"spectrum_id":"CCMSLIB00017243422","spectrum_index":18897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 347.1953 Da; putative annotation: N/A; putative formula: C17H33NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.266,"smiles":null,"spectrum_id":"CCMSLIB00017243423","spectrum_index":18898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 30.0 eV (delta mass: 75.0526 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.144,"smiles":null,"spectrum_id":"CCMSLIB00017243426","spectrum_index":18899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,13.alpha.,14.beta.,17.alpha.,20S,24E)-21-Hydroxy-3-oxolanosta-8,24-dien-26-oic acid (delta mass: 114.0832 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.43,"smiles":null,"spectrum_id":"CCMSLIB00017243427","spectrum_index":18900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Di-tert-butyl-4-hydroxybenzoic acid (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.17,"smiles":null,"spectrum_id":"CCMSLIB00017243430","spectrum_index":18901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 282.2638 Da; putative annotation: N/A; putative formula: C13H30N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.579,"smiles":null,"spectrum_id":"CCMSLIB00017243431","spectrum_index":18902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 74.0518 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.289,"smiles":null,"spectrum_id":"CCMSLIB00017243434","spectrum_index":18903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-11-2-1 (delta mass: 41.0263 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.274,"smiles":null,"spectrum_id":"CCMSLIB00017243436","spectrum_index":18904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pregabalin (delta mass: 79.9565 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.09,"smiles":null,"spectrum_id":"CCMSLIB00017243438","spectrum_index":18905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 310.1249 Da; putative annotation: N/A; putative formula: C17H26O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.258,"smiles":null,"spectrum_id":"CCMSLIB00017243441","spectrum_index":18906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .DELTA.2-Androstene-1.alpha.,17.beta.-diol acetate (delta mass: 114.0835 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.326,"smiles":null,"spectrum_id":"CCMSLIB00017243442","spectrum_index":18907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2''-Galloylhyperin (delta mass: 152.0106 Da; putative annotation: Gallic acid; putative formula: C7H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.124,"smiles":null,"spectrum_id":"CCMSLIB00017243445","spectrum_index":18908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORADRENALINE (delta mass: 103.0421 Da; putative annotation: Benzamide; putative formula: C7H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.123,"smiles":null,"spectrum_id":"CCMSLIB00017243447","spectrum_index":18909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 236.1443 Da; putative annotation: 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel-; putative formula: C14H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.209,"smiles":null,"spectrum_id":"CCMSLIB00017243449","spectrum_index":18910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 280.24 Da; putative annotation: 6-Oxooctadecanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.305,"smiles":null,"spectrum_id":"CCMSLIB00017243451","spectrum_index":18911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ECDYSONE CollisionEnergy:102040 (delta mass: 446.2989 Da; putative annotation: ECDYSONE CollisionEnergy:102040; putative formula: C27H42O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.62,"smiles":null,"spectrum_id":"CCMSLIB00017243453","spectrum_index":18912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 148.0609 Da; putative annotation: N-(2-Hydroxyethyl)isonicotinamide; putative formula: C8H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.122,"smiles":null,"spectrum_id":"CCMSLIB00017243456","spectrum_index":18913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of 3,4,5-Trimethoxybenzoic acid (delta mass: 428.1942 Da; putative annotation: \"\"{4,5-dimethoxy-3-[(3,4,5-trimethoxyphenyl)carbonylamino]phenyl}-N,N-diethylcar boxamide CollisionEnergy:205060\"\"; putative formula: C23H28N2O6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.27,"smiles":null,"spectrum_id":"CCMSLIB00017243458","spectrum_index":18914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aleuretic Acid (delta mass: 94.0782 Da; putative annotation: 1,2,3,6-Tetrahydrobenzylalcohol; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.31,"smiles":null,"spectrum_id":"CCMSLIB00017243460","spectrum_index":18915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 218.1283 Da; putative annotation: 3-(2-Methyl-3-oxo-2,5,6,7,8,8a-hexahydro-1H-naphthalen-1-yl)propanoic acid; putative formula: C14H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.35,"smiles":null,"spectrum_id":"CCMSLIB00017243462","spectrum_index":18916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 90.0471 Da; putative annotation: BENZYL ALCOHOL; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.164,"smiles":null,"spectrum_id":"CCMSLIB00017243463","spectrum_index":18917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Keto-4(Z),7(Z),10(Z),13(Z),15(E),19(Z)-docosahexaenoic acid (delta mass: 345.266 Da; putative annotation: N-(2-Hydroxyethyl)-14(15)-epoxy-5Z,8Z,11Z-eicosatrienamide; putative formula: C22H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.493,"smiles":null,"spectrum_id":"CCMSLIB00017243466","spectrum_index":18918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 286.1928 Da; putative annotation: 11-Oxoandrosterone; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.263,"smiles":null,"spectrum_id":"CCMSLIB00017243467","spectrum_index":18919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 154.0034 Da; putative annotation: GLYCEROL 2-PHOSPHATE; putative formula: C3H7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.288,"smiles":null,"spectrum_id":"CCMSLIB00017243470","spectrum_index":18920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 173.1199 Da; putative annotation: Isopentedrone; putative formula: C12H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.269,"smiles":null,"spectrum_id":"CCMSLIB00017243472","spectrum_index":18921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 19.0181 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.25,"smiles":null,"spectrum_id":"CCMSLIB00017243474","spectrum_index":18922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ033506 Norfluoxetine|Norfluoxetin|3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine (delta mass: 119.0848 Da; putative annotation: N/A; putative formula: C7H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.211,"smiles":null,"spectrum_id":"CCMSLIB00017243477","spectrum_index":18923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 227.2607 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.519,"smiles":null,"spectrum_id":"CCMSLIB00017243478","spectrum_index":18924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cycloheptyl-4-piperidinamine (delta mass: 83.0618 Da; putative annotation: N/A; putative formula: C2H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.263,"smiles":null,"spectrum_id":"CCMSLIB00017243481","spectrum_index":18925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anemosapogenin (delta mass: 51.0303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.393,"smiles":null,"spectrum_id":"CCMSLIB00017243482","spectrum_index":18926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,16.Xi.)-17-Hydroxykauran-19-oic acid (delta mass: 118.078 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017243485","spectrum_index":18927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 23.9998 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017243487","spectrum_index":18928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Misoprostol (free acid) (delta mass: 90.083 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.347,"smiles":null,"spectrum_id":"CCMSLIB00017243489","spectrum_index":18929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 255.1683 Da; putative annotation: N/A; putative formula: C11H21N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.223,"smiles":null,"spectrum_id":"CCMSLIB00017243491","spectrum_index":18930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Phe (delta mass: 552.2053 Da; putative annotation: N/A; putative formula: C29H36N4OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.334,"smiles":null,"spectrum_id":"CCMSLIB00017243493","spectrum_index":18931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 8.9891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.055,"smiles":null,"spectrum_id":"CCMSLIB00017243496","spectrum_index":18932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 314.2448 Da; putative annotation: N/A; putative formula: C18H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.461,"smiles":null,"spectrum_id":"CCMSLIB00017243498","spectrum_index":18933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ergocalciferol CollisionEnergy:205060 (delta mass: 54.0315 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.378,"smiles":null,"spectrum_id":"CCMSLIB00017243500","spectrum_index":18934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 82.0412 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.106,"smiles":null,"spectrum_id":"CCMSLIB00017243502","spectrum_index":18935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hypaphorine (delta mass: 57.032 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.176,"smiles":null,"spectrum_id":"CCMSLIB00017243504","spectrum_index":18936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 313.2759 Da; putative annotation: N/A; putative formula: C16H36N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.347,"smiles":null,"spectrum_id":"CCMSLIB00017243506","spectrum_index":18937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-L-phenylalanine (delta mass: 41.0457 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.122,"smiles":null,"spectrum_id":"CCMSLIB00017243509","spectrum_index":18938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 236.1152 Da; putative annotation: N/A; putative formula: C14H21O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.207,"smiles":null,"spectrum_id":"CCMSLIB00017243511","spectrum_index":18939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 397.3922 Da; putative annotation: N/A; putative formula: C25H51NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.489,"smiles":null,"spectrum_id":"CCMSLIB00017243513","spectrum_index":18940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 122.0727 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.31,"smiles":null,"spectrum_id":"CCMSLIB00017243514","spectrum_index":18941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 40.0314 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.17,"smiles":null,"spectrum_id":"CCMSLIB00017243517","spectrum_index":18942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid (delta mass: 62.0152 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.06,"smiles":null,"spectrum_id":"CCMSLIB00017243518","spectrum_index":18943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 172.1314 Da; putative annotation: N/A; putative formula: C7H16N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.483,"smiles":null,"spectrum_id":"CCMSLIB00017243521","spectrum_index":18944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLPUTRESCINE - 20.0 eV (delta mass: 132.8755 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.993,"smiles":null,"spectrum_id":"CCMSLIB00017243523","spectrum_index":18945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRIGONELLINE (delta mass: 30.0068 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.062,"smiles":null,"spectrum_id":"CCMSLIB00017243525","spectrum_index":18946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetylhomoproline (delta mass: 89.0459 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.143,"smiles":null,"spectrum_id":"CCMSLIB00017243527","spectrum_index":18947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 362.1075 Da; putative annotation: N/A; putative formula: C12H18N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.188,"smiles":null,"spectrum_id":"CCMSLIB00017243529","spectrum_index":18948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isomyristic acid (delta mass: 36.0364 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.253,"smiles":null,"spectrum_id":"CCMSLIB00017243532","spectrum_index":18949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hautriwaic acid (delta mass: 28.0315 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.237,"smiles":null,"spectrum_id":"CCMSLIB00017243533","spectrum_index":18950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. alcohol methyl ether (delta mass: 86.0524 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.337,"smiles":null,"spectrum_id":"CCMSLIB00017243536","spectrum_index":18951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 406.1097 Da; putative annotation: N/A; putative formula: C23H15N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.17,"smiles":null,"spectrum_id":"CCMSLIB00017243538","spectrum_index":18952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxy-16-methoxyoctadeca-9,12-dienoic acid (delta mass: 162.097 Da; putative annotation: N/A; putative formula: C2H10N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.35,"smiles":null,"spectrum_id":"CCMSLIB00017243540","spectrum_index":18953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 42.0358 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.185,"smiles":null,"spectrum_id":"CCMSLIB00017243542","spectrum_index":18954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 377.2796 Da; putative annotation: N/A; putative formula: C20H35N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.543,"smiles":null,"spectrum_id":"CCMSLIB00017243545","spectrum_index":18955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12(13)-Epoxy-9Z-octadecenoic acid from NIST14 (delta mass: 77.0844 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.327,"smiles":null,"spectrum_id":"CCMSLIB00017243546","spectrum_index":18956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 13.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.107,"smiles":null,"spectrum_id":"CCMSLIB00017243549","spectrum_index":18957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 497.1877 Da; putative annotation: N/A; putative formula: C20H31N7O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.225,"smiles":null,"spectrum_id":"CCMSLIB00017243551","spectrum_index":18958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 92.0622 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.341,"smiles":null,"spectrum_id":"CCMSLIB00017243553","spectrum_index":18959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 345.2525 Da; putative annotation: N/A; putative formula: C19H39NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.339,"smiles":null,"spectrum_id":"CCMSLIB00017243556","spectrum_index":18960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11-Dideoxy-9.alpha.,11.alpha.-methanoepoxyprosta-5Z,13E-dien-1-oic acid, methyl ester (delta mass: 60.0373 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.327,"smiles":null,"spectrum_id":"CCMSLIB00017243557","spectrum_index":18961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caffeic acid (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.06,"smiles":null,"spectrum_id":"CCMSLIB00017243560","spectrum_index":18962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.4]nonane-2,4-dione (delta mass: 63.9899 Da; putative annotation: N/A; putative formula: C4HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.071,"smiles":null,"spectrum_id":"CCMSLIB00017243561","spectrum_index":18963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 32.9978 Da; putative annotation: N/A; putative formula: C3H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.039,"smiles":null,"spectrum_id":"CCMSLIB00017243564","spectrum_index":18964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine-6-glucuronide (delta mass: 237.3241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.5,"smiles":null,"spectrum_id":"CCMSLIB00017243566","spectrum_index":18965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 162.1773 Da; putative annotation: N/A; putative formula: C13H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.367,"smiles":null,"spectrum_id":"CCMSLIB00017243568","spectrum_index":18966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid (delta mass: 26.0506 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.09,"smiles":null,"spectrum_id":"CCMSLIB00017243571","spectrum_index":18967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 181594 - 30.0 eV (delta mass: 62.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.088,"smiles":null,"spectrum_id":"CCMSLIB00017243572","spectrum_index":18968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 79.5385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.61,"smiles":null,"spectrum_id":"CCMSLIB00017243575","spectrum_index":18969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 24.0005 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.071,"smiles":null,"spectrum_id":"CCMSLIB00017243576","spectrum_index":18970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 432.4316 Da; putative annotation: N/A; putative formula: C26H52N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.523,"smiles":null,"spectrum_id":"CCMSLIB00017243579","spectrum_index":18971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.102,"smiles":null,"spectrum_id":"CCMSLIB00017243580","spectrum_index":18972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 162.141 Da; putative annotation: N/A; putative formula: C12H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.368,"smiles":null,"spectrum_id":"CCMSLIB00017243583","spectrum_index":18973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-11-2-1 (delta mass: 302.1425 Da; putative annotation: N/A; putative formula: C5H14N14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.39,"smiles":null,"spectrum_id":"CCMSLIB00017243584","spectrum_index":18974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 235.1651 Da; putative annotation: N/A; putative formula: C8H21N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.35,"smiles":null,"spectrum_id":"CCMSLIB00017243587","spectrum_index":18975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylimbricatolic acid (delta mass: 88.0673 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.336,"smiles":null,"spectrum_id":"CCMSLIB00017243588","spectrum_index":18976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 134.0685 Da; putative annotation: N/A; putative formula: C4H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.201,"smiles":null,"spectrum_id":"CCMSLIB00017243591","spectrum_index":18977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2R,5R,6R,10R,13S,15S)-5-[(2R,3E,5R)-5,6-dimethylhept-3-en-2-yl]-6,10-dimethyl-16,17-dioxapentacyclo[13.2.2.0,?.0,?.0?,?]nonadec-18-en-13-ol (delta mass: 63.0696 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.406,"smiles":null,"spectrum_id":"CCMSLIB00017243594","spectrum_index":18978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 76.0627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.3,"smiles":null,"spectrum_id":"CCMSLIB00017243595","spectrum_index":18979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phytomonic acid (delta mass: 91.0627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.341,"smiles":null,"spectrum_id":"CCMSLIB00017243598","spectrum_index":18980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((5R,8S,8aS)-3,8-Dimethyl-2-oxo-1,2,4,5,6,7,8,8a-octahydroazulen-5-yl)prop-2-enoic acid (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017243599","spectrum_index":18981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 60.0422 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017243602","spectrum_index":18982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 23.9993 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.075,"smiles":null,"spectrum_id":"CCMSLIB00017243604","spectrum_index":18983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid (delta mass: 168.1873 Da; putative annotation: N/A; putative formula: C12H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.451,"smiles":null,"spectrum_id":"CCMSLIB00017243606","spectrum_index":18984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 144.1282 Da; putative annotation: N/A; putative formula: C7H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.329,"smiles":null,"spectrum_id":"CCMSLIB00017243609","spectrum_index":18985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 30.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.253,"smiles":null,"spectrum_id":"CCMSLIB00017243610","spectrum_index":18986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 368.1112 Da; putative annotation: N/A; putative formula: C20H21N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.26,"smiles":null,"spectrum_id":"CCMSLIB00017243613","spectrum_index":18987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyacetophenone (delta mass: 206.0932 Da; putative annotation: N/A; putative formula: C6H15N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.153,"smiles":null,"spectrum_id":"CCMSLIB00017243614","spectrum_index":18988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 705.2273 Da; putative annotation: N/A; putative formula: C39H31N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.268,"smiles":null,"spectrum_id":"CCMSLIB00017243617","spectrum_index":18989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-dihydroxy-4-(1-hydroxypropyl)-6-(3-methylbut-2-en-1-yl)-8-(3-methylbutanoyl)-2H-chromen-2-one (delta mass: 84.0576 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.254,"smiles":null,"spectrum_id":"CCMSLIB00017243618","spectrum_index":18990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 383.1792 Da; putative annotation: N/A; putative formula: C15H29NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.26,"smiles":null,"spectrum_id":"CCMSLIB00017243621","spectrum_index":18991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 130.0047 Da; putative annotation: N/A; putative formula: C2H3N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.065,"smiles":null,"spectrum_id":"CCMSLIB00017243623","spectrum_index":18992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexadecylmethylglycerol (delta mass: 96.9829 Da; putative annotation: N/A; putative formula: C2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.304,"smiles":null,"spectrum_id":"CCMSLIB00017243625","spectrum_index":18993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentisic acid (delta mass: 71.0578 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.092,"smiles":null,"spectrum_id":"CCMSLIB00017243627","spectrum_index":18994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 160.1472 Da; putative annotation: N/A; putative formula: C5H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.265,"smiles":null,"spectrum_id":"CCMSLIB00017243629","spectrum_index":18995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxo-taurocholenic acid or isomer  putative (delta mass: 17.0006 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.273,"smiles":null,"spectrum_id":"CCMSLIB00017243632","spectrum_index":18996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 385.1178 Da; putative annotation: N/A; putative formula: C21H15N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.188,"smiles":null,"spectrum_id":"CCMSLIB00017243633","spectrum_index":18997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 27.9984 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.1,"smiles":null,"spectrum_id":"CCMSLIB00017243636","spectrum_index":18998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 104.0661 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.1,"smiles":null,"spectrum_id":"CCMSLIB00017243637","spectrum_index":18999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 139.0865 Da; putative annotation: N/A; putative formula: C5H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.188,"smiles":null,"spectrum_id":"CCMSLIB00017243640","spectrum_index":19000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 86.047 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.3,"smiles":null,"spectrum_id":"CCMSLIB00017243642","spectrum_index":19001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Ethyl-5.alpha.-estrane-3.alpha.,17.beta.-diol (delta mass: 130.1143 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.378,"smiles":null,"spectrum_id":"CCMSLIB00017243644","spectrum_index":19002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 220.1828 Da; putative annotation: N/A; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.352,"smiles":null,"spectrum_id":"CCMSLIB00017243647","spectrum_index":19003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 64.0171 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.071,"smiles":null,"spectrum_id":"CCMSLIB00017243649","spectrum_index":19004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 53.8651 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.097,"smiles":null,"spectrum_id":"CCMSLIB00017243651","spectrum_index":19005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 162.0519 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.19,"smiles":null,"spectrum_id":"CCMSLIB00017243653","spectrum_index":19006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 146.574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.645,"smiles":null,"spectrum_id":"CCMSLIB00017243655","spectrum_index":19007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asiatic acid CollisionEnergy:102040 (delta mass: 27.0479 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.405,"smiles":null,"spectrum_id":"CCMSLIB00017243658","spectrum_index":19008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 236.0882 Da; putative annotation: N/A; putative formula: C6H8N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.278,"smiles":null,"spectrum_id":"CCMSLIB00017243659","spectrum_index":19009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 97.9686 Da; putative annotation: N/A; putative formula: CH-2N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.174,"smiles":null,"spectrum_id":"CCMSLIB00017243662","spectrum_index":19010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 413.0499 Da; putative annotation: N/A; putative formula: C10H17N5O9P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.11,"smiles":null,"spectrum_id":"CCMSLIB00017243663","spectrum_index":19011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 105.1145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.195,"smiles":null,"spectrum_id":"CCMSLIB00017243666","spectrum_index":19012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 196.1662 Da; putative annotation: N/A; putative formula: C13H24O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.398,"smiles":null,"spectrum_id":"CCMSLIB00017243668","spectrum_index":19013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 632.3972 Da; putative annotation: N/A; putative formula: C34H56N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.468,"smiles":null,"spectrum_id":"CCMSLIB00017243670","spectrum_index":19014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 42.8905 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":114.971,"smiles":null,"spectrum_id":"CCMSLIB00017243673","spectrum_index":19015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 211.0781 Da; putative annotation: N/A; putative formula: C9H13N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.138,"smiles":null,"spectrum_id":"CCMSLIB00017243674","spectrum_index":19016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 70.0441 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.135,"smiles":null,"spectrum_id":"CCMSLIB00017243677","spectrum_index":19017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 480.3296 Da; putative annotation: N/A; putative formula: C22H36N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.447,"smiles":null,"spectrum_id":"CCMSLIB00017243678","spectrum_index":19018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 221.0503 Da; putative annotation: N/A; putative formula: C13H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.115,"smiles":null,"spectrum_id":"CCMSLIB00017243681","spectrum_index":19019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYANTHRANILATE - 20.0 eV (delta mass: 41.9435 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.993,"smiles":null,"spectrum_id":"CCMSLIB00017243682","spectrum_index":19020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-17-hydroxy-7,13Z-labdadien-15-oic acid (delta mass: 74.052 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.3,"smiles":null,"spectrum_id":"CCMSLIB00017243685","spectrum_index":19021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 106.0785 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017243686","spectrum_index":19022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-hydroxy-11-(hydroxymethyl)-1,5,11-trimethyltricyclo[6.2.1.0,?]undec-2-en-9-one (delta mass: 38.0158 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017243689","spectrum_index":19023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 43.0062 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.087,"smiles":null,"spectrum_id":"CCMSLIB00017243690","spectrum_index":19024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .gamma.-L-Glutamyl-L-alanine (delta mass: 57.0213 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.119,"smiles":null,"spectrum_id":"CCMSLIB00017243693","spectrum_index":19025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 309.1218 Da; putative annotation: N/A; putative formula: C8H19N7O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.193,"smiles":null,"spectrum_id":"CCMSLIB00017243694","spectrum_index":19026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-AMINOLEVULINIC ACID (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.087,"smiles":null,"spectrum_id":"CCMSLIB00017243697","spectrum_index":19027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sericic acid (delta mass: 74.0517 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.404,"smiles":null,"spectrum_id":"CCMSLIB00017243698","spectrum_index":19028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 280.0406 Da; putative annotation: N/A; putative formula: C13H12O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.236,"smiles":null,"spectrum_id":"CCMSLIB00017243701","spectrum_index":19029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 115.0419 Da; putative annotation: N/A; putative formula: C8H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.118,"smiles":null,"spectrum_id":"CCMSLIB00017243702","spectrum_index":19030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine (delta mass: 141.7261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.99,"smiles":null,"spectrum_id":"CCMSLIB00017243705","spectrum_index":19031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 373.159 Da; putative annotation: N/A; putative formula: C16H28N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.375,"smiles":null,"spectrum_id":"CCMSLIB00017243706","spectrum_index":19032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,9.beta.,10.alpha.)-3-Hydroxypregna-5,7-dien-20-one (delta mass: 247.0905 Da; putative annotation: N/A; putative formula: C9H18N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.322,"smiles":null,"spectrum_id":"CCMSLIB00017243709","spectrum_index":19033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 62.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.138,"smiles":null,"spectrum_id":"CCMSLIB00017243710","spectrum_index":19034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-8,11,14-Eicosatrienoic acid from NIST14 (delta mass: 35.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.299,"smiles":null,"spectrum_id":"CCMSLIB00017243713","spectrum_index":19035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 119.0947 Da; putative annotation: N/A; putative formula: CH9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.132,"smiles":null,"spectrum_id":"CCMSLIB00017243715","spectrum_index":19036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 46.924 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017243717","spectrum_index":19037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 280.2391 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.32,"smiles":null,"spectrum_id":"CCMSLIB00017243720","spectrum_index":19038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)(3-fluorophenyl)amine (delta mass: 130.0704 Da; putative annotation: N/A; putative formula: C4H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.2,"smiles":null,"spectrum_id":"CCMSLIB00017243721","spectrum_index":19039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026602 5?-CHOLANIC ACID-3?-OL-7_12-DIONE|3-Hydroxy-7,12-diketocholanoic acid|(4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydro-1H-cyclopenta[a (delta mass: 53.0483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.312,"smiles":null,"spectrum_id":"CCMSLIB00017243724","spectrum_index":19040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 163.0841 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017243725","spectrum_index":19041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 156.0083 Da; putative annotation: N/A; putative formula: C5H5N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.068,"smiles":null,"spectrum_id":"CCMSLIB00017243728","spectrum_index":19042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 124.0518 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.3,"smiles":null,"spectrum_id":"CCMSLIB00017243729","spectrum_index":19043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 238.1604 Da; putative annotation: N/A; putative formula: C13H23N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.22,"smiles":null,"spectrum_id":"CCMSLIB00017243732","spectrum_index":19044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 55.027 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.207,"smiles":null,"spectrum_id":"CCMSLIB00017243733","spectrum_index":19045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 415.168 Da; putative annotation: N/A; putative formula: C20H25N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.4,"smiles":null,"spectrum_id":"CCMSLIB00017243736","spectrum_index":19046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 382.2207 Da; putative annotation: N/A; putative formula: C20H35N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.369,"smiles":null,"spectrum_id":"CCMSLIB00017243737","spectrum_index":19047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 415.1682 Da; putative annotation: N/A; putative formula: C28H21N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.4,"smiles":null,"spectrum_id":"CCMSLIB00017243740","spectrum_index":19048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenol (delta mass: 214.0624 Da; putative annotation: N/A; putative formula: C7H11N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.133,"smiles":null,"spectrum_id":"CCMSLIB00017243743","spectrum_index":19049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 12.995 Da; putative annotation: N/A; putative formula: C22H32N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.097,"smiles":null,"spectrum_id":"CCMSLIB00017243744","spectrum_index":19050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 8.0481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.103,"smiles":null,"spectrum_id":"CCMSLIB00017243747","spectrum_index":19051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 57.1187 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.185,"smiles":null,"spectrum_id":"CCMSLIB00017243748","spectrum_index":19052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 30.0121 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.083,"smiles":null,"spectrum_id":"CCMSLIB00017243751","spectrum_index":19053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-(1-Aminoethyl)-4-hydroxybenzyl alcohol (delta mass: 6.9841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.086,"smiles":null,"spectrum_id":"CCMSLIB00017243752","spectrum_index":19054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-7-carboxaldehyde (delta mass: 11.9995 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.059,"smiles":null,"spectrum_id":"CCMSLIB00017243755","spectrum_index":19055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 40.0329 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.083,"smiles":null,"spectrum_id":"CCMSLIB00017243756","spectrum_index":19056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 19.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.158,"smiles":null,"spectrum_id":"CCMSLIB00017243759","spectrum_index":19057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 114.0675 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017243760","spectrum_index":19058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 136.0367 Da; putative annotation: N/A; putative formula: C4H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.316,"smiles":null,"spectrum_id":"CCMSLIB00017243763","spectrum_index":19059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 381.2381 Da; putative annotation: N/A; putative formula: C19H35N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.314,"smiles":null,"spectrum_id":"CCMSLIB00017243765","spectrum_index":19060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 106.0243 Da; putative annotation: N/A; putative formula: C7H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.1,"smiles":null,"spectrum_id":"CCMSLIB00017243767","spectrum_index":19061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxycoumarin (delta mass: 295.1269 Da; putative annotation: N/A; putative formula: C11H21NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.166,"smiles":null,"spectrum_id":"CCMSLIB00017243769","spectrum_index":19062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lanosterol (delta mass: 227.185 Da; putative annotation: N/A; putative formula: C9H21N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.578,"smiles":null,"spectrum_id":"CCMSLIB00017243771","spectrum_index":19063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 165.0431 Da; putative annotation: N/A; putative formula: C8H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.119,"smiles":null,"spectrum_id":"CCMSLIB00017243773","spectrum_index":19064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 505.2141 Da; putative annotation: N/A; putative formula: C19H35N7O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":807.353,"smiles":null,"spectrum_id":"CCMSLIB00017243775","spectrum_index":19065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-3-oleoyl-sn-glycero-2-phosphoethanolamine (delta mass: 56.0724 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.61,"smiles":null,"spectrum_id":"CCMSLIB00017243778","spectrum_index":19066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-naphthol (delta mass: 125.0842 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.16,"smiles":null,"spectrum_id":"CCMSLIB00017243779","spectrum_index":19067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 86.0555 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.34,"smiles":null,"spectrum_id":"CCMSLIB00017243782","spectrum_index":19068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 43.0422 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.139,"smiles":null,"spectrum_id":"CCMSLIB00017243784","spectrum_index":19069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Diazaspiro[5.5]undecane-1,7-dione (delta mass: 100.0161 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.129,"smiles":null,"spectrum_id":"CCMSLIB00017243786","spectrum_index":19070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-7-methoxycoumarin (delta mass: 124.0516 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.101,"smiles":null,"spectrum_id":"CCMSLIB00017243789","spectrum_index":19071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,8,11-Eicosatriynoic acid (delta mass: 17.973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.189,"smiles":null,"spectrum_id":"CCMSLIB00017243791","spectrum_index":19072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 444.2382 Da; putative annotation: N/A; putative formula: C24H36N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.303,"smiles":null,"spectrum_id":"CCMSLIB00017243793","spectrum_index":19073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 406.2959 Da; putative annotation: N/A; putative formula: C23H34N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.387,"smiles":null,"spectrum_id":"CCMSLIB00017243795","spectrum_index":19074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 41.043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.108,"smiles":null,"spectrum_id":"CCMSLIB00017243798","spectrum_index":19075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,12-Dehydroursolic acid lactone (delta mass: 344.0975 Da; putative annotation: N/A; putative formula: C12H26O5P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.45,"smiles":null,"spectrum_id":"CCMSLIB00017243800","spectrum_index":19076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Dodecyloxypropanoic acid (delta mass: 80.0617 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.289,"smiles":null,"spectrum_id":"CCMSLIB00017243802","spectrum_index":19077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin D (delta mass: 108.021 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.206,"smiles":null,"spectrum_id":"CCMSLIB00017243805","spectrum_index":19078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 268.0738 Da; putative annotation: N/A; putative formula: C9H20N2OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.134,"smiles":null,"spectrum_id":"CCMSLIB00017243806","spectrum_index":19079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 342.2099 Da; putative annotation: N/A; putative formula: C24H26N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.306,"smiles":null,"spectrum_id":"CCMSLIB00017243809","spectrum_index":19080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 96.9844 Da; putative annotation: N/A; putative formula: CH-1N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.055,"smiles":null,"spectrum_id":"CCMSLIB00017243810","spectrum_index":19081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoleoyl-sn-glycero-3-phosphoethanolamine (delta mass: 86.052 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.543,"smiles":null,"spectrum_id":"CCMSLIB00017243813","spectrum_index":19082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 112.0874 Da; putative annotation: N/A; putative formula: C3H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.189,"smiles":null,"spectrum_id":"CCMSLIB00017243814","spectrum_index":19083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4'-Bipiperidin-3-ol (delta mass: 149.0682 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.233,"smiles":null,"spectrum_id":"CCMSLIB00017243817","spectrum_index":19084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,11Z,14Z-Eicosatrienoic acid (delta mass: 120.0947 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.358,"smiles":null,"spectrum_id":"CCMSLIB00017243820","spectrum_index":19085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatol (delta mass: 203.1227 Da; putative annotation: N/A; putative formula: C13H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.204,"smiles":null,"spectrum_id":"CCMSLIB00017243821","spectrum_index":19086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 92.0108 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017243824","spectrum_index":19087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,2'-Dihydroxy-3-methoxychalcone (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.107,"smiles":null,"spectrum_id":"CCMSLIB00017243825","spectrum_index":19088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 214.0034 Da; putative annotation: N/A; putative formula: C8H7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.131,"smiles":null,"spectrum_id":"CCMSLIB00017243828","spectrum_index":19089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 103.0628 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.239,"smiles":null,"spectrum_id":"CCMSLIB00017243829","spectrum_index":19090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Benzoylamino)benzoic acid (delta mass: 94.0414 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.123,"smiles":null,"spectrum_id":"CCMSLIB00017243832","spectrum_index":19091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.04,"smiles":null,"spectrum_id":"CCMSLIB00017243834","spectrum_index":19092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 114.0865 Da; putative annotation: N/A; putative formula: C7H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.331,"smiles":null,"spectrum_id":"CCMSLIB00017243836","spectrum_index":19093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 206.1267 Da; putative annotation: N/A; putative formula: C8H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.265,"smiles":null,"spectrum_id":"CCMSLIB00017243839","spectrum_index":19094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 134.0371 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.076,"smiles":null,"spectrum_id":"CCMSLIB00017243840","spectrum_index":19095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 169.0276 Da; putative annotation: N/A; putative formula: C9H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.065,"smiles":null,"spectrum_id":"CCMSLIB00017243843","spectrum_index":19096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 452.3362 Da; putative annotation: N/A; putative formula: C24H44N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.427,"smiles":null,"spectrum_id":"CCMSLIB00017243845","spectrum_index":19097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE-3-ACETIC ACID (delta mass: 40.0351 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.101,"smiles":null,"spectrum_id":"CCMSLIB00017243847","spectrum_index":19098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017243850","spectrum_index":19099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 503.3466 Da; putative annotation: N/A; putative formula: C27H45N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.417,"smiles":null,"spectrum_id":"CCMSLIB00017243851","spectrum_index":19100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 969.4942 Da; putative annotation: N/A; putative formula: C54H67N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1132.55,"smiles":null,"spectrum_id":"CCMSLIB00017243854","spectrum_index":19101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 17.9904 Da; putative annotation: N/A; putative formula: C3H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.088,"smiles":null,"spectrum_id":"CCMSLIB00017243855","spectrum_index":19102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,7,10,13,16,19-Docosahexaenoic acid (delta mass: 193.0954 Da; putative annotation: N/A; putative formula: C7H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.343,"smiles":null,"spectrum_id":"CCMSLIB00017243858","spectrum_index":19103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":116.107,"smiles":null,"spectrum_id":"CCMSLIB00017243860","spectrum_index":19104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Azaspiro[4.5]decane-1,3-dione (delta mass: 231.2229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.325,"smiles":null,"spectrum_id":"CCMSLIB00017243862","spectrum_index":19105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 168.0944 Da; putative annotation: N/A; putative formula: C13H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.322,"smiles":null,"spectrum_id":"CCMSLIB00017243865","spectrum_index":19106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 60.0366 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017243866","spectrum_index":19107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ent-15-Hydroxy-8(17)-labden-2-one (delta mass: 80.0622 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.325,"smiles":null,"spectrum_id":"CCMSLIB00017243869","spectrum_index":19108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 108.0576 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.16,"smiles":null,"spectrum_id":"CCMSLIB00017243870","spectrum_index":19109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fucosterol (delta mass: 155.0191 Da; putative annotation: N/A; putative formula: C2HN7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.397,"smiles":null,"spectrum_id":"CCMSLIB00017243873","spectrum_index":19110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 100.0702 Da; putative annotation: N/A; putative formula: C6H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.315,"smiles":null,"spectrum_id":"CCMSLIB00017243874","spectrum_index":19111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.211,"smiles":null,"spectrum_id":"CCMSLIB00017243877","spectrum_index":19112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 494.1773 Da; putative annotation: N/A; putative formula: C29H34OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.269,"smiles":null,"spectrum_id":"CCMSLIB00017243879","spectrum_index":19113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:102040 (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.269,"smiles":null,"spectrum_id":"CCMSLIB00017243881","spectrum_index":19114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentalenic acid (delta mass: 56.0265 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.191,"smiles":null,"spectrum_id":"CCMSLIB00017243883","spectrum_index":19115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 252.1361 Da; putative annotation: N/A; putative formula: C14H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.211,"smiles":null,"spectrum_id":"CCMSLIB00017243886","spectrum_index":19116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 125.0293 Da; putative annotation: N/A; putative formula: C6H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.116,"smiles":null,"spectrum_id":"CCMSLIB00017243888","spectrum_index":19117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 107.0947 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.264,"smiles":null,"spectrum_id":"CCMSLIB00017243890","spectrum_index":19118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 447.1535 Da; putative annotation: N/A; putative formula: C14H31N3O9P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.214,"smiles":null,"spectrum_id":"CCMSLIB00017243892","spectrum_index":19119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10-2 (delta mass: 120.0941 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.342,"smiles":null,"spectrum_id":"CCMSLIB00017243894","spectrum_index":19120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-1-ene-3.beta.,17.beta.-diol (delta mass: 142.0992 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.331,"smiles":null,"spectrum_id":"CCMSLIB00017243896","spectrum_index":19121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid CollisionEnergy:205060 (delta mass: 313.0799 Da; putative annotation: N/A; putative formula: C13H15NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.109,"smiles":null,"spectrum_id":"CCMSLIB00017243899","spectrum_index":19122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-n-benzoyl-2-hydroxy-2-phenylethylamine (delta mass: 612.3824 Da; putative annotation: N/A; putative formula: C32H56N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.5,"smiles":null,"spectrum_id":"CCMSLIB00017243901","spectrum_index":19123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 55.0456 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.085,"smiles":null,"spectrum_id":"CCMSLIB00017243903","spectrum_index":19124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Deoxy-9-methyleneprostaglandin E2 (delta mass: 489.2195 Da; putative annotation: N/A; putative formula: C27H39NOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.472,"smiles":null,"spectrum_id":"CCMSLIB00017243905","spectrum_index":19125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 172.085 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.176,"smiles":null,"spectrum_id":"CCMSLIB00017243907","spectrum_index":19126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 60.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.132,"smiles":null,"spectrum_id":"CCMSLIB00017243910","spectrum_index":19127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 62.0007 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.108,"smiles":null,"spectrum_id":"CCMSLIB00017243911","spectrum_index":19128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 141.0791 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017243914","spectrum_index":19129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 97.053 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.177,"smiles":null,"spectrum_id":"CCMSLIB00017243916","spectrum_index":19130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.4]nonane-2,4-dione (delta mass: 77.9785 Da; putative annotation: N/A; putative formula: CH4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.06,"smiles":null,"spectrum_id":"CCMSLIB00017243918","spectrum_index":19131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 611.3388 Da; putative annotation: N/A; putative formula: C26H45N9O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.436,"smiles":null,"spectrum_id":"CCMSLIB00017243921","spectrum_index":19132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 118.063 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.14,"smiles":null,"spectrum_id":"CCMSLIB00017243922","spectrum_index":19133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU100205 2,2'-(Tetradecylimino)diethanol|Tetradecyldiethanolamine (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.368,"smiles":null,"spectrum_id":"CCMSLIB00017243925","spectrum_index":19134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 728.2495 Da; putative annotation: N/A; putative formula: C42H32N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1233.43,"smiles":null,"spectrum_id":"CCMSLIB00017243928","spectrum_index":19135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4H-Pyrrolo[3,2-c]pyridin-4-one, 1,5,6,7-tetrahydro-2-[2-(3-quinolinyl)-4-pyridinyl]- (delta mass: 318.1381 Da; putative annotation: N/A; putative formula: C18H23O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.278,"smiles":null,"spectrum_id":"CCMSLIB00017243929","spectrum_index":19136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 17.0994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.347,"smiles":null,"spectrum_id":"CCMSLIB00017243932","spectrum_index":19137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 206.1091 Da; putative annotation: N/A; putative formula: C8H18N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.169,"smiles":null,"spectrum_id":"CCMSLIB00017243934","spectrum_index":19138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 28.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.149,"smiles":null,"spectrum_id":"CCMSLIB00017243936","spectrum_index":19139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 359.1431 Da; putative annotation: N/A; putative formula: C15H26N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.245,"smiles":null,"spectrum_id":"CCMSLIB00017243939","spectrum_index":19140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4H-Pyrrolo[3,2-c]pyridin-4-one, 1,5,6,7-tetrahydro-2-[2-(3-quinolinyl)-4-pyridinyl]- (delta mass: 41.0269 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.167,"smiles":null,"spectrum_id":"CCMSLIB00017243940","spectrum_index":19141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 46.0769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.137,"smiles":null,"spectrum_id":"CCMSLIB00017243943","spectrum_index":19142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 174.0677 Da; putative annotation: N/A; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.164,"smiles":null,"spectrum_id":"CCMSLIB00017243944","spectrum_index":19143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butanoic acid (delta mass: 62.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.096,"smiles":null,"spectrum_id":"CCMSLIB00017243947","spectrum_index":19144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 420.211 Da; putative annotation: N/A; putative formula: C18H32N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.282,"smiles":null,"spectrum_id":"CCMSLIB00017243948","spectrum_index":19145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 196.1255 Da; putative annotation: N/A; putative formula: C15H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017243951","spectrum_index":19146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 17.9374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.19,"smiles":null,"spectrum_id":"CCMSLIB00017243952","spectrum_index":19147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 327.256 Da; putative annotation: N/A; putative formula: C22H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.54,"smiles":null,"spectrum_id":"CCMSLIB00017243955","spectrum_index":19148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to p-Acetaminobenzoic acid from NIST14 (delta mass: 137.058 Da; putative annotation: N/A; putative formula: C6H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.124,"smiles":null,"spectrum_id":"CCMSLIB00017243956","spectrum_index":19149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 130.0621 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.148,"smiles":null,"spectrum_id":"CCMSLIB00017243959","spectrum_index":19150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 66.0466 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.331,"smiles":null,"spectrum_id":"CCMSLIB00017243961","spectrum_index":19151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-Binaphthyl-8,8'-dicarboxylic acid (delta mass: 46.0094 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.106,"smiles":null,"spectrum_id":"CCMSLIB00017243963","spectrum_index":19152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-Hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1,5-diol (delta mass: 184.164 Da; putative annotation: N/A; putative formula: C12H24O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.375,"smiles":null,"spectrum_id":"CCMSLIB00017243966","spectrum_index":19153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 172.0556 Da; putative annotation: N/A; putative formula: C10H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.136,"smiles":null,"spectrum_id":"CCMSLIB00017243967","spectrum_index":19154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyethoxy)phenol (delta mass: 77.0266 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.097,"smiles":null,"spectrum_id":"CCMSLIB00017243969","spectrum_index":19155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 356.1582 Da; putative annotation: N/A; putative formula: C16H24N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.218,"smiles":null,"spectrum_id":"CCMSLIB00017243971","spectrum_index":19156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Benzyloxy)(methyl)amine (delta mass: 76.0313 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.123,"smiles":null,"spectrum_id":"CCMSLIB00017243974","spectrum_index":19157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxyphenylacetic acid (delta mass: 108.02 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.069,"smiles":null,"spectrum_id":"CCMSLIB00017243976","spectrum_index":19158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z, 7E, 11Z)-15-hydroxycembra-3,7,11-trien-19-oic acid (delta mass: 76.0671 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017243978","spectrum_index":19159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 38.4454 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017243981","spectrum_index":19160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Everninic Acid (delta mass: 90.0468 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.112,"smiles":null,"spectrum_id":"CCMSLIB00017243982","spectrum_index":19161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 12.0002 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.102,"smiles":null,"spectrum_id":"CCMSLIB00017243985","spectrum_index":19162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 170.0215 Da; putative annotation: N/A; putative formula: C7H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017243986","spectrum_index":19163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 124.9788 Da; putative annotation: N/A; putative formula: CH3NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.081,"smiles":null,"spectrum_id":"CCMSLIB00017243989","spectrum_index":19164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 54.0106 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.076,"smiles":null,"spectrum_id":"CCMSLIB00017243990","spectrum_index":19165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 81.0579 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.102,"smiles":null,"spectrum_id":"CCMSLIB00017243993","spectrum_index":19166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 70.0062 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.104,"smiles":null,"spectrum_id":"CCMSLIB00017243995","spectrum_index":19167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-5,8,11,14-Eicosatetraenoic acid from NIST14 (delta mass: 89.0838 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.331,"smiles":null,"spectrum_id":"CCMSLIB00017243997","spectrum_index":19168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 46.0535 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.124,"smiles":null,"spectrum_id":"CCMSLIB00017244000","spectrum_index":19169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydro-15-deoxy-.DELTA.12,14-prostaglandin J2 (delta mass: 74.0369 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.264,"smiles":null,"spectrum_id":"CCMSLIB00017244001","spectrum_index":19170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 367.3084 Da; putative annotation: N/A; putative formula: C22H41NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.395,"smiles":null,"spectrum_id":"CCMSLIB00017244004","spectrum_index":19171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 345.251 Da; putative annotation: N/A; putative formula: C18H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.311,"smiles":null,"spectrum_id":"CCMSLIB00017244005","spectrum_index":19172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 118.0774 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017244008","spectrum_index":19173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cedrol (delta mass: 78.0309 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.237,"smiles":null,"spectrum_id":"CCMSLIB00017244009","spectrum_index":19174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 418.2179 Da; putative annotation: N/A; putative formula: C24H34O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.368,"smiles":null,"spectrum_id":"CCMSLIB00017244012","spectrum_index":19175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 373.2763 Da; putative annotation: N/A; putative formula: C19H39N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.561,"smiles":null,"spectrum_id":"CCMSLIB00017244014","spectrum_index":19176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 18.1069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.246,"smiles":null,"spectrum_id":"CCMSLIB00017244016","spectrum_index":19177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carabrol (delta mass: 64.0311 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.195,"smiles":null,"spectrum_id":"CCMSLIB00017244018","spectrum_index":19178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 104.0625 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.175,"smiles":null,"spectrum_id":"CCMSLIB00017244020","spectrum_index":19179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 722.4611 Da; putative annotation: N/A; putative formula: C51H63OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":903.532,"smiles":null,"spectrum_id":"CCMSLIB00017244022","spectrum_index":19180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 16.9427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.222,"smiles":null,"spectrum_id":"CCMSLIB00017244024","spectrum_index":19181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 130.0786 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017244027","spectrum_index":19182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(R)-4-((3R,4R,5S,8S,9S,10R,13R,14S,17R)-3,4-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid\"\" (delta mass: 356.2798 Da; putative annotation: N/A; putative formula: C19H32N8O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.58,"smiles":null,"spectrum_id":"CCMSLIB00017244028","spectrum_index":19183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 521.1758 Da; putative annotation: N/A; putative formula: C22H27N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.236,"smiles":null,"spectrum_id":"CCMSLIB00017244031","spectrum_index":19184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid from NIST14 (delta mass: 40.0318 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.259,"smiles":null,"spectrum_id":"CCMSLIB00017244033","spectrum_index":19185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 102.0681 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.17,"smiles":null,"spectrum_id":"CCMSLIB00017244035","spectrum_index":19186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chorismic acid (delta mass: 120.0213 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.076,"smiles":null,"spectrum_id":"CCMSLIB00017244038","spectrum_index":19187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 92.0654 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.423,"smiles":null,"spectrum_id":"CCMSLIB00017244039","spectrum_index":19188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 106.0052 Da; putative annotation: N/A; putative formula: C6H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017244042","spectrum_index":19189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 580.482 Da; putative annotation: N/A; putative formula: C35H68N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.553,"smiles":null,"spectrum_id":"CCMSLIB00017244043","spectrum_index":19190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 354.1681 Da; putative annotation: N/A; putative formula: C21H27N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.317,"smiles":null,"spectrum_id":"CCMSLIB00017244046","spectrum_index":19191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-2-methylbutyric acid (delta mass: 23.016 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.086,"smiles":null,"spectrum_id":"CCMSLIB00017244047","spectrum_index":19192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxo-1,2-dihydro-quinoline-3,4-dicarboxylic acid (delta mass: 42.0135 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.053,"smiles":null,"spectrum_id":"CCMSLIB00017244050","spectrum_index":19193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Ile (delta mass: 216.075 Da; putative annotation: N/A; putative formula: C10H19O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.256,"smiles":null,"spectrum_id":"CCMSLIB00017244051","spectrum_index":19194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one (delta mass: 15.9948 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017244054","spectrum_index":19195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.,16.alpha.-diol-17-one (delta mass: 62.0523 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.263,"smiles":null,"spectrum_id":"CCMSLIB00017244055","spectrum_index":19196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde (delta mass: 35.9767 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.021,"smiles":null,"spectrum_id":"CCMSLIB00017244058","spectrum_index":19197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 42.9116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.976,"smiles":null,"spectrum_id":"CCMSLIB00017244060","spectrum_index":19198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 35.0379 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.166,"smiles":null,"spectrum_id":"CCMSLIB00017244062","spectrum_index":19199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 215.1008 Da; putative annotation: N/A; putative formula: C9H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.291,"smiles":null,"spectrum_id":"CCMSLIB00017244065","spectrum_index":19200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 71.0367 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.171,"smiles":null,"spectrum_id":"CCMSLIB00017244067","spectrum_index":19201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9S,11R,15S-Trihydroxy-20a,20b-dihomo-5Z,13E-prostadienoic acid (delta mass: 78.0472 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.326,"smiles":null,"spectrum_id":"CCMSLIB00017244069","spectrum_index":19202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Esculin (delta mass: 128.0841 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.171,"smiles":null,"spectrum_id":"CCMSLIB00017244072","spectrum_index":19203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 93.9821 Da; putative annotation: N/A; putative formula: CH3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.021,"smiles":null,"spectrum_id":"CCMSLIB00017244073","spectrum_index":19204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(14,15-Epoxyeicosatrienoyl)glycerol (delta mass: 74.0519 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.331,"smiles":null,"spectrum_id":"CCMSLIB00017244076","spectrum_index":19205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 85.0732 Da; putative annotation: N/A; putative formula: C2H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.19,"smiles":null,"spectrum_id":"CCMSLIB00017244078","spectrum_index":19206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 488.2776 Da; putative annotation: N/A; putative formula: C23H37N8O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.422,"smiles":null,"spectrum_id":"CCMSLIB00017244080","spectrum_index":19207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 46.0038 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.062,"smiles":null,"spectrum_id":"CCMSLIB00017244082","spectrum_index":19208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 142.1005 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.239,"smiles":null,"spectrum_id":"CCMSLIB00017244085","spectrum_index":19209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 190.1725 Da; putative annotation: N/A; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.357,"smiles":null,"spectrum_id":"CCMSLIB00017244087","spectrum_index":19210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asperlactone (delta mass: 63.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.149,"smiles":null,"spectrum_id":"CCMSLIB00017244089","spectrum_index":19211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LysoPC(0:0/18:0) (delta mass: 4.003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.374,"smiles":null,"spectrum_id":"CCMSLIB00017244091","spectrum_index":19212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 28.0505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017244094","spectrum_index":19213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenol (delta mass: 26.0521 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.122,"smiles":null,"spectrum_id":"CCMSLIB00017244096","spectrum_index":19214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 344.053 Da; putative annotation: N/A; putative formula: C17H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.118,"smiles":null,"spectrum_id":"CCMSLIB00017244098","spectrum_index":19215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 326.2449 Da; putative annotation: N/A; putative formula: C19H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.316,"smiles":null,"spectrum_id":"CCMSLIB00017244100","spectrum_index":19216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrosappanone A Trimethyl Ether (delta mass: 47.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.19,"smiles":null,"spectrum_id":"CCMSLIB00017244103","spectrum_index":19217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monoelaidin from NIST14 (delta mass: 367.3101 Da; putative annotation: N/A; putative formula: C23H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.61,"smiles":null,"spectrum_id":"CCMSLIB00017244105","spectrum_index":19218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-methylolivetolcarboxylic acid (delta mass: 50.3722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.5,"smiles":null,"spectrum_id":"CCMSLIB00017244107","spectrum_index":19219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-trans-Myrtanol (delta mass: 70.0071 Da; putative annotation: N/A; putative formula: C2H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.15,"smiles":null,"spectrum_id":"CCMSLIB00017244110","spectrum_index":19220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 437.1921 Da; putative annotation: N/A; putative formula: C20H31N5O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.341,"smiles":null,"spectrum_id":"CCMSLIB00017244111","spectrum_index":19221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 188.1204 Da; putative annotation: N/A; putative formula: C13H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.244,"smiles":null,"spectrum_id":"CCMSLIB00017244114","spectrum_index":19222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 164.0477 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.176,"smiles":null,"spectrum_id":"CCMSLIB00017244115","spectrum_index":19223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Lys (delta mass: 99.068 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.202,"smiles":null,"spectrum_id":"CCMSLIB00017244118","spectrum_index":19224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 159.089 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.191,"smiles":null,"spectrum_id":"CCMSLIB00017244119","spectrum_index":19225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-2-hydroxybenzoic acid (delta mass: 126.1049 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.139,"smiles":null,"spectrum_id":"CCMSLIB00017244122","spectrum_index":19226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 118.0775 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.257,"smiles":null,"spectrum_id":"CCMSLIB00017244123","spectrum_index":19227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 135.905 Da; putative annotation: N/A; putative formula: CH-1O2P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.96,"smiles":null,"spectrum_id":"CCMSLIB00017244126","spectrum_index":19228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 63.0206 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017244127","spectrum_index":19229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 27.0472 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.113,"smiles":null,"spectrum_id":"CCMSLIB00017244130","spectrum_index":19230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of elegantissine (delta mass: 16.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.25,"smiles":null,"spectrum_id":"CCMSLIB00017244132","spectrum_index":19231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 51.9935 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.085,"smiles":null,"spectrum_id":"CCMSLIB00017244134","spectrum_index":19232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 129.0429 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.092,"smiles":null,"spectrum_id":"CCMSLIB00017244137","spectrum_index":19233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017244138","spectrum_index":19234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroterrein (delta mass: 187.121 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.207,"smiles":null,"spectrum_id":"CCMSLIB00017244141","spectrum_index":19235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 101.1269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.223,"smiles":null,"spectrum_id":"CCMSLIB00017244142","spectrum_index":19236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 73.9999 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017244145","spectrum_index":19237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 36.0081 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.095,"smiles":null,"spectrum_id":"CCMSLIB00017244146","spectrum_index":19238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 284.2723 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.53,"smiles":null,"spectrum_id":"CCMSLIB00017244149","spectrum_index":19239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 572.2497 Da; putative annotation: N/A; putative formula: C37H36N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":929.55,"smiles":null,"spectrum_id":"CCMSLIB00017244150","spectrum_index":19240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Gallic acid from NIST14 (delta mass: 94.0056 Da; putative annotation: N/A; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.034,"smiles":null,"spectrum_id":"CCMSLIB00017244153","spectrum_index":19241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 52.0674 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.257,"smiles":null,"spectrum_id":"CCMSLIB00017244154","spectrum_index":19242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 384.1271 Da; putative annotation: N/A; putative formula: C20H16N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.187,"smiles":null,"spectrum_id":"CCMSLIB00017244157","spectrum_index":19243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 80.0624 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.32,"smiles":null,"spectrum_id":"CCMSLIB00017244160","spectrum_index":19244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 166.0997 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.181,"smiles":null,"spectrum_id":"CCMSLIB00017244161","spectrum_index":19245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-TRIHYDROXYBENZOIC ACID\"\" (delta mass: 108.0208 Da; putative annotation: N/A; putative formula: C6H4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.05,"smiles":null,"spectrum_id":"CCMSLIB00017244163","spectrum_index":19246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-linolenic acid (delta mass: 68.0477 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.28,"smiles":null,"spectrum_id":"CCMSLIB00017244165","spectrum_index":19247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 320.2557 Da; putative annotation: N/A; putative formula: C14H28N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.488,"smiles":null,"spectrum_id":"CCMSLIB00017244168","spectrum_index":19248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylpiperidine (delta mass: 116.048 Da; putative annotation: N/A; putative formula: C6H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.191,"smiles":null,"spectrum_id":"CCMSLIB00017244170","spectrum_index":19249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 299.2812 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.466,"smiles":null,"spectrum_id":"CCMSLIB00017244172","spectrum_index":19250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Methylsulfanyl)-9H-pyrimido[4,5-b]indole (delta mass: 60.0277 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.087,"smiles":null,"spectrum_id":"CCMSLIB00017244175","spectrum_index":19251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Heptynoic acid (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017244177","spectrum_index":19252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 183.5476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.608,"smiles":null,"spectrum_id":"CCMSLIB00017244180","spectrum_index":19253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 75.0496 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.092,"smiles":null,"spectrum_id":"CCMSLIB00017244181","spectrum_index":19254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipivefrine (delta mass: 238.1725 Da; putative annotation: N/A; putative formula: C18H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.384,"smiles":null,"spectrum_id":"CCMSLIB00017244184","spectrum_index":19255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 62.0515 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017244185","spectrum_index":19256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 73.0136 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.064,"smiles":null,"spectrum_id":"CCMSLIB00017244188","spectrum_index":19257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 350.1625 Da; putative annotation: N/A; putative formula: C13H26N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.217,"smiles":null,"spectrum_id":"CCMSLIB00017244190","spectrum_index":19258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Leu-DL-Val (delta mass: 113.0837 Da; putative annotation: L-(+)-norleucine - 40.0 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017244192","spectrum_index":19259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Met (delta mass: 129.0424 Da; putative annotation: O-Acetyl-L-serine; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.133,"smiles":null,"spectrum_id":"CCMSLIB00017244195","spectrum_index":19260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 264.2449 Da; putative annotation: trans-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.336,"smiles":null,"spectrum_id":"CCMSLIB00017244197","spectrum_index":19261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 126.0318 Da; putative annotation: 2-(Hydroxymethyl)-3-methoxy-2H-furan-5-one; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.103,"smiles":null,"spectrum_id":"CCMSLIB00017244199","spectrum_index":19262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 204.1878 Da; putative annotation: Patchouli alcohol; putative formula: C15H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.393,"smiles":null,"spectrum_id":"CCMSLIB00017244202","spectrum_index":19263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 330.2185 Da; putative annotation: Kaurane-17,18-dioic acid, 18-methyl ester, (4.alpha.,16.alpha.)-; putative formula: C21H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.342,"smiles":null,"spectrum_id":"CCMSLIB00017244203","spectrum_index":19264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxopimara-8(14),15-dien-20-oic acid (delta mass: 294.2089 Da; putative annotation: (5.alpha.)-2'H-Androst-2-eno[3,2-c]pyrazol-17-one; putative formula: C20H26N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.42,"smiles":null,"spectrum_id":"CCMSLIB00017244206","spectrum_index":19265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 232.1425 Da; putative annotation: 5a-Hydroxy-1,7,7-trimethyl-1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene-4-carboxylic acid; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.281,"smiles":null,"spectrum_id":"CCMSLIB00017244207","spectrum_index":19266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Isolongifolol (delta mass: 204.1893 Da; putative annotation: (-)-Isolongifolol; putative formula: C15H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.395,"smiles":null,"spectrum_id":"CCMSLIB00017244210","spectrum_index":19267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 238.2289 Da; putative annotation: 2-Hexyldecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.492,"smiles":null,"spectrum_id":"CCMSLIB00017244211","spectrum_index":19268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic LL-D253.alpha. (delta mass: 338.0827 Da; putative annotation: NCGC00385404-01!2-hydroxy-3-[2-(7-hydroxy-5-methoxy-2-methyl-4-oxo-2,3-dihydrochromen-8-yl)ethylsulfanyl]propanoic acid [IIN-based: Match]; putative formula: C16H18O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.19,"smiles":null,"spectrum_id":"CCMSLIB00017244214","spectrum_index":19269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 260.216 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.73,"smiles":null,"spectrum_id":"CCMSLIB00017244215","spectrum_index":19270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid (delta mass: 334.249 Da; putative annotation: 1-Monolinolenin; putative formula: C21H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.476,"smiles":null,"spectrum_id":"CCMSLIB00017244218","spectrum_index":19271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 396.1416 Da; putative annotation: Benzyl 6-O-(4-carboxy-3-hydroxy-3-methylbutanoyl)-.beta.-D-glucopyranoside; putative formula: C19H24O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.202,"smiles":null,"spectrum_id":"CCMSLIB00017244219","spectrum_index":19272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 254.2246 Da; putative annotation: DL-.beta.-Hydroxypalmitic acid; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.436,"smiles":null,"spectrum_id":"CCMSLIB00017244222","spectrum_index":19273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 266.1555 Da; putative annotation: (4E,6E)-2-(Hydroxymethyl)-3-(3-methoxy-3-oxopropyl)deca-4,6-dienoic acid; putative formula: C15H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.294,"smiles":null,"spectrum_id":"CCMSLIB00017244223","spectrum_index":19274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 184.1104 Da; putative annotation: Methyl hydrogen azelate; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.176,"smiles":null,"spectrum_id":"CCMSLIB00017244226","spectrum_index":19275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of phenylethanolamine - 40.0 eV (delta mass: 140.0457 Da; putative annotation: 2-(methylethylidene)butanedioic acid CollisionEnergy:102040; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.137,"smiles":null,"spectrum_id":"CCMSLIB00017244227","spectrum_index":19276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 346.2183 Da; putative annotation: 3.beta.,5.beta.-Tetrahydrocortisone; putative formula: C21H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.44,"smiles":null,"spectrum_id":"CCMSLIB00017244230","spectrum_index":19277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 162.0531 Da; putative annotation: D-Fructose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.118,"smiles":null,"spectrum_id":"CCMSLIB00017244233","spectrum_index":19278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-5-methylhexyl)oxolan-2-one (delta mass: 94.0409 Da; putative annotation: SORBATE; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.2,"smiles":null,"spectrum_id":"CCMSLIB00017244234","spectrum_index":19279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 143.0589 Da; putative annotation: 2-Aminoadipic acid; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.15,"smiles":null,"spectrum_id":"CCMSLIB00017244237","spectrum_index":19280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 80.0622 Da; putative annotation: 1,5-Hexadien-3-ol; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017244238","spectrum_index":19281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331602 Linoleic acid|(9Z,12Z)-octadeca-9,12-dienoic acid (delta mass: 295.251 Da; putative annotation: Gly-C16:0; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.498,"smiles":null,"spectrum_id":"CCMSLIB00017244241","spectrum_index":19282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 127.2513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.331,"smiles":null,"spectrum_id":"CCMSLIB00017244242","spectrum_index":19283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 36.0363 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.342,"smiles":null,"spectrum_id":"CCMSLIB00017244245","spectrum_index":19284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2 ethanolamide (delta mass: 174.0885 Da; putative annotation: N/A; putative formula: C8H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.363,"smiles":null,"spectrum_id":"CCMSLIB00017244246","spectrum_index":19285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 338.3174 Da; putative annotation: N/A; putative formula: C22H42O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.399,"smiles":null,"spectrum_id":"CCMSLIB00017244249","spectrum_index":19286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-benzyl-4-azabicyclo[4.4.0]decan-1-ol CollisionEnergy:205060 (delta mass: 46.0139 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.199,"smiles":null,"spectrum_id":"CCMSLIB00017244251","spectrum_index":19287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 100.9962 Da; putative annotation: N/A; putative formula: H-1N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.244,"smiles":null,"spectrum_id":"CCMSLIB00017244253","spectrum_index":19288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 142.0987 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.164,"smiles":null,"spectrum_id":"CCMSLIB00017244255","spectrum_index":19289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rostafuroxin (delta mass: 64.0675 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017244257","spectrum_index":19290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutrynesulfoxide (delta mass: 358.1404 Da; putative annotation: N/A; putative formula: C24H24O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.279,"smiles":null,"spectrum_id":"CCMSLIB00017244260","spectrum_index":19291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 298.2499 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.492,"smiles":null,"spectrum_id":"CCMSLIB00017244261","spectrum_index":19292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 149.142 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.426,"smiles":null,"spectrum_id":"CCMSLIB00017244264","spectrum_index":19293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OMEGA-HYDROXYDODECANOIC ACID (delta mass: 84.094 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.274,"smiles":null,"spectrum_id":"CCMSLIB00017244265","spectrum_index":19294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 274.2503 Da; putative annotation: N/A; putative formula: C17H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.289,"smiles":null,"spectrum_id":"CCMSLIB00017244268","spectrum_index":19295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 294.2189 Da; putative annotation: N/A; putative formula: C18H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.285,"smiles":null,"spectrum_id":"CCMSLIB00017244269","spectrum_index":19296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 134.1091 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.357,"smiles":null,"spectrum_id":"CCMSLIB00017244272","spectrum_index":19297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 48.0362 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.247,"smiles":null,"spectrum_id":"CCMSLIB00017244273","spectrum_index":19298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLYCOCHOLATE - 70.0 eV (delta mass: 118.0751 Da; putative annotation: N/A; putative formula: C4H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.391,"smiles":null,"spectrum_id":"CCMSLIB00017244276","spectrum_index":19299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 143.9156 Da; putative annotation: N/A; putative formula: C4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.017,"smiles":null,"spectrum_id":"CCMSLIB00017244278","spectrum_index":19300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 290.2222 Da; putative annotation: N/A; putative formula: C15H26N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.391,"smiles":null,"spectrum_id":"CCMSLIB00017244280","spectrum_index":19301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 78.2521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.289,"smiles":null,"spectrum_id":"CCMSLIB00017244283","spectrum_index":19302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 969.6234 Da; putative annotation: N/A; putative formula: C49H87N5O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1150.69,"smiles":null,"spectrum_id":"CCMSLIB00017244284","spectrum_index":19303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 103.0056 Da; putative annotation: N/A; putative formula: C6HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.123,"smiles":null,"spectrum_id":"CCMSLIB00017244287","spectrum_index":19304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 263.246 Da; putative annotation: N/A; putative formula: C15H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.327,"smiles":null,"spectrum_id":"CCMSLIB00017244288","spectrum_index":19305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 227.1521 Da; putative annotation: N/A; putative formula: C12H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.363,"smiles":null,"spectrum_id":"CCMSLIB00017244291","spectrum_index":19306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 117.0559 Da; putative annotation: N/A; putative formula: C2H8N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.257,"smiles":null,"spectrum_id":"CCMSLIB00017244293","spectrum_index":19307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 56.0258 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.253,"smiles":null,"spectrum_id":"CCMSLIB00017244295","spectrum_index":19308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,7-dimethoxy-4-oxochromen-2-yl)propanoic acid (delta mass: 27.9847 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.071,"smiles":null,"spectrum_id":"CCMSLIB00017244297","spectrum_index":19309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 852.2729 Da; putative annotation: N/A; putative formula: C50H40N6O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1033.34,"smiles":null,"spectrum_id":"CCMSLIB00017244300","spectrum_index":19310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 14.0162 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.103,"smiles":null,"spectrum_id":"CCMSLIB00017244302","spectrum_index":19311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-C10:0 (delta mass: 55.0417 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.243,"smiles":null,"spectrum_id":"CCMSLIB00017244304","spectrum_index":19312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 103.009 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.257,"smiles":null,"spectrum_id":"CCMSLIB00017244307","spectrum_index":19313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(8-Chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethanone (delta mass: 226.0819 Da; putative annotation: N/A; putative formula: C15H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.161,"smiles":null,"spectrum_id":"CCMSLIB00017244309","spectrum_index":19314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384849-01_C21H34O10_2H-Cyclohepta[b]furan-2-one, 4-acetyl-6-[1-(beta-D-glucopyranosyloxy)-1-methylethyl]octahydro-8a-(hydroxymethyl)-, (3aS,4R,6R,8aR)- (delta mass: 78.0125 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.235,"smiles":null,"spectrum_id":"CCMSLIB00017244311","spectrum_index":19315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1162.7385 Da; putative annotation: N/A; putative formula: C78H94N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1384.84,"smiles":null,"spectrum_id":"CCMSLIB00017244314","spectrum_index":19316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid benzyl ester (delta mass: 22.0782 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.164,"smiles":null,"spectrum_id":"CCMSLIB00017244315","spectrum_index":19317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 79.9867 Da; putative annotation: N/A; putative formula: C4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.057,"smiles":null,"spectrum_id":"CCMSLIB00017244318","spectrum_index":19318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 112.0327 Da; putative annotation: N/A; putative formula: C9H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.129,"smiles":null,"spectrum_id":"CCMSLIB00017244319","spectrum_index":19319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Cyclodecadiene-1-methanol, .alpha.,.alpha.,4,8-tetramethyl- (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.227,"smiles":null,"spectrum_id":"CCMSLIB00017244321","spectrum_index":19320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetic acid, 2-[[2'-(5-ethyl-3,4-diphenyl-1H-pyrazol-1-yl)[1,1'-biphenyl]-3-yl]oxy]- (delta mass: 87.0539 Da; putative annotation: N/A; putative formula: CH5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.255,"smiles":null,"spectrum_id":"CCMSLIB00017244323","spectrum_index":19321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.102,"smiles":null,"spectrum_id":"CCMSLIB00017244326","spectrum_index":19322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 131.0392 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.216,"smiles":null,"spectrum_id":"CCMSLIB00017244327","spectrum_index":19323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 139.0295 Da; putative annotation: N/A; putative formula: C5H6N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.11,"smiles":null,"spectrum_id":"CCMSLIB00017244329","spectrum_index":19324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SALICYLAMIDE (delta mass: 227.0795 Da; putative annotation: N/A; putative formula: C10H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.134,"smiles":null,"spectrum_id":"CCMSLIB00017244331","spectrum_index":19325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 40.0546 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.133,"smiles":null,"spectrum_id":"CCMSLIB00017244334","spectrum_index":19326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 60.0324 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.286,"smiles":null,"spectrum_id":"CCMSLIB00017244335","spectrum_index":19327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1a,1b-Dihomoprostaglandin E1 (delta mass: 48.0355 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.315,"smiles":null,"spectrum_id":"CCMSLIB00017244338","spectrum_index":19328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxyphenylacetic acid (delta mass: 94.0776 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.127,"smiles":null,"spectrum_id":"CCMSLIB00017244340","spectrum_index":19329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 187.0925 Da; putative annotation: N/A; putative formula: C12H14NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.179,"smiles":null,"spectrum_id":"CCMSLIB00017244342","spectrum_index":19330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 621.5992 Da; putative annotation: N/A; putative formula: C39H79N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.826,"smiles":null,"spectrum_id":"CCMSLIB00017244345","spectrum_index":19331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 100.1688 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.234,"smiles":null,"spectrum_id":"CCMSLIB00017244346","spectrum_index":19332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paxilline (delta mass: 444.2767 Da; putative annotation: N/A; putative formula: C21H40N4O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":880.525,"smiles":null,"spectrum_id":"CCMSLIB00017244349","spectrum_index":19333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 318.2551 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.445,"smiles":null,"spectrum_id":"CCMSLIB00017244350","spectrum_index":19334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 139.0637 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.181,"smiles":null,"spectrum_id":"CCMSLIB00017244353","spectrum_index":19335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 293.2788 Da; putative annotation: N/A; putative formula: C18H35N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.555,"smiles":null,"spectrum_id":"CCMSLIB00017244354","spectrum_index":19336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 36.0469 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.42,"smiles":null,"spectrum_id":"CCMSLIB00017244357","spectrum_index":19337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 110.0031 Da; putative annotation: N/A; putative formula: C4H3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.078,"smiles":null,"spectrum_id":"CCMSLIB00017244359","spectrum_index":19338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 100.0881 Da; putative annotation: N/A; putative formula: C6H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.221,"smiles":null,"spectrum_id":"CCMSLIB00017244361","spectrum_index":19339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 425.1654 Da; putative annotation: N/A; putative formula: C16H31N3O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.309,"smiles":null,"spectrum_id":"CCMSLIB00017244364","spectrum_index":19340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 171.0969 Da; putative annotation: N/A; putative formula: C3H9N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.176,"smiles":null,"spectrum_id":"CCMSLIB00017244365","spectrum_index":19341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufalin (delta mass: 68.0628 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.316,"smiles":null,"spectrum_id":"CCMSLIB00017244368","spectrum_index":19342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 304.2038 Da; putative annotation: N/A; putative formula: C19H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.436,"smiles":null,"spectrum_id":"CCMSLIB00017244370","spectrum_index":19343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 251.1799 Da; putative annotation: N/A; putative formula: C15H26NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.417,"smiles":null,"spectrum_id":"CCMSLIB00017244372","spectrum_index":19344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 598.1622 Da; putative annotation: N/A; putative formula: C29H30N2O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.203,"smiles":null,"spectrum_id":"CCMSLIB00017244375","spectrum_index":19345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-4-(methoxymethyl)coumarin (delta mass: 911.3331 Da; putative annotation: N/A; putative formula: C36H59N5O18P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1118.4,"smiles":null,"spectrum_id":"CCMSLIB00017244377","spectrum_index":19346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 112.0678 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017244379","spectrum_index":19347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5-Anhydro-6-deoxy-2-O-(6-deoxy-.alpha.-L-mannopyranosyl)-1-(5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl)hexitol (delta mass: 45.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.234,"smiles":null,"spectrum_id":"CCMSLIB00017244381","spectrum_index":19348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-hydroxybenzoic acid (delta mass: 196.0895 Da; putative annotation: N/A; putative formula: C7H12N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.119,"smiles":null,"spectrum_id":"CCMSLIB00017244383","spectrum_index":19349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 91.0633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.295,"smiles":null,"spectrum_id":"CCMSLIB00017244386","spectrum_index":19350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 96.06 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.23,"smiles":null,"spectrum_id":"CCMSLIB00017244387","spectrum_index":19351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrachcinidine (delta mass: 61.0162 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.212,"smiles":null,"spectrum_id":"CCMSLIB00017244389","spectrum_index":19352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-6,10,14,18-tetraene-2,3,22,23-tetrol (delta mass: 174.1384 Da; putative annotation: N/A; putative formula: C7H19N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.548,"smiles":null,"spectrum_id":"CCMSLIB00017244391","spectrum_index":19353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 621.1899 Da; putative annotation: N/A; putative formula: C33H32N7PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.25,"smiles":null,"spectrum_id":"CCMSLIB00017244394","spectrum_index":19354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Tetrahydro-3-furanyl-4-piperidinamine (delta mass: 295.1064 Da; putative annotation: N/A; putative formula: C15H21NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.256,"smiles":null,"spectrum_id":"CCMSLIB00017244396","spectrum_index":19355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tapentadol (delta mass: 98.1304 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.316,"smiles":null,"spectrum_id":"CCMSLIB00017244399","spectrum_index":19356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1(4H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-6-hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl- (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017244401","spectrum_index":19357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Phe from NIST14 (delta mass: 99.0687 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.187,"smiles":null,"spectrum_id":"CCMSLIB00017244403","spectrum_index":19358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 96.9834 Da; putative annotation: N/A; putative formula: C2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.085,"smiles":null,"spectrum_id":"CCMSLIB00017244405","spectrum_index":19359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 75.994 Da; putative annotation: N/A; putative formula: C5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.074,"smiles":null,"spectrum_id":"CCMSLIB00017244407","spectrum_index":19360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 112.0531 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.124,"smiles":null,"spectrum_id":"CCMSLIB00017244410","spectrum_index":19361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-7-methoxycoumarin (delta mass: 166.1016 Da; putative annotation: N/A; putative formula: C9H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.151,"smiles":null,"spectrum_id":"CCMSLIB00017244412","spectrum_index":19362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385617-01!9-[(Z)-4-hydroxy-3-methylbut-2-enoxy]furo[3,2-g]chromen-7-one (delta mass: 88.0532 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.145,"smiles":null,"spectrum_id":"CCMSLIB00017244414","spectrum_index":19363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380732-01_C24H35NO4_1H-Cycloundec[d]isoindole-1,15(2H)-dione, 3,3a,4,6a,9,10,11,12-octahydro-11,12-dihydroxy-4,5,8-trimethyl-3-(2-methylpropyl)-, (7E,13E)- (delta mass: 371.2986 Da; putative annotation: N/A; putative formula: C20H43N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.562,"smiles":null,"spectrum_id":"CCMSLIB00017244417","spectrum_index":19364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 27.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.154,"smiles":null,"spectrum_id":"CCMSLIB00017244418","spectrum_index":19365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Bis(2-hydroxyethyl)formamide (delta mass: 182.2036 Da; putative annotation: N/A; putative formula: C13H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.285,"smiles":null,"spectrum_id":"CCMSLIB00017244421","spectrum_index":19366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 36.0362 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017244422","spectrum_index":19367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hautriwaic acid (delta mass: 62.0526 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.259,"smiles":null,"spectrum_id":"CCMSLIB00017244425","spectrum_index":19368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 259.0428 Da; putative annotation: N/A; putative formula: C10H14NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.145,"smiles":null,"spectrum_id":"CCMSLIB00017244426","spectrum_index":19369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Adamantanol (delta mass: 253.0779 Da; putative annotation: N/A; putative formula: C12H17NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.205,"smiles":null,"spectrum_id":"CCMSLIB00017244429","spectrum_index":19370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 146.1759 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017244430","spectrum_index":19371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid (delta mass: 18.0147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.154,"smiles":null,"spectrum_id":"CCMSLIB00017244433","spectrum_index":19372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 59.073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.295,"smiles":null,"spectrum_id":"CCMSLIB00017244435","spectrum_index":19373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid methyl ester (delta mass: 172.1306 Da; putative annotation: N/A; putative formula: C3H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.514,"smiles":null,"spectrum_id":"CCMSLIB00017244437","spectrum_index":19374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 183.1904 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.298,"smiles":null,"spectrum_id":"CCMSLIB00017244439","spectrum_index":19375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 215.9964 Da; putative annotation: N/A; putative formula: C6H8N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.098,"smiles":null,"spectrum_id":"CCMSLIB00017244442","spectrum_index":19376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 339.3144 Da; putative annotation: N/A; putative formula: C21H41NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.557,"smiles":null,"spectrum_id":"CCMSLIB00017244444","spectrum_index":19377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(4S,8aS)-4-acetyloxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 116.0635 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.311,"smiles":null,"spectrum_id":"CCMSLIB00017244446","spectrum_index":19378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ellagic acid (delta mass: 480.0508 Da; putative annotation: N/A; putative formula: C16H20N2O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.064,"smiles":null,"spectrum_id":"CCMSLIB00017244448","spectrum_index":19379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Oleoylethanolamine (delta mass: 18.0096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.315,"smiles":null,"spectrum_id":"CCMSLIB00017244450","spectrum_index":19380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017244453","spectrum_index":19381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 2.0497 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.22,"smiles":null,"spectrum_id":"CCMSLIB00017244454","spectrum_index":19382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Deoxyprostaglandin E2 (delta mass: 106.0782 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.315,"smiles":null,"spectrum_id":"CCMSLIB00017244457","spectrum_index":19383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE30; MS2Dec (delta mass: 44.0266 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.092,"smiles":null,"spectrum_id":"CCMSLIB00017244458","spectrum_index":19384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 129.0084 Da; putative annotation: N/A; putative formula: C3H4N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.147,"smiles":null,"spectrum_id":"CCMSLIB00017244461","spectrum_index":19385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclic adenosine diphosphate ribose (delta mass: 411.5572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":953.626,"smiles":null,"spectrum_id":"CCMSLIB00017244463","spectrum_index":19386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desoxypipradrol (delta mass: 556.2205 Da; putative annotation: N/A; putative formula: C24H36N4O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.395,"smiles":null,"spectrum_id":"CCMSLIB00017244465","spectrum_index":19387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-1,4-diazepane (delta mass: 117.0449 Da; putative annotation: N/A; putative formula: C3H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.163,"smiles":null,"spectrum_id":"CCMSLIB00017244468","spectrum_index":19388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 130.08 Da; putative annotation: N/A; putative formula: C7H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.317,"smiles":null,"spectrum_id":"CCMSLIB00017244469","spectrum_index":19389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 186.1042 Da; putative annotation: N/A; putative formula: C13H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.191,"smiles":null,"spectrum_id":"CCMSLIB00017244472","spectrum_index":19390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-(-)-Nopol CollisionEnergy:205060 (delta mass: 46.0051 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.148,"smiles":null,"spectrum_id":"CCMSLIB00017244473","spectrum_index":19391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 384.1878 Da; putative annotation: N/A; putative formula: C30H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.229,"smiles":null,"spectrum_id":"CCMSLIB00017244476","spectrum_index":19392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 328.3122 Da; putative annotation: N/A; putative formula: C18H41N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.377,"smiles":null,"spectrum_id":"CCMSLIB00017244478","spectrum_index":19393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole (delta mass: 236.2045 Da; putative annotation: N/A; putative formula: C16H29O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.273,"smiles":null,"spectrum_id":"CCMSLIB00017244480","spectrum_index":19394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 185.0945 Da; putative annotation: N/A; putative formula: C11H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.171,"smiles":null,"spectrum_id":"CCMSLIB00017244483","spectrum_index":19395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (25S)-7-Dafachronic acid (delta mass: 18.9146 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.235,"smiles":null,"spectrum_id":"CCMSLIB00017244484","spectrum_index":19396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,3-Dimethylbicyclo[2.2.1]hept-2-yl)-1-propanol (delta mass: 56.0081 Da; putative annotation: N/A; putative formula: C3H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.182,"smiles":null,"spectrum_id":"CCMSLIB00017244487","spectrum_index":19397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 405.1082 Da; putative annotation: N/A; putative formula: C21H19N5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.293,"smiles":null,"spectrum_id":"CCMSLIB00017244488","spectrum_index":19398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Trp (delta mass: 240.0751 Da; putative annotation: N/A; putative formula: C12H19O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.225,"smiles":null,"spectrum_id":"CCMSLIB00017244491","spectrum_index":19399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 172.125 Da; putative annotation: N/A; putative formula: C13H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017244493","spectrum_index":19400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 164.0982 Da; putative annotation: N/A; putative formula: C14H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.44,"smiles":null,"spectrum_id":"CCMSLIB00017244495","spectrum_index":19401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 80.0731 Da; putative annotation: N/A; putative formula: C5H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.42,"smiles":null,"spectrum_id":"CCMSLIB00017244497","spectrum_index":19402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylimbricatolic acid (delta mass: 102.0838 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017244499","spectrum_index":19403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 94.0783 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017244502","spectrum_index":19404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-isopropylthiophenethylamine (delta mass: 186.0873 Da; putative annotation: N/A; putative formula: C13H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.224,"smiles":null,"spectrum_id":"CCMSLIB00017244503","spectrum_index":19405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 517.1492 Da; putative annotation: N/A; putative formula: C20H23N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.19,"smiles":null,"spectrum_id":"CCMSLIB00017244505","spectrum_index":19406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 227.2235 Da; putative annotation: N/A; putative formula: C10H25N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.492,"smiles":null,"spectrum_id":"CCMSLIB00017244508","spectrum_index":19407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 73.7814 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.92,"smiles":null,"spectrum_id":"CCMSLIB00017244510","spectrum_index":19408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dimethyl-1H-benzimidazole-2-thiol (delta mass: 161.0545 Da; putative annotation: N/A; putative formula: C9H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.118,"smiles":null,"spectrum_id":"CCMSLIB00017244512","spectrum_index":19409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid ethyl ester (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.122,"smiles":null,"spectrum_id":"CCMSLIB00017244514","spectrum_index":19410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one (delta mass: 337.1736 Da; putative annotation: N/A; putative formula: C14H27NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.39,"smiles":null,"spectrum_id":"CCMSLIB00017244516","spectrum_index":19411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 110.073 Da; putative annotation: N/A; putative formula: C7H10O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017244519","spectrum_index":19412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Epicorosolic acid (delta mass: 76.0659 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.428,"smiles":null,"spectrum_id":"CCMSLIB00017244520","spectrum_index":19413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam A (delta mass: 32.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.107,"smiles":null,"spectrum_id":"CCMSLIB00017244523","spectrum_index":19414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12S-Hydroxy-5Z,8E,10E-heptadecatrienoic acid (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.232,"smiles":null,"spectrum_id":"CCMSLIB00017244525","spectrum_index":19415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 32.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.268,"smiles":null,"spectrum_id":"CCMSLIB00017244527","spectrum_index":19416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 254.1882 Da; putative annotation: N/A; putative formula: C15H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.254,"smiles":null,"spectrum_id":"CCMSLIB00017244530","spectrum_index":19417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-isopropylthiophenethylamine (delta mass: 131.1012 Da; putative annotation: N/A; putative formula: CH9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.238,"smiles":null,"spectrum_id":"CCMSLIB00017244531","spectrum_index":19418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130087 (delta mass: 36.0201 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.191,"smiles":null,"spectrum_id":"CCMSLIB00017244534","spectrum_index":19419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)ethanol (delta mass: 132.042 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.176,"smiles":null,"spectrum_id":"CCMSLIB00017244535","spectrum_index":19420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 87.0327 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.156,"smiles":null,"spectrum_id":"CCMSLIB00017244538","spectrum_index":19421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-1,4-diazepane (delta mass: 172.0851 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.203,"smiles":null,"spectrum_id":"CCMSLIB00017244539","spectrum_index":19422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 28.0674 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.164,"smiles":null,"spectrum_id":"CCMSLIB00017244542","spectrum_index":19423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 40.0142 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.173,"smiles":null,"spectrum_id":"CCMSLIB00017244543","spectrum_index":19424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 62.0555 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.231,"smiles":null,"spectrum_id":"CCMSLIB00017244546","spectrum_index":19425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 191.0575 Da; putative annotation: N/A; putative formula: C10H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.159,"smiles":null,"spectrum_id":"CCMSLIB00017244548","spectrum_index":19426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 160.0851 Da; putative annotation: N/A; putative formula: C6H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017244550","spectrum_index":19427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 108.0319 Da; putative annotation: N/A; putative formula: C5H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.128,"smiles":null,"spectrum_id":"CCMSLIB00017244553","spectrum_index":19428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 219.1456 Da; putative annotation: N/A; putative formula: C14H21NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.393,"smiles":null,"spectrum_id":"CCMSLIB00017244554","spectrum_index":19429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyldihydrosphingosine (delta mass: 226.2296 Da; putative annotation: N/A; putative formula: C15H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.545,"smiles":null,"spectrum_id":"CCMSLIB00017244557","spectrum_index":19430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3R)-2-(((S)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(1-benzylpiperidin-4-yl)-3-methylpentanamide (delta mass: 3.1197 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.5,"smiles":null,"spectrum_id":"CCMSLIB00017244558","spectrum_index":19431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 122.0371 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.087,"smiles":null,"spectrum_id":"CCMSLIB00017244561","spectrum_index":19432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 735.3216 Da; putative annotation: N/A; putative formula: C35H49N3O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.382,"smiles":null,"spectrum_id":"CCMSLIB00017244562","spectrum_index":19433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-O-(Phenylacetyl)-.beta.-D-glucopyranose (delta mass: 73.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.201,"smiles":null,"spectrum_id":"CCMSLIB00017244565","spectrum_index":19434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 289.1519 Da; putative annotation: N/A; putative formula: C13H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.212,"smiles":null,"spectrum_id":"CCMSLIB00017244566","spectrum_index":19435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylpiperidine (delta mass: 191.1266 Da; putative annotation: N/A; putative formula: C7H17N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.27,"smiles":null,"spectrum_id":"CCMSLIB00017244569","spectrum_index":19436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 48.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.076,"smiles":null,"spectrum_id":"CCMSLIB00017244571","spectrum_index":19437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4'-Ethenyl-2'-hydroxy-1,4',4a-trimethyl-5-oxospiro[2,3,4,7,8,8a-hexahydronaphthalene-6,1'-cyclopentane]-1-carboxylic acid (delta mass: 86.0553 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.277,"smiles":null,"spectrum_id":"CCMSLIB00017244573","spectrum_index":19438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 97.9959 Da; putative annotation: N/A; putative formula: H-2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.051,"smiles":null,"spectrum_id":"CCMSLIB00017244576","spectrum_index":19439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 44.0337 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.094,"smiles":null,"spectrum_id":"CCMSLIB00017244577","spectrum_index":19440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-pyrazole-3-carboxylic acid (delta mass: 100.0094 Da; putative annotation: N/A; putative formula: C3H4N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.06,"smiles":null,"spectrum_id":"CCMSLIB00017244580","spectrum_index":19441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Tyr from NIST14 (delta mass: 78.0152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.128,"smiles":null,"spectrum_id":"CCMSLIB00017244582","spectrum_index":19442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 297.0861 Da; putative annotation: N/A; putative formula: C14H11N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.21,"smiles":null,"spectrum_id":"CCMSLIB00017244584","spectrum_index":19443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.222,"smiles":null,"spectrum_id":"CCMSLIB00017244587","spectrum_index":19444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4R,5R)-3-[(11E)-Hexadeca-11,15-dien-9-ynyl]-4-hydroxy-5-methyloxolan-2-one (delta mass: 38.0164 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.259,"smiles":null,"spectrum_id":"CCMSLIB00017244589","spectrum_index":19445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 24.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.169,"smiles":null,"spectrum_id":"CCMSLIB00017244592","spectrum_index":19446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 172.1459 Da; putative annotation: N/A; putative formula: C10H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.206,"smiles":null,"spectrum_id":"CCMSLIB00017244594","spectrum_index":19447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. 1,11-lactone (delta mass: 56.0265 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.264,"smiles":null,"spectrum_id":"CCMSLIB00017244597","spectrum_index":19448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 63.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.095,"smiles":null,"spectrum_id":"CCMSLIB00017244599","spectrum_index":19449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-linoleoyl-rac-glycerol (delta mass: 38.0513 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.581,"smiles":null,"spectrum_id":"CCMSLIB00017244601","spectrum_index":19450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 111.1071 Da; putative annotation: N/A; putative formula: C7H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.24,"smiles":null,"spectrum_id":"CCMSLIB00017244603","spectrum_index":19451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androstane-3.beta.,17.beta.-diol (delta mass: 62.0468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.294,"smiles":null,"spectrum_id":"CCMSLIB00017244606","spectrum_index":19452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 129.0429 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.145,"smiles":null,"spectrum_id":"CCMSLIB00017244607","spectrum_index":19453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 74.0726 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.127,"smiles":null,"spectrum_id":"CCMSLIB00017244610","spectrum_index":19454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cresotinic acid (delta mass: 72.0206 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.075,"smiles":null,"spectrum_id":"CCMSLIB00017244611","spectrum_index":19455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.102,"smiles":null,"spectrum_id":"CCMSLIB00017244614","spectrum_index":19456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Asn-Phe from NIST14 (delta mass: 162.053 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.182,"smiles":null,"spectrum_id":"CCMSLIB00017244616","spectrum_index":19457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 128.0987 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017244618","spectrum_index":19458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 74.0576 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.31,"smiles":null,"spectrum_id":"CCMSLIB00017244620","spectrum_index":19459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 344.6699 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.751,"smiles":null,"spectrum_id":"CCMSLIB00017244622","spectrum_index":19460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 148.0023 Da; putative annotation: N/A; putative formula: C5N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.089,"smiles":null,"spectrum_id":"CCMSLIB00017244624","spectrum_index":19461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 260.1303 Da; putative annotation: N/A; putative formula: C12H17N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.269,"smiles":null,"spectrum_id":"CCMSLIB00017244627","spectrum_index":19462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(2-(3-Hydroxy-2,2,5a-trimethyl-7-methylidenedecahydro-1-benzoxepin-6-yl)ethyl)-2,2,5a,7-tetramethyldecahydro-1-benzoxepine-3,4,6-triol (delta mass: 138.0833 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.467,"smiles":null,"spectrum_id":"CCMSLIB00017244629","spectrum_index":19463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 196.0824 Da; putative annotation: N/A; putative formula: C5H8N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.144,"smiles":null,"spectrum_id":"CCMSLIB00017244631","spectrum_index":19464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 107.0044 Da; putative annotation: N/A; putative formula: C2H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.116,"smiles":null,"spectrum_id":"CCMSLIB00017244632","spectrum_index":19465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 93.0102 Da; putative annotation: N/A; putative formula: H4N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017244635","spectrum_index":19466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 14.015 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.091,"smiles":null,"spectrum_id":"CCMSLIB00017244637","spectrum_index":19467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 350.0247 Da; putative annotation: N/A; putative formula: C11H6N6O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.138,"smiles":null,"spectrum_id":"CCMSLIB00017244639","spectrum_index":19468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10-Dihydro-15-deoxy-.DELTA.12,14-prostaglandin J2 (delta mass: 45.9669 Da; putative annotation: N/A; putative formula: H-2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.194,"smiles":null,"spectrum_id":"CCMSLIB00017244640","spectrum_index":19469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 340.1787 Da; putative annotation: N/A; putative formula: C20H24N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.27,"smiles":null,"spectrum_id":"CCMSLIB00017244643","spectrum_index":19470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(hydroxymethyl)-4,9a-dimethyl-2,7,8,9-tetrahydro-1H-benzo[7]annulen-3-one (delta mass: 36.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.185,"smiles":null,"spectrum_id":"CCMSLIB00017244645","spectrum_index":19471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vanillin CollisionEnergy:102040 (delta mass: 57.0248 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.079,"smiles":null,"spectrum_id":"CCMSLIB00017244647","spectrum_index":19472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 379.1854 Da; putative annotation: N/A; putative formula: C27H26NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.256,"smiles":null,"spectrum_id":"CCMSLIB00017244650","spectrum_index":19473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 619.4446 Da; putative annotation: N/A; putative formula: C36H61NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.505,"smiles":null,"spectrum_id":"CCMSLIB00017244651","spectrum_index":19474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 127.0518 Da; putative annotation: N/A; putative formula: C8H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.195,"smiles":null,"spectrum_id":"CCMSLIB00017244653","spectrum_index":19475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 640.5659 Da; putative annotation: N/A; putative formula: C40H72N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":923.829,"smiles":null,"spectrum_id":"CCMSLIB00017244655","spectrum_index":19476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 102.03 Da; putative annotation: N/A; putative formula: H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.199,"smiles":null,"spectrum_id":"CCMSLIB00017244658","spectrum_index":19477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.alpha.-Hydroxystanozolol (delta mass: 80.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.31,"smiles":null,"spectrum_id":"CCMSLIB00017244659","spectrum_index":19478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 60.0243 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.199,"smiles":null,"spectrum_id":"CCMSLIB00017244662","spectrum_index":19479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 74.036 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.205,"smiles":null,"spectrum_id":"CCMSLIB00017244663","spectrum_index":19480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthro[3,2-b]furan-9(1H)-one, 2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro-6,10a-dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl- (delta mass: 92.0623 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.279,"smiles":null,"spectrum_id":"CCMSLIB00017244666","spectrum_index":19481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 86.0366 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017244667","spectrum_index":19482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 96.9843 Da; putative annotation: N/A; putative formula: CH-1N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.148,"smiles":null,"spectrum_id":"CCMSLIB00017244670","spectrum_index":19483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 66.0409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.142,"smiles":null,"spectrum_id":"CCMSLIB00017244672","spectrum_index":19484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 33.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.079,"smiles":null,"spectrum_id":"CCMSLIB00017244674","spectrum_index":19485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 73.9462 Da; putative annotation: N/A; putative formula: CH-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.962,"smiles":null,"spectrum_id":"CCMSLIB00017244677","spectrum_index":19486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Linoleoylglycerol from NIST14 (delta mass: 162.0428 Da; putative annotation: N/A; putative formula: C8H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.327,"smiles":null,"spectrum_id":"CCMSLIB00017244678","spectrum_index":19487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 619.3572 Da; putative annotation: N/A; putative formula: C33H54N3O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.428,"smiles":null,"spectrum_id":"CCMSLIB00017244681","spectrum_index":19488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 540.3444 Da; putative annotation: N/A; putative formula: C25H52N2O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.404,"smiles":null,"spectrum_id":"CCMSLIB00017244682","spectrum_index":19489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 911.4512 Da; putative annotation: N/A; putative formula: C58H61N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1074.51,"smiles":null,"spectrum_id":"CCMSLIB00017244685","spectrum_index":19490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 106.1 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.218,"smiles":null,"spectrum_id":"CCMSLIB00017244687","spectrum_index":19491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isomaltose (delta mass: 151.0626 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.186,"smiles":null,"spectrum_id":"CCMSLIB00017244689","spectrum_index":19492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 100.0525 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.144,"smiles":null,"spectrum_id":"CCMSLIB00017244692","spectrum_index":19493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 511.1798 Da; putative annotation: N/A; putative formula: C35H21N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.266,"smiles":null,"spectrum_id":"CCMSLIB00017244693","spectrum_index":19494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,16-Dimethylprostaglandin D2 (delta mass: 76.0683 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.332,"smiles":null,"spectrum_id":"CCMSLIB00017244696","spectrum_index":19495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sumaresinolic acid (delta mass: 62.0539 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.416,"smiles":null,"spectrum_id":"CCMSLIB00017244698","spectrum_index":19496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 84.0206 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.133,"smiles":null,"spectrum_id":"CCMSLIB00017244700","spectrum_index":19497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 110.0731 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.305,"smiles":null,"spectrum_id":"CCMSLIB00017244703","spectrum_index":19498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazole (delta mass: 17.0508 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":86.0955,"smiles":null,"spectrum_id":"CCMSLIB00017244705","spectrum_index":19499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 558.2022 Da; putative annotation: N/A; putative formula: C19H34N4O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.243,"smiles":null,"spectrum_id":"CCMSLIB00017244707","spectrum_index":19500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 66.0473 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.332,"smiles":null,"spectrum_id":"CCMSLIB00017244709","spectrum_index":19501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 70.0774 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.32,"smiles":null,"spectrum_id":"CCMSLIB00017244711","spectrum_index":19502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 495.283 Da; putative annotation: N/A; putative formula: C21H46N5O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.354,"smiles":null,"spectrum_id":"CCMSLIB00017244714","spectrum_index":19503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[3-[3-Hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxyphenyl]-5-oxo-2H-furan-2-yl]acetic acid (delta mass: 14.0056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.113,"smiles":null,"spectrum_id":"CCMSLIB00017244716","spectrum_index":19504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 169.0335 Da; putative annotation: N/A; putative formula: C2H7N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.16,"smiles":null,"spectrum_id":"CCMSLIB00017244718","spectrum_index":19505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 72.0572 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.128,"smiles":null,"spectrum_id":"CCMSLIB00017244720","spectrum_index":19506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-tyrosine (delta mass: 54.0466 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.138,"smiles":null,"spectrum_id":"CCMSLIB00017244723","spectrum_index":19507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 103.0992 Da; putative annotation: N/A; putative formula: CH9N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.159,"smiles":null,"spectrum_id":"CCMSLIB00017244724","spectrum_index":19508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 184.7104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.964,"smiles":null,"spectrum_id":"CCMSLIB00017244727","spectrum_index":19509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palitantin (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.165,"smiles":null,"spectrum_id":"CCMSLIB00017244730","spectrum_index":19510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 176.9654 Da; putative annotation: N/A; putative formula: C2H-1N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.135,"smiles":null,"spectrum_id":"CCMSLIB00017244731","spectrum_index":19511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 74.0563 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.335,"smiles":null,"spectrum_id":"CCMSLIB00017244734","spectrum_index":19512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(R)-4-((5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid\"\" (delta mass: 40.0131 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.302,"smiles":null,"spectrum_id":"CCMSLIB00017244735","spectrum_index":19513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 142.0632 Da; putative annotation: N/A; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.181,"smiles":null,"spectrum_id":"CCMSLIB00017244737","spectrum_index":19514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 40.9888 Da; putative annotation: N/A; putative formula: CH-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.07,"smiles":null,"spectrum_id":"CCMSLIB00017244739","spectrum_index":19515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-ALANINE (delta mass: 43.015 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.07,"smiles":null,"spectrum_id":"CCMSLIB00017244742","spectrum_index":19516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(Hydroxymethyl)-3,8-dimethyl-2-oxooctahydro-3a,7-ethanoindene-4-carboxylic acid (delta mass: 284.1621 Da; putative annotation: N/A; putative formula: C15H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.321,"smiles":null,"spectrum_id":"CCMSLIB00017244743","spectrum_index":19517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-hydroxybenzoic acid CollisionEnergy:102040 (delta mass: 102.0308 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.081,"smiles":null,"spectrum_id":"CCMSLIB00017244746","spectrum_index":19518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 96.0565 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.111,"smiles":null,"spectrum_id":"CCMSLIB00017244748","spectrum_index":19519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 254.1002 Da; putative annotation: N/A; putative formula: C9H18O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.321,"smiles":null,"spectrum_id":"CCMSLIB00017244750","spectrum_index":19520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 262.1413 Da; putative annotation: N/A; putative formula: C12H22O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.28,"smiles":null,"spectrum_id":"CCMSLIB00017244753","spectrum_index":19521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU071404 N-[3-(Dimethylamino)propyl]dodecanamide (delta mass: 84.0943 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.384,"smiles":null,"spectrum_id":"CCMSLIB00017244754","spectrum_index":19522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 64.0667 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.226,"smiles":null,"spectrum_id":"CCMSLIB00017244757","spectrum_index":19523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 194.1805 Da; putative annotation: N/A; putative formula: C12H22N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.221,"smiles":null,"spectrum_id":"CCMSLIB00017244758","spectrum_index":19524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 62.9593 Da; putative annotation: N/A; putative formula: HNO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.022,"smiles":null,"spectrum_id":"CCMSLIB00017244761","spectrum_index":19525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde (delta mass: 27.0108 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.055,"smiles":null,"spectrum_id":"CCMSLIB00017244763","spectrum_index":19526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 259.1071 Da; putative annotation: N/A; putative formula: C12H13N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.251,"smiles":null,"spectrum_id":"CCMSLIB00017244765","spectrum_index":19527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 82.0506 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017244768","spectrum_index":19528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 104.0109 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017244769","spectrum_index":19529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 196.1089 Da; putative annotation: N/A; putative formula: C11H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.2,"smiles":null,"spectrum_id":"CCMSLIB00017244772","spectrum_index":19530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 223.105 Da; putative annotation: N/A; putative formula: C8H17NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.176,"smiles":null,"spectrum_id":"CCMSLIB00017244773","spectrum_index":19531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hopen-3-on (delta mass: 35.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.426,"smiles":null,"spectrum_id":"CCMSLIB00017244776","spectrum_index":19532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 441.2938 Da; putative annotation: N/A; putative formula: C31H40NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.333,"smiles":null,"spectrum_id":"CCMSLIB00017244777","spectrum_index":19533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 107.988 Da; putative annotation: N/A; putative formula: C2H4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.038,"smiles":null,"spectrum_id":"CCMSLIB00017244780","spectrum_index":19534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 481.3034 Da; putative annotation: N/A; putative formula: C26H43NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.546,"smiles":null,"spectrum_id":"CCMSLIB00017244781","spectrum_index":19535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 124.1594 Da; putative annotation: N/A; putative formula: C10H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.251,"smiles":null,"spectrum_id":"CCMSLIB00017244784","spectrum_index":19536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 184.037 Da; putative annotation: N/A; putative formula: C8H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.076,"smiles":null,"spectrum_id":"CCMSLIB00017244787","spectrum_index":19537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 611.5429 Da; putative annotation: N/A; putative formula: C44H69N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":831.586,"smiles":null,"spectrum_id":"CCMSLIB00017244788","spectrum_index":19538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 96.0571 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017244791","spectrum_index":19539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 162.0931 Da; putative annotation: N/A; putative formula: C5H14N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.148,"smiles":null,"spectrum_id":"CCMSLIB00017244792","spectrum_index":19540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 171.9561 Da; putative annotation: N/A; putative formula: C5HO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.037,"smiles":null,"spectrum_id":"CCMSLIB00017244795","spectrum_index":19541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 304.0797 Da; putative annotation: N/A; putative formula: C12H16O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.182,"smiles":null,"spectrum_id":"CCMSLIB00017244797","spectrum_index":19542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis,cis-9,12-Octadecadien-1-ol (delta mass: 52.0667 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.335,"smiles":null,"spectrum_id":"CCMSLIB00017244799","spectrum_index":19543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 327.1159 Da; putative annotation: N/A; putative formula: C24H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.212,"smiles":null,"spectrum_id":"CCMSLIB00017244802","spectrum_index":19544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 104.9884 Da; putative annotation: N/A; putative formula: C2H3NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.075,"smiles":null,"spectrum_id":"CCMSLIB00017244803","spectrum_index":19545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 231.197 Da; putative annotation: N/A; putative formula: C10H26N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.34,"smiles":null,"spectrum_id":"CCMSLIB00017244806","spectrum_index":19546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017244807","spectrum_index":19547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 188.16 Da; putative annotation: N/A; putative formula: C4H16N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.35,"smiles":null,"spectrum_id":"CCMSLIB00017244810","spectrum_index":19548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 244.1744 Da; putative annotation: N/A; putative formula: C17H25O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.255,"smiles":null,"spectrum_id":"CCMSLIB00017244811","spectrum_index":19549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.081,"smiles":null,"spectrum_id":"CCMSLIB00017244814","spectrum_index":19550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 355.4937 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.58,"smiles":null,"spectrum_id":"CCMSLIB00017244816","spectrum_index":19551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Hydroxyethyl)acetamide (delta mass: 100.0144 Da; putative annotation: N/A; putative formula: N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.085,"smiles":null,"spectrum_id":"CCMSLIB00017244818","spectrum_index":19552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 15.44 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.5,"smiles":null,"spectrum_id":"CCMSLIB00017244820","spectrum_index":19553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 82.0785 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.342,"smiles":null,"spectrum_id":"CCMSLIB00017244822","spectrum_index":19554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-(1,2,4a,5-Tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoic acid (delta mass: 64.0418 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.269,"smiles":null,"spectrum_id":"CCMSLIB00017244825","spectrum_index":19555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 239.0392 Da; putative annotation: N/A; putative formula: C7H16NO2P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.099,"smiles":null,"spectrum_id":"CCMSLIB00017244827","spectrum_index":19556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 100.016 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.066,"smiles":null,"spectrum_id":"CCMSLIB00017244829","spectrum_index":19557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(hydroxymethyl)-2-methyl-2-(5-oxooxolan-2-yl)-3H-chromen-4-one (delta mass: 36.0112 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.113,"smiles":null,"spectrum_id":"CCMSLIB00017244831","spectrum_index":19558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 18.9701 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.212,"smiles":null,"spectrum_id":"CCMSLIB00017244833","spectrum_index":19559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-3,10-Dihydroxy-4,9-dimethyldodec-6-enedioic acid (delta mass: 36.036 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017244836","spectrum_index":19560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cinchonidine (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.243,"smiles":null,"spectrum_id":"CCMSLIB00017244837","spectrum_index":19561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 88.0321 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.134,"smiles":null,"spectrum_id":"CCMSLIB00017244840","spectrum_index":19562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 124.0487 Da; putative annotation: N/A; putative formula: C3H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.14,"smiles":null,"spectrum_id":"CCMSLIB00017244842","spectrum_index":19563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 100.0644 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.13,"smiles":null,"spectrum_id":"CCMSLIB00017244844","spectrum_index":19564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 896.4295 Da; putative annotation: N/A; putative formula: C44H56N12O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1118.53,"smiles":null,"spectrum_id":"CCMSLIB00017244847","spectrum_index":19565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 258.1099 Da; putative annotation: N/A; putative formula: C12H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.17,"smiles":null,"spectrum_id":"CCMSLIB00017244849","spectrum_index":19566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 64.15 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.185,"smiles":null,"spectrum_id":"CCMSLIB00017244851","spectrum_index":19567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 17.9482 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.159,"smiles":null,"spectrum_id":"CCMSLIB00017244853","spectrum_index":19568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 218.1048 Da; putative annotation: N/A; putative formula: C12H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.186,"smiles":null,"spectrum_id":"CCMSLIB00017244855","spectrum_index":19569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 114.0832 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.341,"smiles":null,"spectrum_id":"CCMSLIB00017244857","spectrum_index":19570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.108,"smiles":null,"spectrum_id":"CCMSLIB00017244860","spectrum_index":19571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10Z,14E)-6,14-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid (delta mass: 123.0899 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.28,"smiles":null,"spectrum_id":"CCMSLIB00017244862","spectrum_index":19572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 129.0512 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.101,"smiles":null,"spectrum_id":"CCMSLIB00017244864","spectrum_index":19573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 26.9996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.107,"smiles":null,"spectrum_id":"CCMSLIB00017244866","spectrum_index":19574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4S,5S,6R)-2-[[7-hydroxy-4-[(Z)-5-hydroxy-3-methylpent-3-enyl]-4a,8,8-trimethyl-3-methylidene-2,4,5,6,7,8a-hexahydro-1H-naphthalen-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 62.0504 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.361,"smiles":null,"spectrum_id":"CCMSLIB00017244868","spectrum_index":19575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 650.184 Da; putative annotation: N/A; putative formula: C22H38N2O18S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.339,"smiles":null,"spectrum_id":"CCMSLIB00017244871","spectrum_index":19576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 42.0112 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.071,"smiles":null,"spectrum_id":"CCMSLIB00017244873","spectrum_index":19577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 366.3093 Da; putative annotation: N/A; putative formula: C15H34N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.374,"smiles":null,"spectrum_id":"CCMSLIB00017244875","spectrum_index":19578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 546.6476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.62,"smiles":null,"spectrum_id":"CCMSLIB00017244878","spectrum_index":19579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-methoxybenzoic acid (delta mass: 99.0673 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.133,"smiles":null,"spectrum_id":"CCMSLIB00017244879","spectrum_index":19580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 88.0131 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.12,"smiles":null,"spectrum_id":"CCMSLIB00017244882","spectrum_index":19581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinoresinol (delta mass: 394.1622 Da; putative annotation: N/A; putative formula: C14H27N4O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":753.311,"smiles":null,"spectrum_id":"CCMSLIB00017244884","spectrum_index":19582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 84.0364 Da; putative annotation: N/A; putative formula: C8H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.18,"smiles":null,"spectrum_id":"CCMSLIB00017244886","spectrum_index":19583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 128.0594 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.13,"smiles":null,"spectrum_id":"CCMSLIB00017244889","spectrum_index":19584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 120.0941 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017244890","spectrum_index":19585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitelaidic acid (delta mass: 210.2358 Da; putative annotation: N/A; putative formula: C15H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.468,"smiles":null,"spectrum_id":"CCMSLIB00017244893","spectrum_index":19586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 161.086 Da; putative annotation: N/A; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.129,"smiles":null,"spectrum_id":"CCMSLIB00017244894","spectrum_index":19587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde (delta mass: 39.9484 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.992,"smiles":null,"spectrum_id":"CCMSLIB00017244897","spectrum_index":19588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethylpiperazine (delta mass: 57.059 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.182,"smiles":null,"spectrum_id":"CCMSLIB00017244899","spectrum_index":19589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-aspartic acid (delta mass: 118.0419 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017244901","spectrum_index":19590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 9.9683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.091,"smiles":null,"spectrum_id":"CCMSLIB00017244904","spectrum_index":19591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 159.068 Da; putative annotation: N/A; putative formula: C10H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.144,"smiles":null,"spectrum_id":"CCMSLIB00017244905","spectrum_index":19592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 361.2393 Da; putative annotation: N/A; putative formula: C19H32N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.508,"smiles":null,"spectrum_id":"CCMSLIB00017244908","spectrum_index":19593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 72.0574 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.123,"smiles":null,"spectrum_id":"CCMSLIB00017244909","spectrum_index":19594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.107,"smiles":null,"spectrum_id":"CCMSLIB00017244912","spectrum_index":19595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 173.105 Da; putative annotation: N/A; putative formula: C8H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.197,"smiles":null,"spectrum_id":"CCMSLIB00017244914","spectrum_index":19596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 17.0353 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.113,"smiles":null,"spectrum_id":"CCMSLIB00017244916","spectrum_index":19597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1012.8995 Da; putative annotation: N/A; putative formula: C60H120N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1235.0,"smiles":null,"spectrum_id":"CCMSLIB00017244918","spectrum_index":19598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-1-piperazinyl)acetic acid (delta mass: 37.0201 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.133,"smiles":null,"spectrum_id":"CCMSLIB00017244920","spectrum_index":19599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 214.1644 Da; putative annotation: N/A; putative formula: C7H18N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.245,"smiles":null,"spectrum_id":"CCMSLIB00017244923","spectrum_index":19600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipalmitolein (9c) (delta mass: 154.0026 Da; putative annotation: N/A; putative formula: C6H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.485,"smiles":null,"spectrum_id":"CCMSLIB00017244924","spectrum_index":19601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 3-amino-4-methoxyindole-2-carboxylate CollisionEnergy:102040 (delta mass: 32.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017244927","spectrum_index":19602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethylene glycol (delta mass: 88.0315 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017244929","spectrum_index":19603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 78.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.28,"smiles":null,"spectrum_id":"CCMSLIB00017244931","spectrum_index":19604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 319.2232 Da; putative annotation: N/A; putative formula: C14H25N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.45,"smiles":null,"spectrum_id":"CCMSLIB00017244934","spectrum_index":19605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 88.0525 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.118,"smiles":null,"spectrum_id":"CCMSLIB00017244935","spectrum_index":19606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 97.0066 Da; putative annotation: N/A; putative formula: C6H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.161,"smiles":null,"spectrum_id":"CCMSLIB00017244938","spectrum_index":19607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 15.8925 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.062,"smiles":null,"spectrum_id":"CCMSLIB00017244939","spectrum_index":19608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 60.0543 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.15,"smiles":null,"spectrum_id":"CCMSLIB00017244942","spectrum_index":19609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11-Eicosenoic acid (delta mass: 102.0837 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.378,"smiles":null,"spectrum_id":"CCMSLIB00017244944","spectrum_index":19610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethylpiperazine (delta mass: 55.03 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017244946","spectrum_index":19611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosteviol (delta mass: 114.0827 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.31,"smiles":null,"spectrum_id":"CCMSLIB00017244949","spectrum_index":19612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Hydroxytestosterone (delta mass: 78.0476 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.259,"smiles":null,"spectrum_id":"CCMSLIB00017244950","spectrum_index":19613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.107,"smiles":null,"spectrum_id":"CCMSLIB00017244952","spectrum_index":19614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viscic acid (delta mass: 87.1043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.268,"smiles":null,"spectrum_id":"CCMSLIB00017244954","spectrum_index":19615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.-ol-17-one (delta mass: 60.0356 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.252,"smiles":null,"spectrum_id":"CCMSLIB00017244957","spectrum_index":19616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 205.0768 Da; putative annotation: N/A; putative formula: C10H12N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.163,"smiles":null,"spectrum_id":"CCMSLIB00017244959","spectrum_index":19617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 14(Z)-Eicosenoic acid from NIST14 (delta mass: 84.0955 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.39,"smiles":null,"spectrum_id":"CCMSLIB00017244961","spectrum_index":19618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoleoylglycine (delta mass: 138.0888 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.358,"smiles":null,"spectrum_id":"CCMSLIB00017244964","spectrum_index":19619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 23.0135 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.142,"smiles":null,"spectrum_id":"CCMSLIB00017244965","spectrum_index":19620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid (delta mass: 60.0376 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.27,"smiles":null,"spectrum_id":"CCMSLIB00017244968","spectrum_index":19621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(R)-4-((3R,5R,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-6-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid\"\" (delta mass: 114.9941 Da; putative annotation: N/A; putative formula: C2H2N3OP)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.278,"smiles":null,"spectrum_id":"CCMSLIB00017244970","spectrum_index":19622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 48.0338 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.13,"smiles":null,"spectrum_id":"CCMSLIB00017244972","spectrum_index":19623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylimbricatolic acid (delta mass: 68.0632 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017244975","spectrum_index":19624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 357.1274 Da; putative annotation: N/A; putative formula: C15H24N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.208,"smiles":null,"spectrum_id":"CCMSLIB00017244976","spectrum_index":19625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-5-Phenylpent-2-enoic acid (delta mass: 293.0751 Da; putative annotation: N/A; putative formula: C13H16N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.166,"smiles":null,"spectrum_id":"CCMSLIB00017244979","spectrum_index":19626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 248.0535 Da; putative annotation: N/A; putative formula: C4H9N8O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.254,"smiles":null,"spectrum_id":"CCMSLIB00017244981","spectrum_index":19627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 138.1054 Da; putative annotation: N/A; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.153,"smiles":null,"spectrum_id":"CCMSLIB00017244983","spectrum_index":19628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19,20-Dihydroxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 86.0521 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.305,"smiles":null,"spectrum_id":"CCMSLIB00017244986","spectrum_index":19629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017244988","spectrum_index":19630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 225.1216 Da; putative annotation: N/A; putative formula: C9H15N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.186,"smiles":null,"spectrum_id":"CCMSLIB00017244990","spectrum_index":19631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.186,"smiles":null,"spectrum_id":"CCMSLIB00017244993","spectrum_index":19632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 232.9157 Da; putative annotation: N/A; putative formula: H2N3O6P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.2,"smiles":null,"spectrum_id":"CCMSLIB00017244995","spectrum_index":19633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phytomonic acid (delta mass: 45.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.336,"smiles":null,"spectrum_id":"CCMSLIB00017244997","spectrum_index":19634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid (delta mass: 214.193 Da; putative annotation: N/A; putative formula: C13H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.238,"smiles":null,"spectrum_id":"CCMSLIB00017245000","spectrum_index":19635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 237.2063 Da; putative annotation: N/A; putative formula: C11H23N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.522,"smiles":null,"spectrum_id":"CCMSLIB00017245002","spectrum_index":19636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12S-Hydroxy-5Z,8E,10E-heptadecatrienoic acid (delta mass: 193.0589 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.27,"smiles":null,"spectrum_id":"CCMSLIB00017245004","spectrum_index":19637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100215 alpha-Methyl-DL-serine|DL-2-Methylserine|2-Amino-3-hydroxy-2-methylpropanoic Acid|DL-2-Amino-3-hydroxy-2-methylpropionic Acid|DL-alpha-(Hydroxymethyl)alanine|alpha-Methylserine (delta mass: 101.0475 Da; putative annotation: Massbank:PR100294 L-Homoserine|Hse|HoSer|(S)-2-Amino-4-hydroxybutyric acid|2-Amino-4-hydroxybutanoic acid; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.113,"smiles":null,"spectrum_id":"CCMSLIB00017245007","spectrum_index":19638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 136.1266 Da; putative annotation: Chrysanthemyl alcohol; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.374,"smiles":null,"spectrum_id":"CCMSLIB00017245008","spectrum_index":19639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP004601 2-Hydroxyphenylacetic acid|2-(2-hydroxyphenyl)acetic acid (delta mass: 115.0265 Da; putative annotation: L-Aspartic acid; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.081,"smiles":null,"spectrum_id":"CCMSLIB00017245011","spectrum_index":19640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 242.1261 Da; putative annotation: Massbank:PR311045 Glutamylleucine; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.271,"smiles":null,"spectrum_id":"CCMSLIB00017245013","spectrum_index":19641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 111.0899 Da; putative annotation: Massbank:EA255001 Metformin|3-(diaminomethylene)-1,1-dimethyl-guanidine; putative formula: C4H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.187,"smiles":null,"spectrum_id":"CCMSLIB00017245015","spectrum_index":19642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 122.0734 Da; putative annotation: (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017245018","spectrum_index":19643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385960-01!methyl 4,6-dihydroxy-2,3-dimethylbenzoate (delta mass: 160.0525 Da; putative annotation: Massbank:NA001722 Coniferaldehyde; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017245019","spectrum_index":19644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 148.1252 Da; putative annotation: (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.498,"smiles":null,"spectrum_id":"CCMSLIB00017245022","spectrum_index":19645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-4-[(E)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 224.1441 Da; putative annotation: 2-Oct-7-enylpentanedioic acid; putative formula: C13H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.293,"smiles":null,"spectrum_id":"CCMSLIB00017245023","spectrum_index":19646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(R)-Hydroxydocosahexaenoic acid (delta mass: 343.2533 Da; putative annotation: Arachidonoylglycine; putative formula: C22H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.496,"smiles":null,"spectrum_id":"CCMSLIB00017245026","spectrum_index":19647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 328.1518 Da; putative annotation: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate; putative formula: C16H24O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.259,"smiles":null,"spectrum_id":"CCMSLIB00017245027","spectrum_index":19648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 111.0685 Da; putative annotation: N-Methyl-L-proline; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.144,"smiles":null,"spectrum_id":"CCMSLIB00017245030","spectrum_index":19649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 300.1887 Da; putative annotation: 9.alpha.-Fluoro-17,17-dimethyl-18-norandrostane-4,13-dien-11.beta.-ol-3-one; putative formula: C20H25FO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.4,"smiles":null,"spectrum_id":"CCMSLIB00017245031","spectrum_index":19650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 262.1567 Da; putative annotation: Brefeldin A; putative formula: C16H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.28,"smiles":null,"spectrum_id":"CCMSLIB00017245034","spectrum_index":19651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 386.1822 Da; putative annotation: Glu-Glu-Lys; putative formula: C16H26N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.263,"smiles":null,"spectrum_id":"CCMSLIB00017245035","spectrum_index":19652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E,8E)-9-[3a-hydroxy-6,7-dimethyl-1-(2-methylpropyl)-3-oxo-2,4,7,7a-tetrahydro-1H-isoindol-4-yl]-4,5-dihydroxy-8-methylnona-2,8-dienoate (delta mass: 138.089 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.374,"smiles":null,"spectrum_id":"CCMSLIB00017245038","spectrum_index":19653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 133.1139 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.257,"smiles":null,"spectrum_id":"CCMSLIB00017245039","spectrum_index":19654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid - 30.0 eV (delta mass: 276.11 Da; putative annotation: N/A; putative formula: C14H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.223,"smiles":null,"spectrum_id":"CCMSLIB00017245042","spectrum_index":19655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 192.0692 Da; putative annotation: N/A; putative formula: C13H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.15,"smiles":null,"spectrum_id":"CCMSLIB00017245043","spectrum_index":19656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 184.1308 Da; putative annotation: N/A; putative formula: C4H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.514,"smiles":null,"spectrum_id":"CCMSLIB00017245046","spectrum_index":19657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Keto-.beta.-boswellic acid (delta mass: 101.048 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.395,"smiles":null,"spectrum_id":"CCMSLIB00017245047","spectrum_index":19658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galanthamine (delta mass: 23.0116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.171,"smiles":null,"spectrum_id":"CCMSLIB00017245050","spectrum_index":19659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.341,"smiles":null,"spectrum_id":"CCMSLIB00017245051","spectrum_index":19660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 305.2584 Da; putative annotation: N/A; putative formula: C17H31N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.506,"smiles":null,"spectrum_id":"CCMSLIB00017245054","spectrum_index":19661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate (delta mass: 232.1105 Da; putative annotation: N/A; putative formula: C7H16N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.281,"smiles":null,"spectrum_id":"CCMSLIB00017245055","spectrum_index":19662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 318.2585 Da; putative annotation: N/A; putative formula: C20H35N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.496,"smiles":null,"spectrum_id":"CCMSLIB00017245058","spectrum_index":19663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 146.0734 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.17,"smiles":null,"spectrum_id":"CCMSLIB00017245059","spectrum_index":19664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-methoxybenzoic acid (delta mass: 64.0621 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.112,"smiles":null,"spectrum_id":"CCMSLIB00017245062","spectrum_index":19665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 107.9063 Da; putative annotation: N/A; putative formula: H-1OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.966,"smiles":null,"spectrum_id":"CCMSLIB00017245063","spectrum_index":19666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 177.1154 Da; putative annotation: N/A; putative formula: C11H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.222,"smiles":null,"spectrum_id":"CCMSLIB00017245066","spectrum_index":19667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Glutamic acid, dimethyl ester (delta mass: 118.0425 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.134,"smiles":null,"spectrum_id":"CCMSLIB00017245067","spectrum_index":19668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 70.078 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017245070","spectrum_index":19669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 203.1523 Da; putative annotation: N/A; putative formula: C10H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.244,"smiles":null,"spectrum_id":"CCMSLIB00017245071","spectrum_index":19670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 96.0572 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.237,"smiles":null,"spectrum_id":"CCMSLIB00017245074","spectrum_index":19671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 146.0466 Da; putative annotation: N/A; putative formula: C2H7N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.16,"smiles":null,"spectrum_id":"CCMSLIB00017245075","spectrum_index":19672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 66.0467 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017245078","spectrum_index":19673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017245079","spectrum_index":19674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 438.147 Da; putative annotation: N/A; putative formula: C21H30N2O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.234,"smiles":null,"spectrum_id":"CCMSLIB00017245082","spectrum_index":19675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 63.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.29,"smiles":null,"spectrum_id":"CCMSLIB00017245084","spectrum_index":19676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 341.3653 Da; putative annotation: N/A; putative formula: C18H43N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.436,"smiles":null,"spectrum_id":"CCMSLIB00017245086","spectrum_index":19677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 48.0357 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.236,"smiles":null,"spectrum_id":"CCMSLIB00017245089","spectrum_index":19678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1.alpha.,2.alpha.,3.beta.,5.Xi.,9.Xi.,13.Xi.,14.Xi.,18.Xi.)-1,2,3,22,23,29-Hexahydroxy-13,27-cycloolean-11-en-28-oic acid (delta mass: 183.0746 Da; putative annotation: N/A; putative formula: C6H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.401,"smiles":null,"spectrum_id":"CCMSLIB00017245091","spectrum_index":19679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE (delta mass: 8.0055 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017245093","spectrum_index":19680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 84.0203 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.117,"smiles":null,"spectrum_id":"CCMSLIB00017245096","spectrum_index":19681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.107,"smiles":null,"spectrum_id":"CCMSLIB00017245097","spectrum_index":19682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 74.0517 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.221,"smiles":null,"spectrum_id":"CCMSLIB00017245100","spectrum_index":19683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP021902 Biotin|5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid (delta mass: 132.0499 Da; putative annotation: N/A; putative formula: C9H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.145,"smiles":null,"spectrum_id":"CCMSLIB00017245102","spectrum_index":19684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM836501 Morpholine|Morpholin (delta mass: 31.9943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":120.07,"smiles":null,"spectrum_id":"CCMSLIB00017245104","spectrum_index":19685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 82.0783 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.221,"smiles":null,"spectrum_id":"CCMSLIB00017245106","spectrum_index":19686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 289.235 Da; putative annotation: N/A; putative formula: C10H27N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.462,"smiles":null,"spectrum_id":"CCMSLIB00017245108","spectrum_index":19687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 597.3146 Da; putative annotation: N/A; putative formula: C43H39N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.375,"smiles":null,"spectrum_id":"CCMSLIB00017245110","spectrum_index":19688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140306 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 59.0036 Da; putative annotation: N/A; putative formula: H2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017245112","spectrum_index":19689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 105.0425 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.218,"smiles":null,"spectrum_id":"CCMSLIB00017245115","spectrum_index":19690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 639.5091 Da; putative annotation: N/A; putative formula: C38H65N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":932.72,"smiles":null,"spectrum_id":"CCMSLIB00017245117","spectrum_index":19691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Adamantanol (delta mass: 74.0326 Da; putative annotation: N/A; putative formula: C2H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.16,"smiles":null,"spectrum_id":"CCMSLIB00017245119","spectrum_index":19692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hecogenin (delta mass: 150.0827 Da; putative annotation: N/A; putative formula: C13H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.398,"smiles":null,"spectrum_id":"CCMSLIB00017245121","spectrum_index":19693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylpiperazine (delta mass: 105.0313 Da; putative annotation: N/A; putative formula: C5H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.154,"smiles":null,"spectrum_id":"CCMSLIB00017245123","spectrum_index":19694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Docosatetraenoyl ethanolamide from NIST14 (delta mass: 90.066 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.34,"smiles":null,"spectrum_id":"CCMSLIB00017245125","spectrum_index":19695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 96.0207 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.107,"smiles":null,"spectrum_id":"CCMSLIB00017245127","spectrum_index":19696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 20.9999 Da; putative annotation: N/A; putative formula: C2H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.097,"smiles":null,"spectrum_id":"CCMSLIB00017245129","spectrum_index":19697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(1H-Indol-5-yl)ethanone (delta mass: 19.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.118,"smiles":null,"spectrum_id":"CCMSLIB00017245132","spectrum_index":19698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Amyrenonol (delta mass: 70.0422 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.415,"smiles":null,"spectrum_id":"CCMSLIB00017245133","spectrum_index":19699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[5-(7-Hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentoxy]-4-oxobutanoic acid (delta mass: 104.0996 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.394,"smiles":null,"spectrum_id":"CCMSLIB00017245136","spectrum_index":19700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 49.1623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.217,"smiles":null,"spectrum_id":"CCMSLIB00017245137","spectrum_index":19701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Erythrodiol (delta mass: 210.1961 Da; putative annotation: N/A; putative formula: C10H22N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.584,"smiles":null,"spectrum_id":"CCMSLIB00017245140","spectrum_index":19702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 19.9667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.031,"smiles":null,"spectrum_id":"CCMSLIB00017245143","spectrum_index":19703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 68.0465 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.258,"smiles":null,"spectrum_id":"CCMSLIB00017245144","spectrum_index":19704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 131.0949 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.222,"smiles":null,"spectrum_id":"CCMSLIB00017245147","spectrum_index":19705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 370.1272 Da; putative annotation: N/A; putative formula: C17H22O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.208,"smiles":null,"spectrum_id":"CCMSLIB00017245148","spectrum_index":19706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 56.9087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017245151","spectrum_index":19707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxaldehyde (delta mass: 59.04 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017245153","spectrum_index":19708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 98.1098 Da; putative annotation: N/A; putative formula: C7H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.295,"smiles":null,"spectrum_id":"CCMSLIB00017245155","spectrum_index":19709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 45.0583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.118,"smiles":null,"spectrum_id":"CCMSLIB00017245158","spectrum_index":19710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Elemadienonic acid (delta mass: 37.028 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.38,"smiles":null,"spectrum_id":"CCMSLIB00017245159","spectrum_index":19711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 144.0939 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017245162","spectrum_index":19712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 226.1327 Da; putative annotation: N/A; putative formula: C12H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.287,"smiles":null,"spectrum_id":"CCMSLIB00017245163","spectrum_index":19713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aureonitol (delta mass: 74.032 Da; putative annotation: N/A; putative formula: C2H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.17,"smiles":null,"spectrum_id":"CCMSLIB00017245166","spectrum_index":19714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa - 30.0 eV (delta mass: 46.1146 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.191,"smiles":null,"spectrum_id":"CCMSLIB00017245168","spectrum_index":19715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PIPERONYLIC ACID CollisionEnergy:102040 (delta mass: 40.0321 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.066,"smiles":null,"spectrum_id":"CCMSLIB00017245170","spectrum_index":19716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxy-4-methylbenzoic acid (delta mass: 60.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017245173","spectrum_index":19717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 206.0904 Da; putative annotation: N/A; putative formula: C7H14N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.214,"smiles":null,"spectrum_id":"CCMSLIB00017245174","spectrum_index":19718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid (delta mass: 123.0743 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017245176","spectrum_index":19719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 63.0343 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.11,"smiles":null,"spectrum_id":"CCMSLIB00017245178","spectrum_index":19720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 242.0391 Da; putative annotation: N/A; putative formula: C8H11N4OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.104,"smiles":null,"spectrum_id":"CCMSLIB00017245181","spectrum_index":19721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 27.0124 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.093,"smiles":null,"spectrum_id":"CCMSLIB00017245182","spectrum_index":19722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thymol (delta mass: 355.3452 Da; putative annotation: N/A; putative formula: C22H45NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.457,"smiles":null,"spectrum_id":"CCMSLIB00017245185","spectrum_index":19723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 193.0991 Da; putative annotation: N/A; putative formula: C5H15N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.217,"smiles":null,"spectrum_id":"CCMSLIB00017245186","spectrum_index":19724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 81.0212 Da; putative annotation: N/A; putative formula: C4H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.118,"smiles":null,"spectrum_id":"CCMSLIB00017245189","spectrum_index":19725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Chlorophenyl)-1H-pyrazol-5-amine (delta mass: 45.0521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.1,"smiles":null,"spectrum_id":"CCMSLIB00017245191","spectrum_index":19726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 57.0212 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017245193","spectrum_index":19727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methylbenzyl)pyrrolidine (delta mass: 17.9738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017245196","spectrum_index":19728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 97.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.134,"smiles":null,"spectrum_id":"CCMSLIB00017245198","spectrum_index":19729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 53.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.191,"smiles":null,"spectrum_id":"CCMSLIB00017245200","spectrum_index":19730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13,14-Dihydro-16,16-difluoroprostaglandin E1 (delta mass: 112.0692 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.314,"smiles":null,"spectrum_id":"CCMSLIB00017245203","spectrum_index":19731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 152.0975 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.325,"smiles":null,"spectrum_id":"CCMSLIB00017245204","spectrum_index":19732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 488.2047 Da; putative annotation: N/A; putative formula: C26H32O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.327,"smiles":null,"spectrum_id":"CCMSLIB00017245207","spectrum_index":19733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 320.0695 Da; putative annotation: N/A; putative formula: C19H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.198,"smiles":null,"spectrum_id":"CCMSLIB00017245209","spectrum_index":19734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4-ol (delta mass: 22.0039 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.065,"smiles":null,"spectrum_id":"CCMSLIB00017245211","spectrum_index":19735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 594.5576 Da; putative annotation: N/A; putative formula: C38H74O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":959.863,"smiles":null,"spectrum_id":"CCMSLIB00017245214","spectrum_index":19736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.154,"smiles":null,"spectrum_id":"CCMSLIB00017245215","spectrum_index":19737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 60.0453 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.086,"smiles":null,"spectrum_id":"CCMSLIB00017245218","spectrum_index":19738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 57.0645 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.13,"smiles":null,"spectrum_id":"CCMSLIB00017245219","spectrum_index":19739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 402.0958 Da; putative annotation: N/A; putative formula: C13H18N6O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.208,"smiles":null,"spectrum_id":"CCMSLIB00017245222","spectrum_index":19740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 30.0023 Da; putative annotation: N/A; putative formula: CH3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.13,"smiles":null,"spectrum_id":"CCMSLIB00017245223","spectrum_index":19741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 332.1599 Da; putative annotation: N/A; putative formula: C23H24S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.299,"smiles":null,"spectrum_id":"CCMSLIB00017245226","spectrum_index":19742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 150.0403 Da; putative annotation: N/A; putative formula: C3H2N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.081,"smiles":null,"spectrum_id":"CCMSLIB00017245227","spectrum_index":19743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 71.0004 Da; putative annotation: N/A; putative formula: C2HNO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.066,"smiles":null,"spectrum_id":"CCMSLIB00017245230","spectrum_index":19744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NEROLIDOL CollisionEnergy:205060 (delta mass: 45.025 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.231,"smiles":null,"spectrum_id":"CCMSLIB00017245232","spectrum_index":19745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ofloxacin N-oxide (delta mass: 18.0091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.155,"smiles":null,"spectrum_id":"CCMSLIB00017245234","spectrum_index":19746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatrienoic acid (delta mass: 16.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.326,"smiles":null,"spectrum_id":"CCMSLIB00017245237","spectrum_index":19747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE\"\" (delta mass: 60.0579 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.16,"smiles":null,"spectrum_id":"CCMSLIB00017245238","spectrum_index":19748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-oleoyl-sn-glycerol (delta mass: 192.109 Da; putative annotation: N/A; putative formula: C11H16N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":787.639,"smiles":null,"spectrum_id":"CCMSLIB00017245241","spectrum_index":19749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 147.0531 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.192,"smiles":null,"spectrum_id":"CCMSLIB00017245243","spectrum_index":19750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-Butylidene-6,7-dihydroxy-4,5,6,7-tetrahydro-2-benzofuran-1-one (delta mass: 197.09 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.202,"smiles":null,"spectrum_id":"CCMSLIB00017245245","spectrum_index":19751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 88.0151 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.056,"smiles":null,"spectrum_id":"CCMSLIB00017245248","spectrum_index":19752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 1.9998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.071,"smiles":null,"spectrum_id":"CCMSLIB00017245250","spectrum_index":19753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 74.0372 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.097,"smiles":null,"spectrum_id":"CCMSLIB00017245252","spectrum_index":19754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-11-Hydroxy-.DELTA.9-tetrahydrocannabinol (delta mass: 149.0683 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.295,"smiles":null,"spectrum_id":"CCMSLIB00017245255","spectrum_index":19755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 618.4112 Da; putative annotation: N/A; putative formula: C40H58O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.471,"smiles":null,"spectrum_id":"CCMSLIB00017245256","spectrum_index":19756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 926.4776 Da; putative annotation: N/A; putative formula: C49H70N2O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1107.55,"smiles":null,"spectrum_id":"CCMSLIB00017245259","spectrum_index":19757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 43.9867 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.334,"smiles":null,"spectrum_id":"CCMSLIB00017245260","spectrum_index":19758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 184.1239 Da; putative annotation: N/A; putative formula: C8H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.319,"smiles":null,"spectrum_id":"CCMSLIB00017245263","spectrum_index":19759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169594-02!8-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one (delta mass: 162.0529 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.176,"smiles":null,"spectrum_id":"CCMSLIB00017245265","spectrum_index":19760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 195.1273 Da; putative annotation: N/A; putative formula: C11H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.359,"smiles":null,"spectrum_id":"CCMSLIB00017245267","spectrum_index":19761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norharmane (delta mass: 58.1119 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.188,"smiles":null,"spectrum_id":"CCMSLIB00017245270","spectrum_index":19762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 118.2065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.254,"smiles":null,"spectrum_id":"CCMSLIB00017245271","spectrum_index":19763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 277.2949 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.306,"smiles":null,"spectrum_id":"CCMSLIB00017245274","spectrum_index":19764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 17.0149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017245275","spectrum_index":19765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 116.0625 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.191,"smiles":null,"spectrum_id":"CCMSLIB00017245278","spectrum_index":19766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 82.0783 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.425,"smiles":null,"spectrum_id":"CCMSLIB00017245279","spectrum_index":19767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of UNII-9K011NUF0R CollisionEnergy:205060 (delta mass: 245.2358 Da; putative annotation: N/A; putative formula: C10H27N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.338,"smiles":null,"spectrum_id":"CCMSLIB00017245282","spectrum_index":19768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.258,"smiles":null,"spectrum_id":"CCMSLIB00017245283","spectrum_index":19769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 114.084 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.306,"smiles":null,"spectrum_id":"CCMSLIB00017245286","spectrum_index":19770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017245289","spectrum_index":19771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 114.1069 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.234,"smiles":null,"spectrum_id":"CCMSLIB00017245290","spectrum_index":19772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 342.1147 Da; putative annotation: N/A; putative formula: C19H15N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.206,"smiles":null,"spectrum_id":"CCMSLIB00017245293","spectrum_index":19773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 42.0101 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.258,"smiles":null,"spectrum_id":"CCMSLIB00017245294","spectrum_index":19774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 32.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.294,"smiles":null,"spectrum_id":"CCMSLIB00017245297","spectrum_index":19775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 35.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.404,"smiles":null,"spectrum_id":"CCMSLIB00017245298","spectrum_index":19776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Di-.gamma.-linolenin (6c,9c,12c) from NIST14 (delta mass: 277.2883 Da; putative annotation: N/A; putative formula: C18H35N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.771,"smiles":null,"spectrum_id":"CCMSLIB00017245301","spectrum_index":19777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 60.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.103,"smiles":null,"spectrum_id":"CCMSLIB00017245302","spectrum_index":19778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 87.0676 Da; putative annotation: N/A; putative formula: C4H9NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.138,"smiles":null,"spectrum_id":"CCMSLIB00017245305","spectrum_index":19779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 56.4191 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.521,"smiles":null,"spectrum_id":"CCMSLIB00017245306","spectrum_index":19780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 86.0004 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.285,"smiles":null,"spectrum_id":"CCMSLIB00017245309","spectrum_index":19781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 90.0656 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.215,"smiles":null,"spectrum_id":"CCMSLIB00017245311","spectrum_index":19782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 62.006 Da; putative annotation: N/A; putative formula: H3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.28,"smiles":null,"spectrum_id":"CCMSLIB00017245313","spectrum_index":19783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxykaurenolide (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.222,"smiles":null,"spectrum_id":"CCMSLIB00017245316","spectrum_index":19784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)Semixanthomegnin (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.081,"smiles":null,"spectrum_id":"CCMSLIB00017245317","spectrum_index":19785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 172.0887 Da; putative annotation: N/A; putative formula: C12H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.164,"smiles":null,"spectrum_id":"CCMSLIB00017245319","spectrum_index":19786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.206,"smiles":null,"spectrum_id":"CCMSLIB00017245322","spectrum_index":19787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 44.9862 Da; putative annotation: N/A; putative formula: H-1NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.104,"smiles":null,"spectrum_id":"CCMSLIB00017245324","spectrum_index":19788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 422.1537 Da; putative annotation: N/A; putative formula: C16H26N2O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.261,"smiles":null,"spectrum_id":"CCMSLIB00017245326","spectrum_index":19789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 63.9661 Da; putative annotation: N/A; putative formula: H2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.048,"smiles":null,"spectrum_id":"CCMSLIB00017245328","spectrum_index":19790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.221,"smiles":null,"spectrum_id":"CCMSLIB00017245330","spectrum_index":19791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 84.0577 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.123,"smiles":null,"spectrum_id":"CCMSLIB00017245333","spectrum_index":19792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 294.1949 Da; putative annotation: N/A; putative formula: C16H26N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.25,"smiles":null,"spectrum_id":"CCMSLIB00017245335","spectrum_index":19793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2,5-Dihydroxyhexyl)oxolan-2-one (delta mass: 59.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.201,"smiles":null,"spectrum_id":"CCMSLIB00017245337","spectrum_index":19794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 41.0447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.171,"smiles":null,"spectrum_id":"CCMSLIB00017245339","spectrum_index":19795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 82.0534 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.104,"smiles":null,"spectrum_id":"CCMSLIB00017245341","spectrum_index":19796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-METHOXYSALICYLIC ACID (delta mass: 148.0162 Da; putative annotation: N/A; putative formula: C8H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.066,"smiles":null,"spectrum_id":"CCMSLIB00017245344","spectrum_index":19797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLIC ACID - 50.00 eV (delta mass: 110.0366 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.092,"smiles":null,"spectrum_id":"CCMSLIB00017245345","spectrum_index":19798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.144,"smiles":null,"spectrum_id":"CCMSLIB00017245348","spectrum_index":19799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 63.0325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.124,"smiles":null,"spectrum_id":"CCMSLIB00017245350","spectrum_index":19800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 43.0301 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.132,"smiles":null,"spectrum_id":"CCMSLIB00017245352","spectrum_index":19801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 590.251 Da; putative annotation: N/A; putative formula: C18H38N8O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":849.373,"smiles":null,"spectrum_id":"CCMSLIB00017245355","spectrum_index":19802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 11.9976 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.058,"smiles":null,"spectrum_id":"CCMSLIB00017245356","spectrum_index":19803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOIC ACID (delta mass: 62.0179 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.073,"smiles":null,"spectrum_id":"CCMSLIB00017245359","spectrum_index":19804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 16.9977 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.23,"smiles":null,"spectrum_id":"CCMSLIB00017245360","spectrum_index":19805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 44.0289 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.106,"smiles":null,"spectrum_id":"CCMSLIB00017245363","spectrum_index":19806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 58.0207 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.075,"smiles":null,"spectrum_id":"CCMSLIB00017245364","spectrum_index":19807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 97.0532 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.129,"smiles":null,"spectrum_id":"CCMSLIB00017245367","spectrum_index":19808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Felbinac (delta mass: 29.9984 Da; putative annotation: N/A; putative formula: CH3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.089,"smiles":null,"spectrum_id":"CCMSLIB00017245368","spectrum_index":19809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 118.0993 Da; putative annotation: N/A; putative formula: C2H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.143,"smiles":null,"spectrum_id":"CCMSLIB00017245371","spectrum_index":19810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 84.0657 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.204,"smiles":null,"spectrum_id":"CCMSLIB00017245372","spectrum_index":19811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 70.0783 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017245375","spectrum_index":19812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 26.9389 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.025,"smiles":null,"spectrum_id":"CCMSLIB00017245376","spectrum_index":19813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 85.0611 Da; putative annotation: N/A; putative formula: C3H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.22,"smiles":null,"spectrum_id":"CCMSLIB00017245379","spectrum_index":19814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)propanamide (delta mass: 61.0034 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.137,"smiles":null,"spectrum_id":"CCMSLIB00017245382","spectrum_index":19815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 40.0535 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.145,"smiles":null,"spectrum_id":"CCMSLIB00017245383","spectrum_index":19816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 54.9661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.042,"smiles":null,"spectrum_id":"CCMSLIB00017245385","spectrum_index":19817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 124.082 Da; putative annotation: N/A; putative formula: C8H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.158,"smiles":null,"spectrum_id":"CCMSLIB00017245387","spectrum_index":19818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 206.101 Da; putative annotation: N/A; putative formula: C8H19N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.177,"smiles":null,"spectrum_id":"CCMSLIB00017245390","spectrum_index":19819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 323.119 Da; putative annotation: N/A; putative formula: C16H21NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.195,"smiles":null,"spectrum_id":"CCMSLIB00017245392","spectrum_index":19820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-N-stearoylsphingosine (delta mass: 332.3403 Da; putative annotation: N/A; putative formula: C24H44)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.63,"smiles":null,"spectrum_id":"CCMSLIB00017245394","spectrum_index":19821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 26.7087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.789,"smiles":null,"spectrum_id":"CCMSLIB00017245396","spectrum_index":19822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 28.0032 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.09,"smiles":null,"spectrum_id":"CCMSLIB00017245399","spectrum_index":19823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 86.0304 Da; putative annotation: N/A; putative formula: C3H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.278,"smiles":null,"spectrum_id":"CCMSLIB00017245401","spectrum_index":19824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 74.0732 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.263,"smiles":null,"spectrum_id":"CCMSLIB00017245403","spectrum_index":19825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026901 5?-CHOLANIC ACID-3?-OL-6_7-DIONE (delta mass: 426.2977 Da; putative annotation: N/A; putative formula: C24H42O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":831.561,"smiles":null,"spectrum_id":"CCMSLIB00017245405","spectrum_index":19826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 13.9743 Da; putative annotation: N/A; putative formula: C11H14N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.222,"smiles":null,"spectrum_id":"CCMSLIB00017245407","spectrum_index":19827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 64.0673 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017245410","spectrum_index":19828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Poliumoside (delta mass: 324.0855 Da; putative annotation: N/A; putative formula: C16H20O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1095.36,"smiles":null,"spectrum_id":"CCMSLIB00017245412","spectrum_index":19829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Sitosterol (delta mass: 144.1303 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.524,"smiles":null,"spectrum_id":"CCMSLIB00017245414","spectrum_index":19830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 (delta mass: 38.0501 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.588,"smiles":null,"spectrum_id":"CCMSLIB00017245416","spectrum_index":19831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl-4-fluoroindole-2-carboxylate (delta mass: 23.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.098,"smiles":null,"spectrum_id":"CCMSLIB00017245418","spectrum_index":19832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 32.1167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017245421","spectrum_index":19833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 65.0626 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.186,"smiles":null,"spectrum_id":"CCMSLIB00017245422","spectrum_index":19834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (delta mass: 48.0371 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.238,"smiles":null,"spectrum_id":"CCMSLIB00017245425","spectrum_index":19835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 51.0475 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.124,"smiles":null,"spectrum_id":"CCMSLIB00017245426","spectrum_index":19836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.118,"smiles":null,"spectrum_id":"CCMSLIB00017245429","spectrum_index":19837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE\"\" (delta mass: 328.1543 Da; putative annotation: N/A; putative formula: C10H20N10OS)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.256,"smiles":null,"spectrum_id":"CCMSLIB00017245431","spectrum_index":19838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 1095.3703 Da; putative annotation: N/A; putative formula: C52H61N3O23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1317.47,"smiles":null,"spectrum_id":"CCMSLIB00017245433","spectrum_index":19839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 609.495 Da; putative annotation: N/A; putative formula: C36H67NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":964.779,"smiles":null,"spectrum_id":"CCMSLIB00017245436","spectrum_index":19840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4,5-Dihydroxy-3,4-bis(hydroxymethyl)-4a,8,8-trimethyl-5,6,7,8a-tetrahydro-1H-naphthalen-1-yl] hexanoate (delta mass: 86.0488 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.307,"smiles":null,"spectrum_id":"CCMSLIB00017245437","spectrum_index":19841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2'-deoxyadenosine (delta mass: 40.0321 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.152,"smiles":null,"spectrum_id":"CCMSLIB00017245440","spectrum_index":19842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 82.1508 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.31,"smiles":null,"spectrum_id":"CCMSLIB00017245441","spectrum_index":19843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 127.027 Da; putative annotation: N/A; putative formula: C5H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.108,"smiles":null,"spectrum_id":"CCMSLIB00017245444","spectrum_index":19844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-cis-Retinol (delta mass: 166.1203 Da; putative annotation: N/A; putative formula: C8H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.357,"smiles":null,"spectrum_id":"CCMSLIB00017245445","spectrum_index":19845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 355.2727 Da; putative annotation: N/A; putative formula: C15H34N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.343,"smiles":null,"spectrum_id":"CCMSLIB00017245448","spectrum_index":19846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 391.1529 Da; putative annotation: N/A; putative formula: C22H21N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.192,"smiles":null,"spectrum_id":"CCMSLIB00017245451","spectrum_index":19847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 228.1462 Da; putative annotation: N/A; putative formula: C13H25O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.233,"smiles":null,"spectrum_id":"CCMSLIB00017245452","spectrum_index":19848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 368.256 Da; putative annotation: N/A; putative formula: C21H36O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.316,"smiles":null,"spectrum_id":"CCMSLIB00017245455","spectrum_index":19849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 383.2676 Da; putative annotation: N/A; putative formula: C22H41NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.338,"smiles":null,"spectrum_id":"CCMSLIB00017245456","spectrum_index":19850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-4-[(E)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 340.1889 Da; putative annotation: N/A; putative formula: C18H28O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.337,"smiles":null,"spectrum_id":"CCMSLIB00017245459","spectrum_index":19851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxybenzenemethanol (delta mass: 281.0536 Da; putative annotation: N/A; putative formula: C12H11NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.129,"smiles":null,"spectrum_id":"CCMSLIB00017245461","spectrum_index":19852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 237.1582 Da; putative annotation: N/A; putative formula: C11H19N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.228,"smiles":null,"spectrum_id":"CCMSLIB00017245463","spectrum_index":19853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 66.0103 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.232,"smiles":null,"spectrum_id":"CCMSLIB00017245466","spectrum_index":19854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 178.0406 Da; putative annotation: N/A; putative formula: C7H15O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.147,"smiles":null,"spectrum_id":"CCMSLIB00017245467","spectrum_index":19855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 90.0709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.21,"smiles":null,"spectrum_id":"CCMSLIB00017245470","spectrum_index":19856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxopimara-8(14),15-dien-20-oic acid (delta mass: 51.0318 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.243,"smiles":null,"spectrum_id":"CCMSLIB00017245472","spectrum_index":19857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylputrescine; AIF; CE0; CorrDec (delta mass: 118.0422 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.16,"smiles":null,"spectrum_id":"CCMSLIB00017245474","spectrum_index":19858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 106.0785 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.384,"smiles":null,"spectrum_id":"CCMSLIB00017245477","spectrum_index":19859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 165.1362 Da; putative annotation: N/A; putative formula: C8H15N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017245478","spectrum_index":19860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 87.0315 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.091,"smiles":null,"spectrum_id":"CCMSLIB00017245481","spectrum_index":19861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 32.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.294,"smiles":null,"spectrum_id":"CCMSLIB00017245482","spectrum_index":19862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 113.0414 Da; putative annotation: N/A; putative formula: C4H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.132,"smiles":null,"spectrum_id":"CCMSLIB00017245485","spectrum_index":19863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 254.2254 Da; putative annotation: N/A; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.437,"smiles":null,"spectrum_id":"CCMSLIB00017245486","spectrum_index":19864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic JBIR 27 (delta mass: 98.0728 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017245489","spectrum_index":19865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-DIHYDROURACIL (delta mass: 75.0797 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.13,"smiles":null,"spectrum_id":"CCMSLIB00017245490","spectrum_index":19866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 147.9841 Da; putative annotation: N/A; putative formula: C5H8O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.065,"smiles":null,"spectrum_id":"CCMSLIB00017245493","spectrum_index":19867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 443.2153 Da; putative annotation: N/A; putative formula: C19H21N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.275,"smiles":null,"spectrum_id":"CCMSLIB00017245494","spectrum_index":19868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 95.0768 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.163,"smiles":null,"spectrum_id":"CCMSLIB00017245497","spectrum_index":19869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 233.1268 Da; putative annotation: N/A; putative formula: C11H23NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.198,"smiles":null,"spectrum_id":"CCMSLIB00017245498","spectrum_index":19870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Minoxidil from NIST14 (delta mass: 71.1355 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.27,"smiles":null,"spectrum_id":"CCMSLIB00017245501","spectrum_index":19871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 76.0677 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.191,"smiles":null,"spectrum_id":"CCMSLIB00017245502","spectrum_index":19872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 715.232 Da; putative annotation: N/A; putative formula: C37H41N5O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":878.292,"smiles":null,"spectrum_id":"CCMSLIB00017245505","spectrum_index":19873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 14,15-EE-(8Z)-E from NIST14 (delta mass: 180.0635 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.337,"smiles":null,"spectrum_id":"CCMSLIB00017245506","spectrum_index":19874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 22-(Acetyloxy)-16-hydroxyolean-12-en-3-yl 2-O-hexopyranosylhexopyranosiduronic acid (delta mass: 186.1345 Da; putative annotation: N/A; putative formula: C5H14N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1025.61,"smiles":null,"spectrum_id":"CCMSLIB00017245509","spectrum_index":19875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 206.0606 Da; putative annotation: N/A; putative formula: C10H11N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.297,"smiles":null,"spectrum_id":"CCMSLIB00017245510","spectrum_index":19876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecan-5-ol (delta mass: 76.0676 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.315,"smiles":null,"spectrum_id":"CCMSLIB00017245513","spectrum_index":19877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 176.1049 Da; putative annotation: N/A; putative formula: C8H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.17,"smiles":null,"spectrum_id":"CCMSLIB00017245514","spectrum_index":19878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.alpha.,9.Xi.)-3-Hydroxyolean-12-en-24-oic acid (delta mass: 160.1308 Da; putative annotation: N/A; putative formula: C6H16N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.498,"smiles":null,"spectrum_id":"CCMSLIB00017245517","spectrum_index":19879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 60.0359 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.284,"smiles":null,"spectrum_id":"CCMSLIB00017245518","spectrum_index":19880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 94.078 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.133,"smiles":null,"spectrum_id":"CCMSLIB00017245521","spectrum_index":19881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 36.0363 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.274,"smiles":null,"spectrum_id":"CCMSLIB00017245523","spectrum_index":19882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of butyrylhomoserine (delta mass: 29.9929 Da; putative annotation: N/A; putative formula: CH2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.1,"smiles":null,"spectrum_id":"CCMSLIB00017245525","spectrum_index":19883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 266.2519 Da; putative annotation: N/A; putative formula: C18H35O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.343,"smiles":null,"spectrum_id":"CCMSLIB00017245528","spectrum_index":19884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 106.916 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.019,"smiles":null,"spectrum_id":"CCMSLIB00017245529","spectrum_index":19885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 98.0361 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.111,"smiles":null,"spectrum_id":"CCMSLIB00017245532","spectrum_index":19886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 83.0401 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.095,"smiles":null,"spectrum_id":"CCMSLIB00017245533","spectrum_index":19887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 75.0561 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.132,"smiles":null,"spectrum_id":"CCMSLIB00017245536","spectrum_index":19888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 509.1619 Da; putative annotation: N/A; putative formula: C18H23N9O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.203,"smiles":null,"spectrum_id":"CCMSLIB00017245537","spectrum_index":19889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 441.1847 Da; putative annotation: N/A; putative formula: C17H31NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.375,"smiles":null,"spectrum_id":"CCMSLIB00017245539","spectrum_index":19890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxy-2,3-dihydropyran-6-one (delta mass: 70.0055 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.055,"smiles":null,"spectrum_id":"CCMSLIB00017245541","spectrum_index":19891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 316.2251 Da; putative annotation: N/A; putative formula: C17H32O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.291,"smiles":null,"spectrum_id":"CCMSLIB00017245543","spectrum_index":19892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 149.0683 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.134,"smiles":null,"spectrum_id":"CCMSLIB00017245546","spectrum_index":19893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 80.0106 Da; putative annotation: N/A; putative formula: C2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.086,"smiles":null,"spectrum_id":"CCMSLIB00017245547","spectrum_index":19894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 62.0162 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.18,"smiles":null,"spectrum_id":"CCMSLIB00017245550","spectrum_index":19895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 112.0672 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.315,"smiles":null,"spectrum_id":"CCMSLIB00017245552","spectrum_index":19896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 302.1879 Da; putative annotation: N/A; putative formula: C19H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.311,"smiles":null,"spectrum_id":"CCMSLIB00017245554","spectrum_index":19897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 148.056 Da; putative annotation: N/A; putative formula: C6H12O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.127,"smiles":null,"spectrum_id":"CCMSLIB00017245557","spectrum_index":19898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleana-1,9(11)-dien-28-oic acid, 2-cyano-3,12-dioxo- (delta mass: 80.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.38,"smiles":null,"spectrum_id":"CCMSLIB00017245558","spectrum_index":19899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 114.0461 Da; putative annotation: N/A; putative formula: C3H7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.117,"smiles":null,"spectrum_id":"CCMSLIB00017245561","spectrum_index":19900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Ethyl-2,4-dihydroxy-3-methylbenzaldehyde (delta mass: 125.0137 Da; putative annotation: N/A; putative formula: C4H4N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.1,"smiles":null,"spectrum_id":"CCMSLIB00017245562","spectrum_index":19901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 186.0891 Da; putative annotation: N/A; putative formula: C9H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.191,"smiles":null,"spectrum_id":"CCMSLIB00017245565","spectrum_index":19902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Homoeriodictyol from NIST14 (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.097,"smiles":null,"spectrum_id":"CCMSLIB00017245568","spectrum_index":19903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 40.0158 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.155,"smiles":null,"spectrum_id":"CCMSLIB00017245569","spectrum_index":19904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 134.1097 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.342,"smiles":null,"spectrum_id":"CCMSLIB00017245572","spectrum_index":19905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 68.0625 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.299,"smiles":null,"spectrum_id":"CCMSLIB00017245573","spectrum_index":19906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 102.0283 Da; putative annotation: N/A; putative formula: H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.12,"smiles":null,"spectrum_id":"CCMSLIB00017245576","spectrum_index":19907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 17.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.16,"smiles":null,"spectrum_id":"CCMSLIB00017245579","spectrum_index":19908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 163.029 Da; putative annotation: N/A; putative formula: C9HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.063,"smiles":null,"spectrum_id":"CCMSLIB00017245580","spectrum_index":19909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpent-2-enoic acid (delta mass: 104.0474 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.123,"smiles":null,"spectrum_id":"CCMSLIB00017245583","spectrum_index":19910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 46.0333 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.044,"smiles":null,"spectrum_id":"CCMSLIB00017245584","spectrum_index":19911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid (delta mass: 124.089 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.18,"smiles":null,"spectrum_id":"CCMSLIB00017245587","spectrum_index":19912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Glu (delta mass: 18.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017245589","spectrum_index":19913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Cholest-7-en-3.beta.-ol (delta mass: 267.2519 Da; putative annotation: N/A; putative formula: C13H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.614,"smiles":null,"spectrum_id":"CCMSLIB00017245591","spectrum_index":19914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 811.4692 Da; putative annotation: N/A; putative formula: C38H65N7O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.529,"smiles":null,"spectrum_id":"CCMSLIB00017245593","spectrum_index":19915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic JBIR 27 (delta mass: 96.0573 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.221,"smiles":null,"spectrum_id":"CCMSLIB00017245595","spectrum_index":19916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DESMOSTEROL CollisionEnergy:205060 (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.357,"smiles":null,"spectrum_id":"CCMSLIB00017245598","spectrum_index":19917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 118.0709 Da; putative annotation: N/A; putative formula: H6N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.35,"smiles":null,"spectrum_id":"CCMSLIB00017245599","spectrum_index":19918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 31.4243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017245602","spectrum_index":19919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 264.2396 Da; putative annotation: N/A; putative formula: C18H33O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.508,"smiles":null,"spectrum_id":"CCMSLIB00017245603","spectrum_index":19920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 71.0007 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.082,"smiles":null,"spectrum_id":"CCMSLIB00017245606","spectrum_index":19921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentanedioic acid, 2-hydroxy, 1,5-diethyl ester (delta mass: 50.0157 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.123,"smiles":null,"spectrum_id":"CCMSLIB00017245607","spectrum_index":19922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 18.0351 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.174,"smiles":null,"spectrum_id":"CCMSLIB00017245610","spectrum_index":19923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.beta.-Homophenylalanine (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017245612","spectrum_index":19924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 118.0782 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.341,"smiles":null,"spectrum_id":"CCMSLIB00017245614","spectrum_index":19925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 92.0217 Da; putative annotation: N/A; putative formula: CH4N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.092,"smiles":null,"spectrum_id":"CCMSLIB00017245617","spectrum_index":19926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 110.109 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.393,"smiles":null,"spectrum_id":"CCMSLIB00017245618","spectrum_index":19927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 156.0771 Da; putative annotation: N/A; putative formula: C4H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.163,"smiles":null,"spectrum_id":"CCMSLIB00017245621","spectrum_index":19928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 661.8443 Da; putative annotation: N/A; putative formula: C17H26O3S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1045.99,"smiles":null,"spectrum_id":"CCMSLIB00017245623","spectrum_index":19929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 1078.1701 Da; putative annotation: N/A; putative formula: C32H42N18O15S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1388.28,"smiles":null,"spectrum_id":"CCMSLIB00017245625","spectrum_index":19930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311135 Grossamide or its isomer (not validated) (delta mass: 624.2224 Da; putative annotation: N/A; putative formula: C35H44O2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1249.48,"smiles":null,"spectrum_id":"CCMSLIB00017245627","spectrum_index":19931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 827.5158 Da; putative annotation: N/A; putative formula: C51H73NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1049.61,"smiles":null,"spectrum_id":"CCMSLIB00017245629","spectrum_index":19932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 570.5798 Da; putative annotation: N/A; putative formula: C39H74N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":954.73,"smiles":null,"spectrum_id":"CCMSLIB00017245632","spectrum_index":19933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-tridecylpiperidine (delta mass: 238.2257 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.541,"smiles":null,"spectrum_id":"CCMSLIB00017245634","spectrum_index":19934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[2-(furan-3-yl)ethyl]-8-hydroxy-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid (delta mass: 43.014 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.22,"smiles":null,"spectrum_id":"CCMSLIB00017245636","spectrum_index":19935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 74.0439 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.183,"smiles":null,"spectrum_id":"CCMSLIB00017245638","spectrum_index":19936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 228.111 Da; putative annotation: N/A; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.213,"smiles":null,"spectrum_id":"CCMSLIB00017245640","spectrum_index":19937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 64.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.275,"smiles":null,"spectrum_id":"CCMSLIB00017245643","spectrum_index":19938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 352.2201 Da; putative annotation: N/A; putative formula: C12H24N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.28,"smiles":null,"spectrum_id":"CCMSLIB00017245644","spectrum_index":19939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 423.1578 Da; putative annotation: N/A; putative formula: C18H25N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.255,"smiles":null,"spectrum_id":"CCMSLIB00017245647","spectrum_index":19940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-hydroxybenzoate (delta mass: 32.0049 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.075,"smiles":null,"spectrum_id":"CCMSLIB00017245648","spectrum_index":19941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 403.1699 Da; putative annotation: N/A; putative formula: C25H26NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.261,"smiles":null,"spectrum_id":"CCMSLIB00017245650","spectrum_index":19942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 58.042 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.264,"smiles":null,"spectrum_id":"CCMSLIB00017245653","spectrum_index":19943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 292.2767 Da; putative annotation: N/A; putative formula: C20H36O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.394,"smiles":null,"spectrum_id":"CCMSLIB00017245655","spectrum_index":19944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 242.0639 Da; putative annotation: N/A; putative formula: C7H14O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.103,"smiles":null,"spectrum_id":"CCMSLIB00017245657","spectrum_index":19945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-2-methylpropiophenone (delta mass: 92.0451 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.136,"smiles":null,"spectrum_id":"CCMSLIB00017245659","spectrum_index":19946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 38.0141 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.236,"smiles":null,"spectrum_id":"CCMSLIB00017245661","spectrum_index":19947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 115.0635 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.214,"smiles":null,"spectrum_id":"CCMSLIB00017245664","spectrum_index":19948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 152.0987 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017245665","spectrum_index":19949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017245668","spectrum_index":19950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 198.1406 Da; putative annotation: N/A; putative formula: C15H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017245669","spectrum_index":19951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 1175.74 Da; putative annotation: N/A; putative formula: C70H101N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1313.83,"smiles":null,"spectrum_id":"CCMSLIB00017245672","spectrum_index":19952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 81.0791 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.275,"smiles":null,"spectrum_id":"CCMSLIB00017245673","spectrum_index":19953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 296.3079 Da; putative annotation: N/A; putative formula: C20H40O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.498,"smiles":null,"spectrum_id":"CCMSLIB00017245676","spectrum_index":19954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chaulmoogric Acid (delta mass: 18.0112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.259,"smiles":null,"spectrum_id":"CCMSLIB00017245677","spectrum_index":19955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 274.1787 Da; putative annotation: N/A; putative formula: C15H30S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.348,"smiles":null,"spectrum_id":"CCMSLIB00017245679","spectrum_index":19956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,18-Dihydroxykaurenolide (delta mass: 94.0752 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.281,"smiles":null,"spectrum_id":"CCMSLIB00017245681","spectrum_index":19957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 134.0731 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017245684","spectrum_index":19958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 50.0267 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.129,"smiles":null,"spectrum_id":"CCMSLIB00017245686","spectrum_index":19959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 144.0422 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.258,"smiles":null,"spectrum_id":"CCMSLIB00017245688","spectrum_index":19960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-3,4-dimethyl- (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.217,"smiles":null,"spectrum_id":"CCMSLIB00017245690","spectrum_index":19961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-fluoro-1H-indazole-3-carboxylate (delta mass: 134.0442 Da; putative annotation: N/A; putative formula: C2H6N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.101,"smiles":null,"spectrum_id":"CCMSLIB00017245693","spectrum_index":19962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 68.0602 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.163,"smiles":null,"spectrum_id":"CCMSLIB00017245694","spectrum_index":19963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 82.0784 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.326,"smiles":null,"spectrum_id":"CCMSLIB00017245697","spectrum_index":19964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 310.2147 Da; putative annotation: N/A; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.265,"smiles":null,"spectrum_id":"CCMSLIB00017245699","spectrum_index":19965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,17-Dihydroxy-7-kauranone (delta mass: 154.0629 Da; putative annotation: N/A; putative formula: C8H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.305,"smiles":null,"spectrum_id":"CCMSLIB00017245701","spectrum_index":19966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 22.035 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.09,"smiles":null,"spectrum_id":"CCMSLIB00017245704","spectrum_index":19967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 395.2522 Da; putative annotation: N/A; putative formula: C25H33NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.474,"smiles":null,"spectrum_id":"CCMSLIB00017245707","spectrum_index":19968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 17.1212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.28,"smiles":null,"spectrum_id":"CCMSLIB00017245708","spectrum_index":19969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,8-Dihydroxy-3-methylisocoumarin (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.055,"smiles":null,"spectrum_id":"CCMSLIB00017245711","spectrum_index":19970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 631.3326 Da; putative annotation: N/A; putative formula: C30H53N3O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":975.518,"smiles":null,"spectrum_id":"CCMSLIB00017245713","spectrum_index":19971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 59.0375 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.098,"smiles":null,"spectrum_id":"CCMSLIB00017245715","spectrum_index":19972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propyl-4-pentenoic acid (delta mass: 77.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.154,"smiles":null,"spectrum_id":"CCMSLIB00017245717","spectrum_index":19973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. ethylamide (delta mass: 38.015 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.31,"smiles":null,"spectrum_id":"CCMSLIB00017245719","spectrum_index":19974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 417.7424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.969,"smiles":null,"spectrum_id":"CCMSLIB00017245722","spectrum_index":19975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 9.9838 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.064,"smiles":null,"spectrum_id":"CCMSLIB00017245723","spectrum_index":19976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Epoxyeicosa-5(Z)-enoic acid (delta mass: 443.3611 Da; putative annotation: N/A; putative formula: C25H49NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.635,"smiles":null,"spectrum_id":"CCMSLIB00017245726","spectrum_index":19977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pergolide sulfoxide (delta mass: 64.9999 Da; putative annotation: N/A; putative formula: C2H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.184,"smiles":null,"spectrum_id":"CCMSLIB00017245727","spectrum_index":19978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carboxylic acid, ethyl ester (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.123,"smiles":null,"spectrum_id":"CCMSLIB00017245729","spectrum_index":19979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 11.3824 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017245732","spectrum_index":19980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 24.9841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.055,"smiles":null,"spectrum_id":"CCMSLIB00017245734","spectrum_index":19981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mononervonin (15c) (delta mass: 70.0788 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.473,"smiles":null,"spectrum_id":"CCMSLIB00017245736","spectrum_index":19982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylpiperazine (delta mass: 105.0788 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.202,"smiles":null,"spectrum_id":"CCMSLIB00017245738","spectrum_index":19983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 219.1103 Da; putative annotation: N/A; putative formula: C9H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.217,"smiles":null,"spectrum_id":"CCMSLIB00017245740","spectrum_index":19984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 278.2614 Da; putative annotation: N/A; putative formula: C19H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.368,"smiles":null,"spectrum_id":"CCMSLIB00017245743","spectrum_index":19985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 94.041 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.289,"smiles":null,"spectrum_id":"CCMSLIB00017245744","spectrum_index":19986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.133,"smiles":null,"spectrum_id":"CCMSLIB00017245747","spectrum_index":19987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 281.2722 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.457,"smiles":null,"spectrum_id":"CCMSLIB00017245748","spectrum_index":19988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 264.245 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.352,"smiles":null,"spectrum_id":"CCMSLIB00017245751","spectrum_index":19989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 280.0919 Da; putative annotation: N/A; putative formula: C10H12N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.152,"smiles":null,"spectrum_id":"CCMSLIB00017245752","spectrum_index":19990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-methoxybenzoic acid (delta mass: 53.0297 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.095,"smiles":null,"spectrum_id":"CCMSLIB00017245755","spectrum_index":19991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 58.0792 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.12,"smiles":null,"spectrum_id":"CCMSLIB00017245757","spectrum_index":19992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 59.1352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.232,"smiles":null,"spectrum_id":"CCMSLIB00017245759","spectrum_index":19993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 300.4913 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.619,"smiles":null,"spectrum_id":"CCMSLIB00017245762","spectrum_index":19994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 117.0429 Da; putative annotation: N/A; putative formula: C5H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.124,"smiles":null,"spectrum_id":"CCMSLIB00017245764","spectrum_index":19995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 22.9685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.071,"smiles":null,"spectrum_id":"CCMSLIB00017245766","spectrum_index":19996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 276.1365 Da; putative annotation: N/A; putative formula: C16H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.223,"smiles":null,"spectrum_id":"CCMSLIB00017245769","spectrum_index":19997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methylbenzoic acid (delta mass: 224.1161 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.171,"smiles":null,"spectrum_id":"CCMSLIB00017245771","spectrum_index":19998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,14,17-Eicosatrienoic acid, (Z,Z,Z)- (delta mass: 75.0405 Da; putative annotation: N/A; putative formula: CH5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.304,"smiles":null,"spectrum_id":"CCMSLIB00017245773","spectrum_index":19999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 60.0557 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.215,"smiles":null,"spectrum_id":"CCMSLIB00017245775","spectrum_index":20000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 230.0433 Da; putative annotation: N/A; putative formula: C2H10N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.228,"smiles":null,"spectrum_id":"CCMSLIB00017245777","spectrum_index":20001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 126.0771 Da; putative annotation: N/A; putative formula: C2H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.356,"smiles":null,"spectrum_id":"CCMSLIB00017245780","spectrum_index":20002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 90.0899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017245782","spectrum_index":20003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 82.0782 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.211,"smiles":null,"spectrum_id":"CCMSLIB00017245784","spectrum_index":20004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(hydroxymethyl)-4,9a-dimethyl-2,7,8,9-tetrahydro-1H-benzo[7]annulen-3-one (delta mass: 28.0316 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.196,"smiles":null,"spectrum_id":"CCMSLIB00017245786","spectrum_index":20005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 95.0735 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.18,"smiles":null,"spectrum_id":"CCMSLIB00017245788","spectrum_index":20006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 273.0784 Da; putative annotation: N/A; putative formula: C10H15N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.17,"smiles":null,"spectrum_id":"CCMSLIB00017245791","spectrum_index":20007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 311.1091 Da; putative annotation: N/A; putative formula: C17H17N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.15,"smiles":null,"spectrum_id":"CCMSLIB00017245793","spectrum_index":20008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 35.0326 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.124,"smiles":null,"spectrum_id":"CCMSLIB00017245795","spectrum_index":20009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 419.2514 Da; putative annotation: N/A; putative formula: C20H37NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.295,"smiles":null,"spectrum_id":"CCMSLIB00017245798","spectrum_index":20010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 229.0799 Da; putative annotation: N/A; putative formula: C9H16N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.265,"smiles":null,"spectrum_id":"CCMSLIB00017245799","spectrum_index":20011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; AIF; CE0; MS2Dec (delta mass: 136.0638 Da; putative annotation: Massbank:PR300431 Cyclo-prolylglycine; putative formula: C7H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.161,"smiles":null,"spectrum_id":"CCMSLIB00017245802","spectrum_index":20012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Seritranolides B (delta mass: 248.1409 Da; putative annotation: Verrucarol; putative formula: C15H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.3,"smiles":null,"spectrum_id":"CCMSLIB00017245804","spectrum_index":20013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 126.0317 Da; putative annotation: 3-(Methoxycarbonyl)but-3-enoic acid; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.107,"smiles":null,"spectrum_id":"CCMSLIB00017245806","spectrum_index":20014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 147.0691 Da; putative annotation: L-Phenylalanine; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.193,"smiles":null,"spectrum_id":"CCMSLIB00017245809","spectrum_index":20015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 264.2449 Da; putative annotation: cis-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.467,"smiles":null,"spectrum_id":"CCMSLIB00017245810","spectrum_index":20016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 204.1881 Da; putative annotation: (-)-Isolongifolol; putative formula: C15H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.394,"smiles":null,"spectrum_id":"CCMSLIB00017245813","spectrum_index":20017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14-Eicosatetraenoic acid (delta mass: 336.2659 Da; putative annotation: 2-Linoleoylglycerol; putative formula: C21H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.513,"smiles":null,"spectrum_id":"CCMSLIB00017245815","spectrum_index":20018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 324.1067 Da; putative annotation: .alpha.,.beta.-Trehalose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":991.336,"smiles":null,"spectrum_id":"CCMSLIB00017245817","spectrum_index":20019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde (delta mass: 168.0005 Da; putative annotation: (3-Chlorophenyl)(hydroxy)acetic acid; putative formula: C8H5ClO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.045,"smiles":null,"spectrum_id":"CCMSLIB00017245819","spectrum_index":20020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 332.2356 Da; putative annotation: Tetrahydrocorticosterone; putative formula: C21H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.468,"smiles":null,"spectrum_id":"CCMSLIB00017245821","spectrum_index":20021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 278.2562 Da; putative annotation: Phytomonic acid; putative formula: C19H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.786,"smiles":null,"spectrum_id":"CCMSLIB00017245824","spectrum_index":20022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 132.0943 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.316,"smiles":null,"spectrum_id":"CCMSLIB00017245826","spectrum_index":20023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lauryl diethanolamide (delta mass: 182.1669 Da; putative annotation: Dodecanoic acid; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.42,"smiles":null,"spectrum_id":"CCMSLIB00017245828","spectrum_index":20024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 314.2244 Da; putative annotation: .DELTA.2-Androstene-1.alpha.,17.beta.-diol acetate; putative formula: C21H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.461,"smiles":null,"spectrum_id":"CCMSLIB00017245831","spectrum_index":20025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:205060 (delta mass: 295.2513 Da; putative annotation: N-Palmitoylglycine; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.519,"smiles":null,"spectrum_id":"CCMSLIB00017245832","spectrum_index":20026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 112.0524 Da; putative annotation: 4-Methyl-2-oxovaleric acid; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017245835","spectrum_index":20027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Atenolol - 40.0 eV (delta mass: 264.1115 Da; putative annotation: Thr-Tyr; putative formula: C13H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.282,"smiles":null,"spectrum_id":"CCMSLIB00017245836","spectrum_index":20028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumenol (delta mass: 84.0573 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.227,"smiles":null,"spectrum_id":"CCMSLIB00017245839","spectrum_index":20029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017245842","spectrum_index":20030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 210.234 Da; putative annotation: N/A; putative formula: C15H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.321,"smiles":null,"spectrum_id":"CCMSLIB00017245843","spectrum_index":20031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy-4(15),11(13)-eudesmadien-12,6-olide (delta mass: 24.0362 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.185,"smiles":null,"spectrum_id":"CCMSLIB00017245845","spectrum_index":20032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 344.1102 Da; putative annotation: N/A; putative formula: C12H22N6P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.202,"smiles":null,"spectrum_id":"CCMSLIB00017245847","spectrum_index":20033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 436.9559 Da; putative annotation: N/A; putative formula: C10H-1N9O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.0,"smiles":null,"spectrum_id":"CCMSLIB00017245850","spectrum_index":20034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017245851","spectrum_index":20035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 318.1281 Da; putative annotation: N/A; putative formula: C20H19N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.36,"smiles":null,"spectrum_id":"CCMSLIB00017245854","spectrum_index":20036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Formestane (delta mass: 160.1078 Da; putative annotation: N/A; putative formula: C4H12N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.303,"smiles":null,"spectrum_id":"CCMSLIB00017245855","spectrum_index":20037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 16.9822 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.08,"smiles":null,"spectrum_id":"CCMSLIB00017245858","spectrum_index":20038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 78.0469 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017245859","spectrum_index":20039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Octadecanoyl-sn-glycero-3-phosphocholine from NIST14 (delta mass: 183.0613 Da; putative annotation: N/A; putative formula: C3H5N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.432,"smiles":null,"spectrum_id":"CCMSLIB00017245862","spectrum_index":20040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 113.0484 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.124,"smiles":null,"spectrum_id":"CCMSLIB00017245863","spectrum_index":20041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01043 Hexahydrocurcumin (delta mass: 197.0891 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.269,"smiles":null,"spectrum_id":"CCMSLIB00017245866","spectrum_index":20042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 2.0045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.055,"smiles":null,"spectrum_id":"CCMSLIB00017245867","spectrum_index":20043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 267.1586 Da; putative annotation: N/A; putative formula: C13H21N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.313,"smiles":null,"spectrum_id":"CCMSLIB00017245870","spectrum_index":20044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 246.9656 Da; putative annotation: N/A; putative formula: C4H11NO3P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.052,"smiles":null,"spectrum_id":"CCMSLIB00017245871","spectrum_index":20045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatetraenoyl ethanolamide (delta mass: 48.0438 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.365,"smiles":null,"spectrum_id":"CCMSLIB00017245874","spectrum_index":20046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 72.0689 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.119,"smiles":null,"spectrum_id":"CCMSLIB00017245875","spectrum_index":20047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017245878","spectrum_index":20048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORADRENALINE (delta mass: 23.9063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.988,"smiles":null,"spectrum_id":"CCMSLIB00017245879","spectrum_index":20049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 140.0142 Da; putative annotation: N/A; putative formula: C5H5N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.199,"smiles":null,"spectrum_id":"CCMSLIB00017245882","spectrum_index":20050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 49.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.264,"smiles":null,"spectrum_id":"CCMSLIB00017245883","spectrum_index":20051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 137.1057 Da; putative annotation: N/A; putative formula: C6H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.327,"smiles":null,"spectrum_id":"CCMSLIB00017245886","spectrum_index":20052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 465.221 Da; putative annotation: N/A; putative formula: C20H35NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.292,"smiles":null,"spectrum_id":"CCMSLIB00017245889","spectrum_index":20053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 595.3562 Da; putative annotation: N/A; putative formula: C41H45N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.427,"smiles":null,"spectrum_id":"CCMSLIB00017245890","spectrum_index":20054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)propanamide (delta mass: 60.0216 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.155,"smiles":null,"spectrum_id":"CCMSLIB00017245893","spectrum_index":20055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxy-7,9-dimethyl-1,3,4,4a,7,7a-hexahydrobenzo[e]naphthalene-2,8,11-trione (delta mass: 42.0468 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.175,"smiles":null,"spectrum_id":"CCMSLIB00017245894","spectrum_index":20056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381253-01_C22H29NO7_2H-Isoindole-2-acetic acid, 7-carboxy-1,3-dihydro-6-methoxy-5-methyl-4-[(3-methyl-2-buten-1-yl)oxy]-alpha-(1-methylpropyl)-1-oxo- (delta mass: 419.196 Da; putative annotation: N/A; putative formula: C23H25N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":839.398,"smiles":null,"spectrum_id":"CCMSLIB00017245897","spectrum_index":20057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 662.2602 Da; putative annotation: N/A; putative formula: C35H34N8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.32,"smiles":null,"spectrum_id":"CCMSLIB00017245899","spectrum_index":20058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 78.0178 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.182,"smiles":null,"spectrum_id":"CCMSLIB00017245901","spectrum_index":20059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 45.9245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.011,"smiles":null,"spectrum_id":"CCMSLIB00017245903","spectrum_index":20060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 186.125 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.212,"smiles":null,"spectrum_id":"CCMSLIB00017245906","spectrum_index":20061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(2-methoxybenzyl)ethanamine (delta mass: 121.063 Da; putative annotation: N/A; putative formula: H8N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.207,"smiles":null,"spectrum_id":"CCMSLIB00017245908","spectrum_index":20062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 87.1145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.227,"smiles":null,"spectrum_id":"CCMSLIB00017245910","spectrum_index":20063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 49.0067 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.104,"smiles":null,"spectrum_id":"CCMSLIB00017245911","spectrum_index":20064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 382.2924 Da; putative annotation: N/A; putative formula: C23H44P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.524,"smiles":null,"spectrum_id":"CCMSLIB00017245914","spectrum_index":20065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 126.0793 Da; putative annotation: N/A; putative formula: C6H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.416,"smiles":null,"spectrum_id":"CCMSLIB00017245916","spectrum_index":20066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 338.1024 Da; putative annotation: N/A; putative formula: C18H18N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.257,"smiles":null,"spectrum_id":"CCMSLIB00017245918","spectrum_index":20067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-acetyl-sn-glycerol (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.321,"smiles":null,"spectrum_id":"CCMSLIB00017245921","spectrum_index":20068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Oxo-5Z,8Z,11Z,13E-eicosatetraenoic acid (delta mass: 53.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.274,"smiles":null,"spectrum_id":"CCMSLIB00017245922","spectrum_index":20069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 106.0408 Da; putative annotation: N/A; putative formula: CH7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.122,"smiles":null,"spectrum_id":"CCMSLIB00017245925","spectrum_index":20070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpyrrole-2,4-dicarboxylic Acid (delta mass: 49.0024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.047,"smiles":null,"spectrum_id":"CCMSLIB00017245927","spectrum_index":20071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 143.0261 Da; putative annotation: N/A; putative formula: C3H5N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.086,"smiles":null,"spectrum_id":"CCMSLIB00017245929","spectrum_index":20072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydro-11-deoxycorticosterone (delta mass: 36.0371 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017245932","spectrum_index":20073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 78.0477 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.28,"smiles":null,"spectrum_id":"CCMSLIB00017245933","spectrum_index":20074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl hydrogen azelate (delta mass: 9.0456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.173,"smiles":null,"spectrum_id":"CCMSLIB00017245936","spectrum_index":20075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 53.0175 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.124,"smiles":null,"spectrum_id":"CCMSLIB00017245937","spectrum_index":20076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-[(cyclopropylcarbonyl)amino]benzoate (delta mass: 17.9738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.086,"smiles":null,"spectrum_id":"CCMSLIB00017245940","spectrum_index":20077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 234.1291 Da; putative annotation: N/A; putative formula: C11H22O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.242,"smiles":null,"spectrum_id":"CCMSLIB00017245941","spectrum_index":20078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 341.2832 Da; putative annotation: N/A; putative formula: C22H35N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.354,"smiles":null,"spectrum_id":"CCMSLIB00017245944","spectrum_index":20079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzocain (delta mass: 26.0137 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017245946","spectrum_index":20080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 177.0596 Da; putative annotation: N/A; putative formula: C5H13N3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.14,"smiles":null,"spectrum_id":"CCMSLIB00017245948","spectrum_index":20081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 144.0491 Da; putative annotation: N/A; putative formula: C10H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.188,"smiles":null,"spectrum_id":"CCMSLIB00017245951","spectrum_index":20082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aspochalasin D (delta mass: 94.0426 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.306,"smiles":null,"spectrum_id":"CCMSLIB00017245952","spectrum_index":20083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Hydroxyprogesterone (delta mass: 109.047 Da; putative annotation: N/A; putative formula: C6H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.274,"smiles":null,"spectrum_id":"CCMSLIB00017245955","spectrum_index":20084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Coumaryl alcohol (delta mass: 265.0776 Da; putative annotation: N/A; putative formula: C13H15NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.153,"smiles":null,"spectrum_id":"CCMSLIB00017245958","spectrum_index":20085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histidine methyl ester (delta mass: 84.0578 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.15,"smiles":null,"spectrum_id":"CCMSLIB00017245959","spectrum_index":20086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 35.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.316,"smiles":null,"spectrum_id":"CCMSLIB00017245962","spectrum_index":20087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 39.0601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.24,"smiles":null,"spectrum_id":"CCMSLIB00017245965","spectrum_index":20088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 183.0979 Da; putative annotation: N/A; putative formula: C4H9N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.215,"smiles":null,"spectrum_id":"CCMSLIB00017245966","spectrum_index":20089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Cyclohexanecarbonylpentadecylamine from NIST14 (delta mass: 43.9716 Da; putative annotation: N/A; putative formula: CS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.313,"smiles":null,"spectrum_id":"CCMSLIB00017245969","spectrum_index":20090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 55.9938 Da; putative annotation: N/A; putative formula: CHN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.075,"smiles":null,"spectrum_id":"CCMSLIB00017245970","spectrum_index":20091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Oxo-11Z,13E-eicosadienoic acid (delta mass: 28.0311 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.289,"smiles":null,"spectrum_id":"CCMSLIB00017245973","spectrum_index":20092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 10.0094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.112,"smiles":null,"spectrum_id":"CCMSLIB00017245975","spectrum_index":20093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 138.0318 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.379,"smiles":null,"spectrum_id":"CCMSLIB00017245977","spectrum_index":20094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-palmitoyl-D-erythro-sphinganine (delta mass: 163.0578 Da; putative annotation: N/A; putative formula: C6H14NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.593,"smiles":null,"spectrum_id":"CCMSLIB00017245980","spectrum_index":20095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384837-01_C19H32O2_14-(Hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0~1,10~.0~4,9~]hexadecan-5-ol (delta mass: 84.0208 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.268,"smiles":null,"spectrum_id":"CCMSLIB00017245981","spectrum_index":20096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 158.0921 Da; putative annotation: N/A; putative formula: C4H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.319,"smiles":null,"spectrum_id":"CCMSLIB00017245984","spectrum_index":20097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 312.0272 Da; putative annotation: N/A; putative formula: C9H16N2O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.265,"smiles":null,"spectrum_id":"CCMSLIB00017245986","spectrum_index":20098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzyl 3-piperidinylcarbamate (delta mass: 68.0696 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.214,"smiles":null,"spectrum_id":"CCMSLIB00017245988","spectrum_index":20099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methylbenzyl)pyrrolidine (delta mass: 46.0125 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.156,"smiles":null,"spectrum_id":"CCMSLIB00017245991","spectrum_index":20100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 392.1268 Da; putative annotation: N/A; putative formula: C24H24OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.208,"smiles":null,"spectrum_id":"CCMSLIB00017245993","spectrum_index":20101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 839.4536 Da; putative annotation: N/A; putative formula: C41H61N9O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1020.52,"smiles":null,"spectrum_id":"CCMSLIB00017245995","spectrum_index":20102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 161.0941 Da; putative annotation: N/A; putative formula: C9H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017245998","spectrum_index":20103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 60.039 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.24,"smiles":null,"spectrum_id":"CCMSLIB00017246000","spectrum_index":20104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Cyclodecadiene-1-methanol, .alpha.,.alpha.,4,8-tetramethyl- (delta mass: 103.0085 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.214,"smiles":null,"spectrum_id":"CCMSLIB00017246002","spectrum_index":20105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoylglycerol (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.31,"smiles":null,"spectrum_id":"CCMSLIB00017246005","spectrum_index":20106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 145.0532 Da; putative annotation: N/A; putative formula: C2H7N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.193,"smiles":null,"spectrum_id":"CCMSLIB00017246007","spectrum_index":20107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 4.4196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017246009","spectrum_index":20108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 593.3927 Da; putative annotation: N/A; putative formula: C33H55NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.463,"smiles":null,"spectrum_id":"CCMSLIB00017246011","spectrum_index":20109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 453.2257 Da; putative annotation: N/A; putative formula: C17H35N5O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":856.51,"smiles":null,"spectrum_id":"CCMSLIB00017246014","spectrum_index":20110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 357.3245 Da; putative annotation: N/A; putative formula: C21H43NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.64,"smiles":null,"spectrum_id":"CCMSLIB00017246016","spectrum_index":20111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidinol (delta mass: 148.015 Da; putative annotation: N/A; putative formula: C2H5N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.195,"smiles":null,"spectrum_id":"CCMSLIB00017246018","spectrum_index":20112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,13-Dihydrolactucin (delta mass: 35.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.159,"smiles":null,"spectrum_id":"CCMSLIB00017246020","spectrum_index":20113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,8-Dihydroxy-3-methylisocoumarin (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.065,"smiles":null,"spectrum_id":"CCMSLIB00017246022","spectrum_index":20114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,13.alpha.)-7-Oxopimara-8,15-dien-18-oic acid (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.226,"smiles":null,"spectrum_id":"CCMSLIB00017246025","spectrum_index":20115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 116.0534 Da; putative annotation: N/A; putative formula: C3H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.125,"smiles":null,"spectrum_id":"CCMSLIB00017246026","spectrum_index":20116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 81.0545 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.208,"smiles":null,"spectrum_id":"CCMSLIB00017246029","spectrum_index":20117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 144.0419 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.211,"smiles":null,"spectrum_id":"CCMSLIB00017246032","spectrum_index":20118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Chlorophenyl)-1H-pyrazol-5-amine (delta mass: 16.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.111,"smiles":null,"spectrum_id":"CCMSLIB00017246033","spectrum_index":20119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 300.0937 Da; putative annotation: N/A; putative formula: C24H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.134,"smiles":null,"spectrum_id":"CCMSLIB00017246036","spectrum_index":20120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 513.1465 Da; putative annotation: N/A; putative formula: C19H27N7O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.248,"smiles":null,"spectrum_id":"CCMSLIB00017246038","spectrum_index":20121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 320.1139 Da; putative annotation: N/A; putative formula: C12H21N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.216,"smiles":null,"spectrum_id":"CCMSLIB00017246040","spectrum_index":20122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 188.141 Da; putative annotation: N/A; putative formula: C10H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.254,"smiles":null,"spectrum_id":"CCMSLIB00017246043","spectrum_index":20123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 62.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017246044","spectrum_index":20124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 129.0459 Da; putative annotation: N/A; putative formula: C4H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.215,"smiles":null,"spectrum_id":"CCMSLIB00017246047","spectrum_index":20125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 301.2616 Da; putative annotation: N/A; putative formula: C17H35NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.322,"smiles":null,"spectrum_id":"CCMSLIB00017246048","spectrum_index":20126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 35.072 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.132,"smiles":null,"spectrum_id":"CCMSLIB00017246051","spectrum_index":20127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galanthamine hydrobromide (delta mass: 18.1444 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.23,"smiles":null,"spectrum_id":"CCMSLIB00017246053","spectrum_index":20128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 432.0902 Da; putative annotation: N/A; putative formula: C23H20N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.156,"smiles":null,"spectrum_id":"CCMSLIB00017246055","spectrum_index":20129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 387.2287 Da; putative annotation: N/A; putative formula: C18H34N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.299,"smiles":null,"spectrum_id":"CCMSLIB00017246057","spectrum_index":20130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 244.1674 Da; putative annotation: N/A; putative formula: C13H24O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.211,"smiles":null,"spectrum_id":"CCMSLIB00017246059","spectrum_index":20131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 275.0678 Da; putative annotation: N/A; putative formula: C10H18N3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.133,"smiles":null,"spectrum_id":"CCMSLIB00017246062","spectrum_index":20132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074904 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017246064","spectrum_index":20133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate (delta mass: 57.0683 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.16,"smiles":null,"spectrum_id":"CCMSLIB00017246066","spectrum_index":20134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1085.3642 Da; putative annotation: N/A; putative formula: C54H59N3O21)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1248.42,"smiles":null,"spectrum_id":"CCMSLIB00017246068","spectrum_index":20135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1110.3486 Da; putative annotation: N/A; putative formula: C43H66O33)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1273.41,"smiles":null,"spectrum_id":"CCMSLIB00017246070","spectrum_index":20136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 141.1033 Da; putative annotation: N/A; putative formula: C5H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.205,"smiles":null,"spectrum_id":"CCMSLIB00017246073","spectrum_index":20137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.378,"smiles":null,"spectrum_id":"CCMSLIB00017246074","spectrum_index":20138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 28.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.107,"smiles":null,"spectrum_id":"CCMSLIB00017246077","spectrum_index":20139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 69.0579 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.149,"smiles":null,"spectrum_id":"CCMSLIB00017246078","spectrum_index":20140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 80.0622 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.148,"smiles":null,"spectrum_id":"CCMSLIB00017246081","spectrum_index":20141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 83.0372 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.217,"smiles":null,"spectrum_id":"CCMSLIB00017246083","spectrum_index":20142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 97.0383 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.172,"smiles":null,"spectrum_id":"CCMSLIB00017246085","spectrum_index":20143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Pro-Lys from NIST14 (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.302,"smiles":null,"spectrum_id":"CCMSLIB00017246088","spectrum_index":20144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017246090","spectrum_index":20145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 84.0247 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.164,"smiles":null,"spectrum_id":"CCMSLIB00017246092","spectrum_index":20146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 161.0688 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.134,"smiles":null,"spectrum_id":"CCMSLIB00017246095","spectrum_index":20147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.113,"smiles":null,"spectrum_id":"CCMSLIB00017246097","spectrum_index":20148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.212,"smiles":null,"spectrum_id":"CCMSLIB00017246099","spectrum_index":20149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 14.0064 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.082,"smiles":null,"spectrum_id":"CCMSLIB00017246101","spectrum_index":20150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 82.0416 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.237,"smiles":null,"spectrum_id":"CCMSLIB00017246104","spectrum_index":20151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1.alpha.,2.alpha.,3.beta.,5.Xi.,9.Xi.,13.Xi.,14.Xi.,18.Xi.)-1,2,3,22,23,29-Hexahydroxy-13,27-cycloolean-11-en-28-oic acid (delta mass: 102.0918 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.418,"smiles":null,"spectrum_id":"CCMSLIB00017246106","spectrum_index":20152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetic acid methyl ester (delta mass: 154.1222 Da; putative annotation: N/A; putative formula: C7H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.485,"smiles":null,"spectrum_id":"CCMSLIB00017246108","spectrum_index":20153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 43.0427 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.192,"smiles":null,"spectrum_id":"CCMSLIB00017246110","spectrum_index":20154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 79.952 Da; putative annotation: N/A; putative formula: H3O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.199,"smiles":null,"spectrum_id":"CCMSLIB00017246113","spectrum_index":20155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 46.0741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.14,"smiles":null,"spectrum_id":"CCMSLIB00017246115","spectrum_index":20156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Methoxyphenyl)acetic acid (delta mass: 46.0207 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.091,"smiles":null,"spectrum_id":"CCMSLIB00017246117","spectrum_index":20157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C4:0 (delta mass: 78.047 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.254,"smiles":null,"spectrum_id":"CCMSLIB00017246119","spectrum_index":20158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 593.413 Da; putative annotation: N/A; putative formula: C35H55N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":887.692,"smiles":null,"spectrum_id":"CCMSLIB00017246121","spectrum_index":20159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 84.9983 Da; putative annotation: N/A; putative formula: C3H3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.058,"smiles":null,"spectrum_id":"CCMSLIB00017246123","spectrum_index":20160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 82.0781 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.159,"smiles":null,"spectrum_id":"CCMSLIB00017246126","spectrum_index":20161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 98.0737 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.197,"smiles":null,"spectrum_id":"CCMSLIB00017246127","spectrum_index":20162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 58.0418 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.159,"smiles":null,"spectrum_id":"CCMSLIB00017246130","spectrum_index":20163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 54.0313 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.211,"smiles":null,"spectrum_id":"CCMSLIB00017246132","spectrum_index":20164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 27.8796 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.96,"smiles":null,"spectrum_id":"CCMSLIB00017246134","spectrum_index":20165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 81.0793 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.171,"smiles":null,"spectrum_id":"CCMSLIB00017246137","spectrum_index":20166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 158.0368 Da; putative annotation: N/A; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.071,"smiles":null,"spectrum_id":"CCMSLIB00017246138","spectrum_index":20167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citromycetin (delta mass: 18.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.061,"smiles":null,"spectrum_id":"CCMSLIB00017246141","spectrum_index":20168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 205.1317 Da; putative annotation: N/A; putative formula: C9H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.223,"smiles":null,"spectrum_id":"CCMSLIB00017246142","spectrum_index":20169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of azelaic acid CollisionEnergy:205060 (delta mass: 110.146 Da; putative annotation: N/A; putative formula: C9H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.258,"smiles":null,"spectrum_id":"CCMSLIB00017246145","spectrum_index":20170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 101.0847 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.16,"smiles":null,"spectrum_id":"CCMSLIB00017246146","spectrum_index":20171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Deoxy-.DELTA.12,14-prostaglandin D2 (delta mass: 31.0424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.264,"smiles":null,"spectrum_id":"CCMSLIB00017246149","spectrum_index":20172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 114.0685 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.144,"smiles":null,"spectrum_id":"CCMSLIB00017246151","spectrum_index":20173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 92.0469 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017246153","spectrum_index":20174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 97.0524 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.118,"smiles":null,"spectrum_id":"CCMSLIB00017246156","spectrum_index":20175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 138.0312 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.102,"smiles":null,"spectrum_id":"CCMSLIB00017246157","spectrum_index":20176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyacetophenone (delta mass: 162.0676 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.127,"smiles":null,"spectrum_id":"CCMSLIB00017246160","spectrum_index":20177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006102 Tyramine|4-(2-aminoethyl)phenol (delta mass: 199.1052 Da; putative annotation: N/A; putative formula: C10H19NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.197,"smiles":null,"spectrum_id":"CCMSLIB00017246161","spectrum_index":20178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 85.079 Da; putative annotation: N/A; putative formula: C2H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.271,"smiles":null,"spectrum_id":"CCMSLIB00017246164","spectrum_index":20179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110101 Terbutaline|5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol (delta mass: 78.0319 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.176,"smiles":null,"spectrum_id":"CCMSLIB00017246166","spectrum_index":20180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 433.3033 Da; putative annotation: N/A; putative formula: C22H43NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.374,"smiles":null,"spectrum_id":"CCMSLIB00017246168","spectrum_index":20181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.07,"smiles":null,"spectrum_id":"CCMSLIB00017246170","spectrum_index":20182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzaldehyde (delta mass: 84.0566 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.111,"smiles":null,"spectrum_id":"CCMSLIB00017246172","spectrum_index":20183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Carboxybenzeneboronic acid (delta mass: 147.0262 Da; putative annotation: N/A; putative formula: C7H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.077,"smiles":null,"spectrum_id":"CCMSLIB00017246175","spectrum_index":20184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 75.0768 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.127,"smiles":null,"spectrum_id":"CCMSLIB00017246176","spectrum_index":20185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Met (delta mass: 132.0252 Da; putative annotation: N/A; putative formula: C5H10P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.142,"smiles":null,"spectrum_id":"CCMSLIB00017246179","spectrum_index":20186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acoric acid (delta mass: 35.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.212,"smiles":null,"spectrum_id":"CCMSLIB00017246181","spectrum_index":20187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cefotaxime (delta mass: 455.0566 Da; putative annotation: N/A; putative formula: C16H17N5O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.121,"smiles":null,"spectrum_id":"CCMSLIB00017246183","spectrum_index":20188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 29.0001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.102,"smiles":null,"spectrum_id":"CCMSLIB00017246186","spectrum_index":20189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 74.0771 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.121,"smiles":null,"spectrum_id":"CCMSLIB00017246187","spectrum_index":20190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 25.9796 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.082,"smiles":null,"spectrum_id":"CCMSLIB00017246190","spectrum_index":20191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 459.1369 Da; putative annotation: N/A; putative formula: C32H17N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.197,"smiles":null,"spectrum_id":"CCMSLIB00017246191","spectrum_index":20192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 410.1056 Da; putative annotation: N/A; putative formula: C28H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.155,"smiles":null,"spectrum_id":"CCMSLIB00017246194","spectrum_index":20193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 259.2857 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.549,"smiles":null,"spectrum_id":"CCMSLIB00017246196","spectrum_index":20194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melatonin (delta mass: 57.021 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.15,"smiles":null,"spectrum_id":"CCMSLIB00017246198","spectrum_index":20195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 61.0869 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.173,"smiles":null,"spectrum_id":"CCMSLIB00017246201","spectrum_index":20196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 50.0113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.061,"smiles":null,"spectrum_id":"CCMSLIB00017246202","spectrum_index":20197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 53.9717 Da; putative annotation: N/A; putative formula: C2H-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.183,"smiles":null,"spectrum_id":"CCMSLIB00017246205","spectrum_index":20198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 36.0359 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.258,"smiles":null,"spectrum_id":"CCMSLIB00017246206","spectrum_index":20199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380429-01_C17H22O4_3-(5,9-Dimethyl-4-oxo-8-oxatetracyclo[7.2.1.1~7,10~.0~1,6~]tridec-2-en-5-yl)propanoic acid (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017246209","spectrum_index":20200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 62.9841 Da; putative annotation: N/A; putative formula: H2NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.091,"smiles":null,"spectrum_id":"CCMSLIB00017246211","spectrum_index":20201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 29.0003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017246213","spectrum_index":20202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 109.0369 Da; putative annotation: N/A; putative formula: C6H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017246216","spectrum_index":20203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2-methylpyridine (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.097,"smiles":null,"spectrum_id":"CCMSLIB00017246217","spectrum_index":20204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Pyrimidin-2-yl)-1,4-diazepane (delta mass: 25.9867 Da; putative annotation: N/A; putative formula: H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.116,"smiles":null,"spectrum_id":"CCMSLIB00017246220","spectrum_index":20205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethoxybenzoic acid (delta mass: 50.0522 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.122,"smiles":null,"spectrum_id":"CCMSLIB00017246222","spectrum_index":20206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 588.4747 Da; putative annotation: N/A; putative formula: C37H64O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.701,"smiles":null,"spectrum_id":"CCMSLIB00017246224","spectrum_index":20207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 239.1011 Da; putative annotation: N/A; putative formula: C11H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.161,"smiles":null,"spectrum_id":"CCMSLIB00017246227","spectrum_index":20208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 205.0953 Da; putative annotation: N/A; putative formula: C8H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.182,"smiles":null,"spectrum_id":"CCMSLIB00017246229","spectrum_index":20209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 711.3192 Da; putative annotation: N/A; putative formula: C37H49N3O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.384,"smiles":null,"spectrum_id":"CCMSLIB00017246231","spectrum_index":20210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.134,"smiles":null,"spectrum_id":"CCMSLIB00017246233","spectrum_index":20211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Liquiritigenin (delta mass: 248.053 Da; putative annotation: N/A; putative formula: C9H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.134,"smiles":null,"spectrum_id":"CCMSLIB00017246236","spectrum_index":20212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid (delta mass: 32.0606 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.1,"smiles":null,"spectrum_id":"CCMSLIB00017246238","spectrum_index":20213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 96.9957 Da; putative annotation: N/A; putative formula: C7H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.28,"smiles":null,"spectrum_id":"CCMSLIB00017246240","spectrum_index":20214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 106.0819 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.35,"smiles":null,"spectrum_id":"CCMSLIB00017246243","spectrum_index":20215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Masticadienonic acid (delta mass: 344.0981 Da; putative annotation: N/A; putative formula: C13H12N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.45,"smiles":null,"spectrum_id":"CCMSLIB00017246245","spectrum_index":20216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14(15)-Epoxy-5Z,8Z,11Z,17Z-eicosatetraenoic acid (delta mass: 28.0309 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.258,"smiles":null,"spectrum_id":"CCMSLIB00017246247","spectrum_index":20217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 70.0382 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.165,"smiles":null,"spectrum_id":"CCMSLIB00017246248","spectrum_index":20218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12S-Hydroxy-5Z,8E,10E-heptadecatrienoic acid (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.263,"smiles":null,"spectrum_id":"CCMSLIB00017246251","spectrum_index":20219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 15.9949 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017246253","spectrum_index":20220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Piperazin-1-yl)ethanamine (delta mass: 172.1683 Da; putative annotation: N/A; putative formula: C8H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.302,"smiles":null,"spectrum_id":"CCMSLIB00017246255","spectrum_index":20221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 211.0838 Da; putative annotation: N/A; putative formula: C10H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.295,"smiles":null,"spectrum_id":"CCMSLIB00017246258","spectrum_index":20222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 86.0519 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.31,"smiles":null,"spectrum_id":"CCMSLIB00017246259","spectrum_index":20223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 66.0467 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.216,"smiles":null,"spectrum_id":"CCMSLIB00017246262","spectrum_index":20224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one (delta mass: 175.1211 Da; putative annotation: N/A; putative formula: C8H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.337,"smiles":null,"spectrum_id":"CCMSLIB00017246263","spectrum_index":20225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4,6-dihydroxy-2,3-dimethylbenzoate (delta mass: 74.0005 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017246266","spectrum_index":20226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid (delta mass: 43.0419 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017246268","spectrum_index":20227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Indolinone (delta mass: 28.9983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.058,"smiles":null,"spectrum_id":"CCMSLIB00017246270","spectrum_index":20228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 6.3504 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.5,"smiles":null,"spectrum_id":"CCMSLIB00017246273","spectrum_index":20229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N''-(4,6-Dimethyl-2-pyrimidinyl)-N-[2-(4-methoxyphenyl)ethyl]guanidine (delta mass: 17.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.207,"smiles":null,"spectrum_id":"CCMSLIB00017246274","spectrum_index":20230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 86.0359 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.096,"smiles":null,"spectrum_id":"CCMSLIB00017246277","spectrum_index":20231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 11.9994 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.247,"smiles":null,"spectrum_id":"CCMSLIB00017246279","spectrum_index":20232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 488.2145 Da; putative annotation: N/A; putative formula: C22H24N12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.306,"smiles":null,"spectrum_id":"CCMSLIB00017246281","spectrum_index":20233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxybenzoic acid (delta mass: 178.0986 Da; putative annotation: N/A; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.133,"smiles":null,"spectrum_id":"CCMSLIB00017246284","spectrum_index":20234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 260.2132 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.278,"smiles":null,"spectrum_id":"CCMSLIB00017246285","spectrum_index":20235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 289.2047 Da; putative annotation: N/A; putative formula: C18H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.27,"smiles":null,"spectrum_id":"CCMSLIB00017246288","spectrum_index":20236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 310.1027 Da; putative annotation: N/A; putative formula: C19H18O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.162,"smiles":null,"spectrum_id":"CCMSLIB00017246289","spectrum_index":20237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 41.0513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017246292","spectrum_index":20238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-nitro-N-(propan-2-yl)aniline (delta mass: 41.0354 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.123,"smiles":null,"spectrum_id":"CCMSLIB00017246293","spectrum_index":20239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetyl-5-hydroxy-3-methylphenyl .beta.-D-glucopyranoside (delta mass: 106.0416 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.165,"smiles":null,"spectrum_id":"CCMSLIB00017246296","spectrum_index":20240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HOMOGENTISATE (delta mass: 36.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.07,"smiles":null,"spectrum_id":"CCMSLIB00017246299","spectrum_index":20241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 575.3824 Da; putative annotation: N/A; putative formula: C33H53NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.443,"smiles":null,"spectrum_id":"CCMSLIB00017246300","spectrum_index":20242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 837.4874 Da; putative annotation: N/A; putative formula: C44H71NO14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1000.55,"smiles":null,"spectrum_id":"CCMSLIB00017246303","spectrum_index":20243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 370.0989 Da; putative annotation: N/A; putative formula: C19H18N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.174,"smiles":null,"spectrum_id":"CCMSLIB00017246305","spectrum_index":20244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 46.0087 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.079,"smiles":null,"spectrum_id":"CCMSLIB00017246307","spectrum_index":20245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 53.0028 Da; putative annotation: N/A; putative formula: CH-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.235,"smiles":null,"spectrum_id":"CCMSLIB00017246308","spectrum_index":20246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 791.3446 Da; putative annotation: N/A; putative formula: C55H45N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":998.431,"smiles":null,"spectrum_id":"CCMSLIB00017246311","spectrum_index":20247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,19-Dihydroxyurs-12-ene-23,28-dioic acid (delta mass: 323.1219 Da; putative annotation: N/A; putative formula: C15H22N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":826.459,"smiles":null,"spectrum_id":"CCMSLIB00017246313","spectrum_index":20248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Pregnane-3.alpha.,17-diol-20-one (delta mass: 92.0605 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.319,"smiles":null,"spectrum_id":"CCMSLIB00017246315","spectrum_index":20249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 319.3075 Da; putative annotation: N/A; putative formula: C19H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.42,"smiles":null,"spectrum_id":"CCMSLIB00017246318","spectrum_index":20250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 117.0286 Da; putative annotation: N/A; putative formula: CH3N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.068,"smiles":null,"spectrum_id":"CCMSLIB00017246319","spectrum_index":20251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 186.0781 Da; putative annotation: N/A; putative formula: C11H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.164,"smiles":null,"spectrum_id":"CCMSLIB00017246322","spectrum_index":20252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid (delta mass: 108.0581 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.411,"smiles":null,"spectrum_id":"CCMSLIB00017246323","spectrum_index":20253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 62.0517 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017246326","spectrum_index":20254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 88.0672 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.279,"smiles":null,"spectrum_id":"CCMSLIB00017246328","spectrum_index":20255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 47.0088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.069,"smiles":null,"spectrum_id":"CCMSLIB00017246330","spectrum_index":20256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 51.9914 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.151,"smiles":null,"spectrum_id":"CCMSLIB00017246333","spectrum_index":20257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Phenylethyl)-4-piperidinylamine (delta mass: 18.9563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.126,"smiles":null,"spectrum_id":"CCMSLIB00017246335","spectrum_index":20258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 56.0242 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.126,"smiles":null,"spectrum_id":"CCMSLIB00017246337","spectrum_index":20259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 43.042 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017246339","spectrum_index":20260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinidine 1'-oxide (delta mass: 45.1136 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.3,"smiles":null,"spectrum_id":"CCMSLIB00017246342","spectrum_index":20261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Iobitridol (delta mass: 60.0324 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.936,"smiles":null,"spectrum_id":"CCMSLIB00017246343","spectrum_index":20262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 413.1544 Da; putative annotation: N/A; putative formula: C26H24NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.225,"smiles":null,"spectrum_id":"CCMSLIB00017246346","spectrum_index":20263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 86.932 Da; putative annotation: N/A; putative formula: C27H42N8O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.013,"smiles":null,"spectrum_id":"CCMSLIB00017246348","spectrum_index":20264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Hydroxy-4Z,7Z,10Z,14E,16Z,19Z-docosahexaenoic acid (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.253,"smiles":null,"spectrum_id":"CCMSLIB00017246350","spectrum_index":20265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 143.0595 Da; putative annotation: N/A; putative formula: C7H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.177,"smiles":null,"spectrum_id":"CCMSLIB00017246353","spectrum_index":20266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 248.118 Da; putative annotation: N/A; putative formula: C13H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.256,"smiles":null,"spectrum_id":"CCMSLIB00017246354","spectrum_index":20267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 61.0243 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017246357","spectrum_index":20268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-amino-4-methylbenzoate (delta mass: 88.0151 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.101,"smiles":null,"spectrum_id":"CCMSLIB00017246358","spectrum_index":20269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP029401 DL-4-Hydroxyphenyllactic acid|2-hydroxy-2-(4-hydroxyphenyl)propanoic acid (delta mass: 57.0567 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.122,"smiles":null,"spectrum_id":"CCMSLIB00017246361","spectrum_index":20270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 61.0354 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.113,"smiles":null,"spectrum_id":"CCMSLIB00017246362","spectrum_index":20271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 480.2721 Da; putative annotation: N/A; putative formula: C26H40O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.343,"smiles":null,"spectrum_id":"CCMSLIB00017246365","spectrum_index":20272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 244.0229 Da; putative annotation: N/A; putative formula: C10H12O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.084,"smiles":null,"spectrum_id":"CCMSLIB00017246367","spectrum_index":20273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 32.97 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.134,"smiles":null,"spectrum_id":"CCMSLIB00017246369","spectrum_index":20274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 78.1185 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.21,"smiles":null,"spectrum_id":"CCMSLIB00017246372","spectrum_index":20275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 322.0854 Da; putative annotation: N/A; putative formula: C20H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.235,"smiles":null,"spectrum_id":"CCMSLIB00017246374","spectrum_index":20276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 471.2318 Da; putative annotation: N/A; putative formula: C25H29N9O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.302,"smiles":null,"spectrum_id":"CCMSLIB00017246376","spectrum_index":20277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,12.alpha.-Epidioxy-13(14)-abieten-18-oic acid (delta mass: 252.2091 Da; putative annotation: N/A; putative formula: C16H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.431,"smiles":null,"spectrum_id":"CCMSLIB00017246378","spectrum_index":20278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bulbocapnine (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.149,"smiles":null,"spectrum_id":"CCMSLIB00017246380","spectrum_index":20279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Amyrin (delta mass: 86.0578 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.451,"smiles":null,"spectrum_id":"CCMSLIB00017246382","spectrum_index":20280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 934.0284 Da; putative annotation: N/A; putative formula: C20H31N10O23P5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1156.13,"smiles":null,"spectrum_id":"CCMSLIB00017246384","spectrum_index":20281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-8,11,14-Eicosatrienoic acid from NIST14 (delta mass: 36.0218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.285,"smiles":null,"spectrum_id":"CCMSLIB00017246387","spectrum_index":20282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 88.0636 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.123,"smiles":null,"spectrum_id":"CCMSLIB00017246388","spectrum_index":20283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 58.0004 Da; putative annotation: N/A; putative formula: CH2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.076,"smiles":null,"spectrum_id":"CCMSLIB00017246391","spectrum_index":20284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU287201 Icaridin|butan-2-yl 2-(2-hydroxyethyl)piperidine-1-carboxylate (delta mass: 412.3392 Da; putative annotation: N/A; putative formula: C25H48O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.514,"smiles":null,"spectrum_id":"CCMSLIB00017246393","spectrum_index":20285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-imidazol-5-yl-2-[(4-methoxyphenyl)carbonylamino]propanoic acid CollisionEnergy:102040 (delta mass: 18.0179 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.131,"smiles":null,"spectrum_id":"CCMSLIB00017246395","spectrum_index":20286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sinapyl alcohol (delta mass: 74.0369 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017246398","spectrum_index":20287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methoxycoumarin-4-acetic acid (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.07,"smiles":null,"spectrum_id":"CCMSLIB00017246399","spectrum_index":20288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 260.2143 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.311,"smiles":null,"spectrum_id":"CCMSLIB00017246402","spectrum_index":20289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 202.1265 Da; putative annotation: N/A; putative formula: C14H19O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.348,"smiles":null,"spectrum_id":"CCMSLIB00017246403","spectrum_index":20290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 164.0883 Da; putative annotation: N/A; putative formula: C9H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.31,"smiles":null,"spectrum_id":"CCMSLIB00017246406","spectrum_index":20291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Putative (3-hydroxyheptadecanoyl)glycine (delta mass: 253.2405 Da; putative annotation: N/A; putative formula: C16H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.52,"smiles":null,"spectrum_id":"CCMSLIB00017246407","spectrum_index":20292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 463.1641 Da; putative annotation: N/A; putative formula: C20H37N3O-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.288,"smiles":null,"spectrum_id":"CCMSLIB00017246410","spectrum_index":20293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 382.1847 Da; putative annotation: N/A; putative formula: C17H34O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.245,"smiles":null,"spectrum_id":"CCMSLIB00017246411","spectrum_index":20294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-.beta.,2,5,5,8a-pentamethyl-3-oxo-, (8aS)- (delta mass: 118.0776 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017246414","spectrum_index":20295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-ethyl-4-methylhydroquinolin-2-one CollisionEnergy:205060 (delta mass: 27.0186 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.126,"smiles":null,"spectrum_id":"CCMSLIB00017246415","spectrum_index":20296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,17-diol, (3.alpha.,5.alpha.,17.beta.)- (delta mass: 106.045 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.293,"smiles":null,"spectrum_id":"CCMSLIB00017246418","spectrum_index":20297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxyethoxy)-5-(trifluoromethyl)aniline (delta mass: 18.0129 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017246420","spectrum_index":20298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 80.0715 Da; putative annotation: N/A; putative formula: C5H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017246422","spectrum_index":20299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017246425","spectrum_index":20300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 104.5387 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.61,"smiles":null,"spectrum_id":"CCMSLIB00017246426","spectrum_index":20301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Benzimidazol-2-one, 1-ethyl-1,3-dihydro- (delta mass: 120.0874 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.174,"smiles":null,"spectrum_id":"CCMSLIB00017246428","spectrum_index":20302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 44.0249 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.158,"smiles":null,"spectrum_id":"CCMSLIB00017246430","spectrum_index":20303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 1078.9858 Da; putative annotation: N/A; putative formula: C71H130O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1389.1,"smiles":null,"spectrum_id":"CCMSLIB00017246433","spectrum_index":20304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 661.8578 Da; putative annotation: N/A; putative formula: C17H26O3S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":971.971,"smiles":null,"spectrum_id":"CCMSLIB00017246434","spectrum_index":20305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 54.0483 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.27,"smiles":null,"spectrum_id":"CCMSLIB00017246437","spectrum_index":20306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 28.1043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.254,"smiles":null,"spectrum_id":"CCMSLIB00017246438","spectrum_index":20307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine; AIF; CE0; MS2Dec (delta mass: 139.0568 Da; putative annotation: N/A; putative formula: C6H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.153,"smiles":null,"spectrum_id":"CCMSLIB00017246441","spectrum_index":20308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Allyl 3-amino-1-piperidinecarboxylate (delta mass: 115.917 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.046,"smiles":null,"spectrum_id":"CCMSLIB00017246442","spectrum_index":20309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 88.0777 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.217,"smiles":null,"spectrum_id":"CCMSLIB00017246445","spectrum_index":20310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 63.9552 Da; putative annotation: N/A; putative formula: HPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.015,"smiles":null,"spectrum_id":"CCMSLIB00017246446","spectrum_index":20311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 39.9948 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.117,"smiles":null,"spectrum_id":"CCMSLIB00017246449","spectrum_index":20312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 30.9945 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017246450","spectrum_index":20313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 230.0948 Da; putative annotation: N/A; putative formula: C7H14N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.16,"smiles":null,"spectrum_id":"CCMSLIB00017246453","spectrum_index":20314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 132.8769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.957,"smiles":null,"spectrum_id":"CCMSLIB00017246454","spectrum_index":20315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid (delta mass: 95.0485 Da; putative annotation: N/A; putative formula: C4H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.188,"smiles":null,"spectrum_id":"CCMSLIB00017246457","spectrum_index":20316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aflatoxin M1 (delta mass: 92.0836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.149,"smiles":null,"spectrum_id":"CCMSLIB00017246458","spectrum_index":20317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ageratriol (delta mass: 158.021 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.201,"smiles":null,"spectrum_id":"CCMSLIB00017246461","spectrum_index":20318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arachidonoyl p-nitroaniline (delta mass: 106.0862 Da; putative annotation: N/A; putative formula: C7H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.366,"smiles":null,"spectrum_id":"CCMSLIB00017246463","spectrum_index":20319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxytestosterone (delta mass: 76.0306 Da; putative annotation: N/A; putative formula: H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.242,"smiles":null,"spectrum_id":"CCMSLIB00017246465","spectrum_index":20320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 204.2565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.358,"smiles":null,"spectrum_id":"CCMSLIB00017246468","spectrum_index":20321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 221.2355 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.338,"smiles":null,"spectrum_id":"CCMSLIB00017246469","spectrum_index":20322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxylimaprost (delta mass: 116.099 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.389,"smiles":null,"spectrum_id":"CCMSLIB00017246472","spectrum_index":20323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4b,8,8,10a-Tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl)acetic acid (delta mass: 111.0535 Da; putative annotation: N/A; putative formula: C3H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.317,"smiles":null,"spectrum_id":"CCMSLIB00017246474","spectrum_index":20324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 36.0363 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.389,"smiles":null,"spectrum_id":"CCMSLIB00017246476","spectrum_index":20325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S)-4-Amino-5-hydroxypentanoic acid (delta mass: 27.0108 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.092,"smiles":null,"spectrum_id":"CCMSLIB00017246479","spectrum_index":20326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 39.0555 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.126,"smiles":null,"spectrum_id":"CCMSLIB00017246480","spectrum_index":20327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 94.086 Da; putative annotation: N/A; putative formula: C6H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.185,"smiles":null,"spectrum_id":"CCMSLIB00017246483","spectrum_index":20328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to trans-EKODE-(E)-Ib from NIST14 (delta mass: 345.2486 Da; putative annotation: N/A; putative formula: C14H31N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.47,"smiles":null,"spectrum_id":"CCMSLIB00017246484","spectrum_index":20329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dexrazoxane (delta mass: 170.0658 Da; putative annotation: N/A; putative formula: C3H6N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.19,"smiles":null,"spectrum_id":"CCMSLIB00017246487","spectrum_index":20330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 459.281 Da; putative annotation: N/A; putative formula: C27H41NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.362,"smiles":null,"spectrum_id":"CCMSLIB00017246489","spectrum_index":20331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Furanacetic acid, tetrahydro-5-(2-hydroxybutyl)-.alpha.-methyl-, 1-[[5-(1-carboxyethyl)tetrahydro-2-furanyl]methyl]propyl ester (delta mass: 54.0472 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.316,"smiles":null,"spectrum_id":"CCMSLIB00017246491","spectrum_index":20332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 31.0054 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.065,"smiles":null,"spectrum_id":"CCMSLIB00017246492","spectrum_index":20333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 544.2853 Da; putative annotation: N/A; putative formula: C33H41N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.351,"smiles":null,"spectrum_id":"CCMSLIB00017246495","spectrum_index":20334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 215.1238 Da; putative annotation: N/A; putative formula: C5H13N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.263,"smiles":null,"spectrum_id":"CCMSLIB00017246496","spectrum_index":20335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 148.1256 Da; putative annotation: N/A; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.342,"smiles":null,"spectrum_id":"CCMSLIB00017246499","spectrum_index":20336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,17-diol, (3.alpha.,5.alpha.,17.beta.)- (delta mass: 52.0317 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.279,"smiles":null,"spectrum_id":"CCMSLIB00017246500","spectrum_index":20337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-5-(1,2,4a,5-Tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoic acid (delta mass: 102.0842 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.311,"smiles":null,"spectrum_id":"CCMSLIB00017246503","spectrum_index":20338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 39.0111 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.098,"smiles":null,"spectrum_id":"CCMSLIB00017246504","spectrum_index":20339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 68.0262 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.07,"smiles":null,"spectrum_id":"CCMSLIB00017246507","spectrum_index":20340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 249.1223 Da; putative annotation: N/A; putative formula: C11H23NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.193,"smiles":null,"spectrum_id":"CCMSLIB00017246508","spectrum_index":20341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hex-3-ynoic acid (delta mass: 25.9792 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.039,"smiles":null,"spectrum_id":"CCMSLIB00017246511","spectrum_index":20342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 174.1051 Da; putative annotation: N/A; putative formula: C5H14N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.228,"smiles":null,"spectrum_id":"CCMSLIB00017246514","spectrum_index":20343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adipic acid (delta mass: 267.2935 Da; putative annotation: N/A; putative formula: C18H37N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.359,"smiles":null,"spectrum_id":"CCMSLIB00017246515","spectrum_index":20344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 40.0306 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017246518","spectrum_index":20345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Val (delta mass: 97.9769 Da; putative annotation: N/A; putative formula: CH-1N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.095,"smiles":null,"spectrum_id":"CCMSLIB00017246519","spectrum_index":20346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 88.0528 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.155,"smiles":null,"spectrum_id":"CCMSLIB00017246522","spectrum_index":20347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.086,"smiles":null,"spectrum_id":"CCMSLIB00017246523","spectrum_index":20348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.,24(S)-Dihydroxy-4-cholesten-3-one (delta mass: 39.993 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.329,"smiles":null,"spectrum_id":"CCMSLIB00017246526","spectrum_index":20349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":130.049,"smiles":null,"spectrum_id":"CCMSLIB00017246529","spectrum_index":20350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 420.2486 Da; putative annotation: N/A; putative formula: C28H36OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":887.456,"smiles":null,"spectrum_id":"CCMSLIB00017246530","spectrum_index":20351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ancistrocladine (delta mass: 34.0434 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.26,"smiles":null,"spectrum_id":"CCMSLIB00017246533","spectrum_index":20352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 346.089 Da; putative annotation: N/A; putative formula: C19H14N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.16,"smiles":null,"spectrum_id":"CCMSLIB00017246534","spectrum_index":20353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.144,"smiles":null,"spectrum_id":"CCMSLIB00017246537","spectrum_index":20354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylcyclohexaneacetic acid (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.133,"smiles":null,"spectrum_id":"CCMSLIB00017246538","spectrum_index":20355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 819.5941 Da; putative annotation: N/A; putative formula: C42H77N9O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1204.76,"smiles":null,"spectrum_id":"CCMSLIB00017246541","spectrum_index":20356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.alpha.-Methyl-5.alpha.-androstan-3.alpha.,17.beta.-diol (delta mass: 821.6145 Da; putative annotation: N/A; putative formula: C47H79N7O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1128.88,"smiles":null,"spectrum_id":"CCMSLIB00017246543","spectrum_index":20357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 458.3637 Da; putative annotation: N/A; putative formula: C25H51N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.569,"smiles":null,"spectrum_id":"CCMSLIB00017246545","spectrum_index":20358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385097-01_C20H22O9_beta-D-Glucopyranoside, 4-hydroxy-2-(hydroxymethyl)phenyl, 6-benzoate (delta mass: 314.0388 Da; putative annotation: N/A; putative formula: C14H19PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.172,"smiles":null,"spectrum_id":"CCMSLIB00017246548","spectrum_index":20359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,,3S,5Z)-3-hydroxy-1,5-octadien-1-yl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5Z)- (delta mass: 643.3572 Da; putative annotation: N/A; putative formula: C38H45N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":992.594,"smiles":null,"spectrum_id":"CCMSLIB00017246549","spectrum_index":20360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 82.0878 Da; putative annotation: N/A; putative formula: C5H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":818.579,"smiles":null,"spectrum_id":"CCMSLIB00017246552","spectrum_index":20361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 48.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.155,"smiles":null,"spectrum_id":"CCMSLIB00017246554","spectrum_index":20362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosaminic acid (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.092,"smiles":null,"spectrum_id":"CCMSLIB00017246556","spectrum_index":20363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 310.2299 Da; putative annotation: N/A; putative formula: C22H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.283,"smiles":null,"spectrum_id":"CCMSLIB00017246558","spectrum_index":20364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 104.0637 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.145,"smiles":null,"spectrum_id":"CCMSLIB00017246560","spectrum_index":20365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 258.0731 Da; putative annotation: N/A; putative formula: C5H15N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.149,"smiles":null,"spectrum_id":"CCMSLIB00017246563","spectrum_index":20366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11-Dideoxy-9.alpha.,11.alpha.-epoxymethanoprosta-5E,13E-dien-1-oic acid (delta mass: 36.0354 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.288,"smiles":null,"spectrum_id":"CCMSLIB00017246564","spectrum_index":20367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 162.0523 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.118,"smiles":null,"spectrum_id":"CCMSLIB00017246567","spectrum_index":20368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 121.0864 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.225,"smiles":null,"spectrum_id":"CCMSLIB00017246568","spectrum_index":20369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.154,"smiles":null,"spectrum_id":"CCMSLIB00017246571","spectrum_index":20370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 329.1536 Da; putative annotation: N/A; putative formula: C14H19N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.25,"smiles":null,"spectrum_id":"CCMSLIB00017246573","spectrum_index":20371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 203.0218 Da; putative annotation: N/A; putative formula: C10H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.082,"smiles":null,"spectrum_id":"CCMSLIB00017246575","spectrum_index":20372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 114.0676 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.128,"smiles":null,"spectrum_id":"CCMSLIB00017246578","spectrum_index":20373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (delta mass: 35.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.17,"smiles":null,"spectrum_id":"CCMSLIB00017246579","spectrum_index":20374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of METHIONINE (delta mass: 57.0217 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.08,"smiles":null,"spectrum_id":"CCMSLIB00017246582","spectrum_index":20375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 103.009 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.08,"smiles":null,"spectrum_id":"CCMSLIB00017246584","spectrum_index":20376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 307.2864 Da; putative annotation: N/A; putative formula: C20H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.816,"smiles":null,"spectrum_id":"CCMSLIB00017246586","spectrum_index":20377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-pyrrolo[2,3-c]pyridin-5-yl- (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.108,"smiles":null,"spectrum_id":"CCMSLIB00017246589","spectrum_index":20378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 110.0522 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.081,"smiles":null,"spectrum_id":"CCMSLIB00017246590","spectrum_index":20379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((1S,3aR,4S,6S,7R,8aR)-1-Hydroxy-4,8a-dimethyloctahydro-1H-3a,6-epoxyazulen-7-yl)prop-2-enoic acid (delta mass: 51.9952 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017246593","spectrum_index":20380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 315.1323 Da; putative annotation: N/A; putative formula: C17H22N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.213,"smiles":null,"spectrum_id":"CCMSLIB00017246594","spectrum_index":20381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 54.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.092,"smiles":null,"spectrum_id":"CCMSLIB00017246597","spectrum_index":20382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acid from NIST14 (delta mass: 357.2913 Da; putative annotation: N/A; putative formula: C21H35N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.518,"smiles":null,"spectrum_id":"CCMSLIB00017246599","spectrum_index":20383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 264.2235 Da; putative annotation: N/A; putative formula: C21H28O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.424,"smiles":null,"spectrum_id":"CCMSLIB00017246601","spectrum_index":20384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 118.0784 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.3,"smiles":null,"spectrum_id":"CCMSLIB00017246603","spectrum_index":20385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 219.0143 Da; putative annotation: N/A; putative formula: C14H5NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.106,"smiles":null,"spectrum_id":"CCMSLIB00017246606","spectrum_index":20386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 265.1162 Da; putative annotation: N/A; putative formula: C10H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.207,"smiles":null,"spectrum_id":"CCMSLIB00017246608","spectrum_index":20387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 268.037 Da; putative annotation: Kaempferol; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.213,"smiles":null,"spectrum_id":"CCMSLIB00017246610","spectrum_index":20388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 200.1166 Da; putative annotation: Ser-Ile; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.25,"smiles":null,"spectrum_id":"CCMSLIB00017246613","spectrum_index":20389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of URIDINE-5-MONOPHOSPHATE (delta mass: 226.0591 Da; putative annotation: Uridine; putative formula: C9H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.102,"smiles":null,"spectrum_id":"CCMSLIB00017246614","spectrum_index":20390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 115.064 Da; putative annotation: N-Methyl-L-threonine; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.135,"smiles":null,"spectrum_id":"CCMSLIB00017246617","spectrum_index":20391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 294.2545 Da; putative annotation: Ricinoleic acid methyl ester; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.502,"smiles":null,"spectrum_id":"CCMSLIB00017246618","spectrum_index":20392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 288.2084 Da; putative annotation: Oxandrolone; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.332,"smiles":null,"spectrum_id":"CCMSLIB00017246621","spectrum_index":20393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid (delta mass: 296.2405 Da; putative annotation: NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.494,"smiles":null,"spectrum_id":"CCMSLIB00017246623","spectrum_index":20394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(hydroxymethyl)-4,9a-dimethyl-2,7,8,9-tetrahydro-1H-benzo[7]annulen-3-one (delta mass: 218.1669 Da; putative annotation: Curcumol; putative formula: C15H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.331,"smiles":null,"spectrum_id":"CCMSLIB00017246625","spectrum_index":20395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of 14,15-Dihydroxy-5Z,8Z,11Z-eicosatrienoic acid (delta mass: 164.0852 Da; putative annotation: \"\"(1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid CollisionEnergy:205060\"\"; putative formula: C10H12O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.338,"smiles":null,"spectrum_id":"CCMSLIB00017246627","spectrum_index":20396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 159.0678 Da; putative annotation: (5-Methoxy-1H-indol-2-yl)methanol; putative formula: C10H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.154,"smiles":null,"spectrum_id":"CCMSLIB00017246629","spectrum_index":20397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 210.1272 Da; putative annotation: 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.354,"smiles":null,"spectrum_id":"CCMSLIB00017246632","spectrum_index":20398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 118.0419 Da; putative annotation: 2-Hydroxyacetophenone; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.118,"smiles":null,"spectrum_id":"CCMSLIB00017246633","spectrum_index":20399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spirodionic acid (delta mass: 264.1373 Da; putative annotation: Dihydrophaseic acid; putative formula: C15H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.281,"smiles":null,"spectrum_id":"CCMSLIB00017246636","spectrum_index":20400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 146.058 Da; putative annotation: 2-DEOXY-D-GLUCOSE - 20.0 eV; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.097,"smiles":null,"spectrum_id":"CCMSLIB00017246638","spectrum_index":20401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 274.2278 Da; putative annotation: 14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecan-5-ol; putative formula: C19H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.47,"smiles":null,"spectrum_id":"CCMSLIB00017246640","spectrum_index":20402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 254.2249 Da; putative annotation: DL-.beta.-Hydroxypalmitic acid; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.436,"smiles":null,"spectrum_id":"CCMSLIB00017246643","spectrum_index":20403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 195.0911 Da; putative annotation: (-)-.alpha.-Kainic acid; putative formula: C10H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.193,"smiles":null,"spectrum_id":"CCMSLIB00017246645","spectrum_index":20404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipalmitolein (9c) (delta mass: 234.1996 Da; putative annotation: Palmitic acid alkyne; putative formula: C16H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.682,"smiles":null,"spectrum_id":"CCMSLIB00017246647","spectrum_index":20405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 84.0211 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.113,"smiles":null,"spectrum_id":"CCMSLIB00017246650","spectrum_index":20406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017246651","spectrum_index":20407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 126.0867 Da; putative annotation: N/A; putative formula: C8H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.162,"smiles":null,"spectrum_id":"CCMSLIB00017246654","spectrum_index":20408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 51.0307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.398,"smiles":null,"spectrum_id":"CCMSLIB00017246655","spectrum_index":20409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 72.042 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.128,"smiles":null,"spectrum_id":"CCMSLIB00017246658","spectrum_index":20410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Morpholinyl)-1-phenylethanol (delta mass: 55.0068 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.14,"smiles":null,"spectrum_id":"CCMSLIB00017246659","spectrum_index":20411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-((4R)-4-((5R,7R,8R,9S,10S,12S,13R,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid\"\" (delta mass: 513.2764 Da; putative annotation: N/A; putative formula: C26H43NO7S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1027.56,"smiles":null,"spectrum_id":"CCMSLIB00017246662","spectrum_index":20412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 166.0788 Da; putative annotation: N/A; putative formula: C13H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.155,"smiles":null,"spectrum_id":"CCMSLIB00017246664","spectrum_index":20413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 94.0083 Da; putative annotation: N/A; putative formula: C4H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.168,"smiles":null,"spectrum_id":"CCMSLIB00017246666","spectrum_index":20414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 74.0351 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.267,"smiles":null,"spectrum_id":"CCMSLIB00017246669","spectrum_index":20415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 307.0874 Da; putative annotation: N/A; putative formula: C17H14N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.237,"smiles":null,"spectrum_id":"CCMSLIB00017246670","spectrum_index":20416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 47.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017246673","spectrum_index":20417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxopentanoic acid (delta mass: 40.0315 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.086,"smiles":null,"spectrum_id":"CCMSLIB00017246676","spectrum_index":20418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 18.0092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.367,"smiles":null,"spectrum_id":"CCMSLIB00017246677","spectrum_index":20419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 238.1053 Da; putative annotation: N/A; putative formula: C9H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.384,"smiles":null,"spectrum_id":"CCMSLIB00017246680","spectrum_index":20420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 609.2358 Da; putative annotation: N/A; putative formula: C23H36N11O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.277,"smiles":null,"spectrum_id":"CCMSLIB00017246681","spectrum_index":20421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 149.927 Da; putative annotation: N/A; putative formula: C2O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.003,"smiles":null,"spectrum_id":"CCMSLIB00017246684","spectrum_index":20422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 84.0938 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.175,"smiles":null,"spectrum_id":"CCMSLIB00017246685","spectrum_index":20423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Hydroxyarachidonic acid (delta mass: 72.0321 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.275,"smiles":null,"spectrum_id":"CCMSLIB00017246688","spectrum_index":20424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 84.0208 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.081,"smiles":null,"spectrum_id":"CCMSLIB00017246689","spectrum_index":20425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 308.3529 Da; putative annotation: N/A; putative formula: C21H44N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.394,"smiles":null,"spectrum_id":"CCMSLIB00017246692","spectrum_index":20426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Deoxy-.DELTA.12,14-prostaglandin D2 (delta mass: 59.0738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.296,"smiles":null,"spectrum_id":"CCMSLIB00017246693","spectrum_index":20427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidinol (delta mass: 283.1779 Da; putative annotation: N/A; putative formula: C15H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.358,"smiles":null,"spectrum_id":"CCMSLIB00017246696","spectrum_index":20428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017246698","spectrum_index":20429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis,cis-9,12-Octadecadien-1-ol (delta mass: 52.0298 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.298,"smiles":null,"spectrum_id":"CCMSLIB00017246700","spectrum_index":20430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 80.0261 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.076,"smiles":null,"spectrum_id":"CCMSLIB00017246703","spectrum_index":20431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpyrrole-2,4-dicarboxylic Acid (delta mass: 141.0779 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.123,"smiles":null,"spectrum_id":"CCMSLIB00017246704","spectrum_index":20432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 799.4204 Da; putative annotation: N/A; putative formula: C42H57N9O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":980.491,"smiles":null,"spectrum_id":"CCMSLIB00017246707","spectrum_index":20433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,5-Piperazinedione, 3-[[1-(1,1-dimethyl-2-propen-1-yl)-1H-indol-3-yl]methyl]-6-[[2-(1,1-dimethyl-2-propen-1-yl)-1H-indol-3-yl]methyl]-, (3S,6S)_120157\"\" (delta mass: 1017.5541 Da; putative annotation: N/A; putative formula: C52H75N9O12)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1526.85,"smiles":null,"spectrum_id":"CCMSLIB00017246708","spectrum_index":20434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347423-03_C35H54O14_Card-20(22)-enolide, 3-[(2-O-hexopyranosylhexopyranosyl)oxy]-14-hydroxy-, (3beta,5alpha,9xi)- (delta mass: 698.3379 Da; putative annotation: N/A; putative formula: C32H50N4O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1397.7,"smiles":null,"spectrum_id":"CCMSLIB00017246711","spectrum_index":20435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169194-02_C25H28N4O4_3-[(2-Benzyl-9-hydroxy-3-oxo-2,3,9,9a-tetrahydro-1H-imidazo[1,2-a]indol-9-yl)methyl]-6-isopropyl-2,5-piperazinedione (delta mass: 448.2116 Da; putative annotation: N/A; putative formula: C26H32N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.43,"smiles":null,"spectrum_id":"CCMSLIB00017246714","spectrum_index":20436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 124.0631 Da; putative annotation: N/A; putative formula: C6H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017246715","spectrum_index":20437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9(10)-Epoxy-12Z-octadecenoic acid (delta mass: 77.0846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.327,"smiles":null,"spectrum_id":"CCMSLIB00017246718","spectrum_index":20438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 204.1507 Da; putative annotation: N/A; putative formula: C14H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.258,"smiles":null,"spectrum_id":"CCMSLIB00017246719","spectrum_index":20439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 156.079 Da; putative annotation: N/A; putative formula: C8H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.176,"smiles":null,"spectrum_id":"CCMSLIB00017246722","spectrum_index":20440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-Met (delta mass: 117.0386 Da; putative annotation: N/A; putative formula: H3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.16,"smiles":null,"spectrum_id":"CCMSLIB00017246725","spectrum_index":20441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetradecanedioic acid (delta mass: 62.0489 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.239,"smiles":null,"spectrum_id":"CCMSLIB00017246726","spectrum_index":20442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 144.0416 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.216,"smiles":null,"spectrum_id":"CCMSLIB00017246729","spectrum_index":20443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 66.0467 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.216,"smiles":null,"spectrum_id":"CCMSLIB00017246730","spectrum_index":20444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 72.0574 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.133,"smiles":null,"spectrum_id":"CCMSLIB00017246733","spectrum_index":20445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.294,"smiles":null,"spectrum_id":"CCMSLIB00017246735","spectrum_index":20446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylcatechol (delta mass: 9.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.096,"smiles":null,"spectrum_id":"CCMSLIB00017246737","spectrum_index":20447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzenemethanol, .alpha.-[(1R)-1-(methylamino)butyl]-, (.alpha.S)-rel- (delta mass: 90.0679 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.222,"smiles":null,"spectrum_id":"CCMSLIB00017246740","spectrum_index":20448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,,3S,5Z)-3-hydroxy-1,5-octadien-1-yl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5Z)- (delta mass: 435.2616 Da; putative annotation: N/A; putative formula: C24H37NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.499,"smiles":null,"spectrum_id":"CCMSLIB00017246741","spectrum_index":20449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxaldehyde (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.071,"smiles":null,"spectrum_id":"CCMSLIB00017246744","spectrum_index":20450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aspochalasin T (delta mass: 66.0474 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.306,"smiles":null,"spectrum_id":"CCMSLIB00017246745","spectrum_index":20451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-phenylpent-1-yn-3-ol (delta mass: 311.1678 Da; putative annotation: N/A; putative formula: C23H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.28,"smiles":null,"spectrum_id":"CCMSLIB00017246748","spectrum_index":20452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .gamma.-Muricholic acid (delta mass: 50.0515 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.346,"smiles":null,"spectrum_id":"CCMSLIB00017246749","spectrum_index":20453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Castanospermine (delta mass: 9.9842 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017246752","spectrum_index":20454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyphenylacetic acid (delta mass: 40.919 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.974,"smiles":null,"spectrum_id":"CCMSLIB00017246753","spectrum_index":20455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 28.0009 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.05,"smiles":null,"spectrum_id":"CCMSLIB00017246756","spectrum_index":20456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 72.0212 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.071,"smiles":null,"spectrum_id":"CCMSLIB00017246758","spectrum_index":20457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 477.4028 Da; putative annotation: N/A; putative formula: C23H47N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.5,"smiles":null,"spectrum_id":"CCMSLIB00017246760","spectrum_index":20458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 22.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.128,"smiles":null,"spectrum_id":"CCMSLIB00017246763","spectrum_index":20459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00524 m-Anisic-acid (delta mass: 10.0169 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.072,"smiles":null,"spectrum_id":"CCMSLIB00017246764","spectrum_index":20460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 74.0521 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.253,"smiles":null,"spectrum_id":"CCMSLIB00017246767","spectrum_index":20461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 35.0354 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.09,"smiles":null,"spectrum_id":"CCMSLIB00017246770","spectrum_index":20462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 148.0616 Da; putative annotation: N/A; putative formula: C4H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.139,"smiles":null,"spectrum_id":"CCMSLIB00017246771","spectrum_index":20463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxysebacic acid (delta mass: 94.1148 Da; putative annotation: N/A; putative formula: C8H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017246774","spectrum_index":20464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 616.5089 Da; putative annotation: N/A; putative formula: C38H69N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.736,"smiles":null,"spectrum_id":"CCMSLIB00017246775","spectrum_index":20465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 274.1678 Da; putative annotation: N/A; putative formula: C16H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.249,"smiles":null,"spectrum_id":"CCMSLIB00017246778","spectrum_index":20466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 102.031 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.164,"smiles":null,"spectrum_id":"CCMSLIB00017246781","spectrum_index":20467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyacetophenone (delta mass: 103.063 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.123,"smiles":null,"spectrum_id":"CCMSLIB00017246783","spectrum_index":20468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 86.0147 Da; putative annotation: N/A; putative formula: CH3N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.09,"smiles":null,"spectrum_id":"CCMSLIB00017246785","spectrum_index":20469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GUDCA - 40.0 eV (delta mass: 75.0319 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.353,"smiles":null,"spectrum_id":"CCMSLIB00017246787","spectrum_index":20470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperazineethanol (delta mass: 120.021 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.139,"smiles":null,"spectrum_id":"CCMSLIB00017246789","spectrum_index":20471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 56.073 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.144,"smiles":null,"spectrum_id":"CCMSLIB00017246792","spectrum_index":20472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 23.1147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.087,"smiles":null,"spectrum_id":"CCMSLIB00017246794","spectrum_index":20473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.113,"smiles":null,"spectrum_id":"CCMSLIB00017246796","spectrum_index":20474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 541.1668 Da; putative annotation: N/A; putative formula: C22H23N9O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.208,"smiles":null,"spectrum_id":"CCMSLIB00017246799","spectrum_index":20475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 518.1994 Da; putative annotation: N/A; putative formula: C36H26N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.281,"smiles":null,"spectrum_id":"CCMSLIB00017246801","spectrum_index":20476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dichloro-1H-indole-2-carboxylic acid (delta mass: 14.0239 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.001,"smiles":null,"spectrum_id":"CCMSLIB00017246804","spectrum_index":20477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 140.0477 Da; putative annotation: N/A; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.176,"smiles":null,"spectrum_id":"CCMSLIB00017246806","spectrum_index":20478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 96.0238 Da; putative annotation: N/A; putative formula: C4H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.24,"smiles":null,"spectrum_id":"CCMSLIB00017246808","spectrum_index":20479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 112.0683 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.253,"smiles":null,"spectrum_id":"CCMSLIB00017246811","spectrum_index":20480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 9.046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.143,"smiles":null,"spectrum_id":"CCMSLIB00017246813","spectrum_index":20481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.284,"smiles":null,"spectrum_id":"CCMSLIB00017246815","spectrum_index":20482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 182.1671 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.285,"smiles":null,"spectrum_id":"CCMSLIB00017246818","spectrum_index":20483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Mononervonin (15c) from NIST14 (delta mass: 188.1638 Da; putative annotation: N/A; putative formula: C8H20N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.558,"smiles":null,"spectrum_id":"CCMSLIB00017246819","spectrum_index":20484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 171.1229 Da; putative annotation: N/A; putative formula: C5H13N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.246,"smiles":null,"spectrum_id":"CCMSLIB00017246822","spectrum_index":20485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE0; MS2Dec (delta mass: 237.1111 Da; putative annotation: N/A; putative formula: C11H15N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.187,"smiles":null,"spectrum_id":"CCMSLIB00017246823","spectrum_index":20486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexaethylene glycol (delta mass: 132.0792 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.254,"smiles":null,"spectrum_id":"CCMSLIB00017246826","spectrum_index":20487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)(3-fluorophenyl)amine (delta mass: 140.1649 Da; putative annotation: N/A; putative formula: C9H20N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.295,"smiles":null,"spectrum_id":"CCMSLIB00017246828","spectrum_index":20488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-((Diethoxyphosphoryl)methyl)benzoic acid (delta mass: 108.0662 Da; putative annotation: N/A; putative formula: C6H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.155,"smiles":null,"spectrum_id":"CCMSLIB00017246831","spectrum_index":20489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zizanoic acid (delta mass: 46.0052 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.174,"smiles":null,"spectrum_id":"CCMSLIB00017246833","spectrum_index":20490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 130.0595 Da; putative annotation: N/A; putative formula: C2H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.161,"smiles":null,"spectrum_id":"CCMSLIB00017246835","spectrum_index":20491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 35.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.268,"smiles":null,"spectrum_id":"CCMSLIB00017246837","spectrum_index":20492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 483.3914 Da; putative annotation: N/A; putative formula: C25H45N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.462,"smiles":null,"spectrum_id":"CCMSLIB00017246839","spectrum_index":20493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.159,"smiles":null,"spectrum_id":"CCMSLIB00017246841","spectrum_index":20494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Undecaethylene glycol from NIST14 (delta mass: 371.3395 Da; putative annotation: N/A; putative formula: C22H45NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.646,"smiles":null,"spectrum_id":"CCMSLIB00017246844","spectrum_index":20495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5S)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one (delta mass: 17.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.148,"smiles":null,"spectrum_id":"CCMSLIB00017246845","spectrum_index":20496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 354.0224 Da; putative annotation: N/A; putative formula: C14H10O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.061,"smiles":null,"spectrum_id":"CCMSLIB00017246848","spectrum_index":20497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxy-16-methoxyoctadeca-9,12-dienoic acid (delta mass: 114.0825 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017246849","spectrum_index":20498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 206.2144 Da; putative annotation: N/A; putative formula: C14H26N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.285,"smiles":null,"spectrum_id":"CCMSLIB00017246852","spectrum_index":20499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,3-Difluoroazetidin-1-yl)piperidine (delta mass: 36.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.147,"smiles":null,"spectrum_id":"CCMSLIB00017246854","spectrum_index":20500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.237,"smiles":null,"spectrum_id":"CCMSLIB00017246856","spectrum_index":20501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid (delta mass: 103.0273 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.066,"smiles":null,"spectrum_id":"CCMSLIB00017246858","spectrum_index":20502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 80.0629 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.332,"smiles":null,"spectrum_id":"CCMSLIB00017246861","spectrum_index":20503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 101.0845 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.171,"smiles":null,"spectrum_id":"CCMSLIB00017246863","spectrum_index":20504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 197.0898 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.16,"smiles":null,"spectrum_id":"CCMSLIB00017246865","spectrum_index":20505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonoylglycerol (delta mass: 80.0637 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.348,"smiles":null,"spectrum_id":"CCMSLIB00017246867","spectrum_index":20506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufalin (delta mass: 76.0692 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.322,"smiles":null,"spectrum_id":"CCMSLIB00017246870","spectrum_index":20507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 181.0735 Da; putative annotation: N/A; putative formula: C9H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.155,"smiles":null,"spectrum_id":"CCMSLIB00017246872","spectrum_index":20508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 76.0678 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017246874","spectrum_index":20509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 40.031 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.232,"smiles":null,"spectrum_id":"CCMSLIB00017246876","spectrum_index":20510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11(12)-Epoxy-5Z,8Z,14Z,17Z- eicosatetraenoic acid (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017246879","spectrum_index":20511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 285.1722 Da; putative annotation: N/A; putative formula: C12H24N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":952.401,"smiles":null,"spectrum_id":"CCMSLIB00017246881","spectrum_index":20512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 142.0787 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.431,"smiles":null,"spectrum_id":"CCMSLIB00017246883","spectrum_index":20513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 183.0535 Da; putative annotation: N/A; putative formula: C8H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.145,"smiles":null,"spectrum_id":"CCMSLIB00017246886","spectrum_index":20514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 63.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.113,"smiles":null,"spectrum_id":"CCMSLIB00017246887","spectrum_index":20515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Di-.gamma.-linolenin (6c,9c,12c) (delta mass: 303.3102 Da; putative annotation: N/A; putative formula: C20H37N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.793,"smiles":null,"spectrum_id":"CCMSLIB00017246890","spectrum_index":20516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,6-DIMETHOXYBENZOIC ACID CollisionEnergy:205060\"\" (delta mass: 11.9999 Da; putative annotation: N/A; putative formula: C)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017246891","spectrum_index":20517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 62.0487 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.333,"smiles":null,"spectrum_id":"CCMSLIB00017246894","spectrum_index":20518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017246895","spectrum_index":20519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 534.2802 Da; putative annotation: N/A; putative formula: C25H38N6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.362,"smiles":null,"spectrum_id":"CCMSLIB00017246898","spectrum_index":20520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 308.1838 Da; putative annotation: N/A; putative formula: C17H29N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.332,"smiles":null,"spectrum_id":"CCMSLIB00017246901","spectrum_index":20521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1107.5471 Da; putative annotation: N/A; putative formula: C58H77N9O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1270.61,"smiles":null,"spectrum_id":"CCMSLIB00017246902","spectrum_index":20522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 132.0577 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.212,"smiles":null,"spectrum_id":"CCMSLIB00017246905","spectrum_index":20523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 46.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017246907","spectrum_index":20524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 321.252 Da; putative annotation: N/A; putative formula: C17H31N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.312,"smiles":null,"spectrum_id":"CCMSLIB00017246909","spectrum_index":20525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 353.1321 Da; putative annotation: N/A; putative formula: C13H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.192,"smiles":null,"spectrum_id":"CCMSLIB00017246911","spectrum_index":20526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 417.0866 Da; putative annotation: N/A; putative formula: C17H19N7S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.157,"smiles":null,"spectrum_id":"CCMSLIB00017246914","spectrum_index":20527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trihexyphenidyl (delta mass: 84.0421 Da; putative annotation: N/A; putative formula: C2H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.29,"smiles":null,"spectrum_id":"CCMSLIB00017246916","spectrum_index":20528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatin (delta mass: 56.0267 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.113,"smiles":null,"spectrum_id":"CCMSLIB00017246918","spectrum_index":20529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid (delta mass: 74.0381 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.129,"smiles":null,"spectrum_id":"CCMSLIB00017246921","spectrum_index":20530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 70.0854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.207,"smiles":null,"spectrum_id":"CCMSLIB00017246922","spectrum_index":20531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 24.9846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.06,"smiles":null,"spectrum_id":"CCMSLIB00017246925","spectrum_index":20532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 686.4544 Da; putative annotation: N/A; putative formula: C44H62O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.551,"smiles":null,"spectrum_id":"CCMSLIB00017246926","spectrum_index":20533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 62.0516 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.195,"smiles":null,"spectrum_id":"CCMSLIB00017246929","spectrum_index":20534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 70.0771 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.181,"smiles":null,"spectrum_id":"CCMSLIB00017246930","spectrum_index":20535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000100 5-hydroxyculmorin|(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol (delta mass: 36.0215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.217,"smiles":null,"spectrum_id":"CCMSLIB00017246933","spectrum_index":20536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 14.0187 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.063,"smiles":null,"spectrum_id":"CCMSLIB00017246935","spectrum_index":20537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385013-01_C16H14O4_1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-(4-methoxyphenyl)-, (3R)- (delta mass: 14.0151 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.112,"smiles":null,"spectrum_id":"CCMSLIB00017246937","spectrum_index":20538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 164.0487 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.098,"smiles":null,"spectrum_id":"CCMSLIB00017246940","spectrum_index":20539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxopimara-8(14),15-dien-20-oic acid (delta mass: 17.9739 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017246941","spectrum_index":20540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 237.1947 Da; putative annotation: N/A; putative formula: C12H23N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.442,"smiles":null,"spectrum_id":"CCMSLIB00017246944","spectrum_index":20541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 100.0575 Da; putative annotation: N/A; putative formula: C4H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.129,"smiles":null,"spectrum_id":"CCMSLIB00017246946","spectrum_index":20542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 52.0238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.073,"smiles":null,"spectrum_id":"CCMSLIB00017246948","spectrum_index":20543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 114.0716 Da; putative annotation: N/A; putative formula: C5H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.195,"smiles":null,"spectrum_id":"CCMSLIB00017246951","spectrum_index":20544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Piperazinecarboxylic acid, methyl ester (delta mass: 41.0021 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.099,"smiles":null,"spectrum_id":"CCMSLIB00017246952","spectrum_index":20545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 57.0667 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.148,"smiles":null,"spectrum_id":"CCMSLIB00017246955","spectrum_index":20546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloropurine riboside (delta mass: 294.0955 Da; putative annotation: N/A; putative formula: C14H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.15,"smiles":null,"spectrum_id":"CCMSLIB00017246956","spectrum_index":20547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F1.alpha. alcohol (delta mass: 88.0699 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.354,"smiles":null,"spectrum_id":"CCMSLIB00017246959","spectrum_index":20548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 597.3714 Da; putative annotation: N/A; putative formula: C33H51N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.432,"smiles":null,"spectrum_id":"CCMSLIB00017246960","spectrum_index":20549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 127.8137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.884,"smiles":null,"spectrum_id":"CCMSLIB00017246963","spectrum_index":20550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 489.3297 Da; putative annotation: N/A; putative formula: C25H47NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.4,"smiles":null,"spectrum_id":"CCMSLIB00017246965","spectrum_index":20551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 16.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.127,"smiles":null,"spectrum_id":"CCMSLIB00017246967","spectrum_index":20552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 282.1524 Da; putative annotation: N/A; putative formula: C21H18N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.27,"smiles":null,"spectrum_id":"CCMSLIB00017246969","spectrum_index":20553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroaspyrone (delta mass: 24.0002 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.097,"smiles":null,"spectrum_id":"CCMSLIB00017246971","spectrum_index":20554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2,9,10-trimethoxy-5,6-dihydroisoquinolino[3,2-a]isoquinolinium cation (delta mass: 17.0283 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.167,"smiles":null,"spectrum_id":"CCMSLIB00017246974","spectrum_index":20555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 210.1742 Da; putative annotation: N/A; putative formula: C12H22N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.18,"smiles":null,"spectrum_id":"CCMSLIB00017246975","spectrum_index":20556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 150.0676 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.289,"smiles":null,"spectrum_id":"CCMSLIB00017246978","spectrum_index":20557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 138.1419 Da; putative annotation: N/A; putative formula: C10H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.197,"smiles":null,"spectrum_id":"CCMSLIB00017246979","spectrum_index":20558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 73.0312 Da; putative annotation: N/A; putative formula: C6H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.133,"smiles":null,"spectrum_id":"CCMSLIB00017246982","spectrum_index":20559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 115.0273 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.198,"smiles":null,"spectrum_id":"CCMSLIB00017246983","spectrum_index":20560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 9.9369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.018,"smiles":null,"spectrum_id":"CCMSLIB00017246986","spectrum_index":20561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 101.084 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.187,"smiles":null,"spectrum_id":"CCMSLIB00017246987","spectrum_index":20562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 70.042 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.083,"smiles":null,"spectrum_id":"CCMSLIB00017246990","spectrum_index":20563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zymosterol (delta mass: 72.0571 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.404,"smiles":null,"spectrum_id":"CCMSLIB00017246991","spectrum_index":20564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 550.2612 Da; putative annotation: N/A; putative formula: C22H34N10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.347,"smiles":null,"spectrum_id":"CCMSLIB00017246994","spectrum_index":20565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 45.0271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.15,"smiles":null,"spectrum_id":"CCMSLIB00017246995","spectrum_index":20566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-8-ol (delta mass: 18.0062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.269,"smiles":null,"spectrum_id":"CCMSLIB00017246998","spectrum_index":20567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Phenylpropyl)piperazine (delta mass: 53.0722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.242,"smiles":null,"spectrum_id":"CCMSLIB00017246999","spectrum_index":20568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 457.1586 Da; putative annotation: N/A; putative formula: C25H25N5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.219,"smiles":null,"spectrum_id":"CCMSLIB00017247002","spectrum_index":20569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 268.0995 Da; putative annotation: N/A; putative formula: C11H16N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.212,"smiles":null,"spectrum_id":"CCMSLIB00017247003","spectrum_index":20570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 7.3562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.5,"smiles":null,"spectrum_id":"CCMSLIB00017247006","spectrum_index":20571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE30; CorrDec (delta mass: 60.0188 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.085,"smiles":null,"spectrum_id":"CCMSLIB00017247009","spectrum_index":20572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347803-02_C20H32O4_1-Naphthalenecarboxylic acid, decahydro-5-[(3E)-5-hydroxy-3-(hydroxymethyl)-3-penten-1-yl]-1,4a-dimethyl-6-methylene- (delta mass: 175.0492 Da; putative annotation: N/A; putative formula: C7H13NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.286,"smiles":null,"spectrum_id":"CCMSLIB00017247010","spectrum_index":20573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 144.1503 Da; putative annotation: N/A; putative formula: C5H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.226,"smiles":null,"spectrum_id":"CCMSLIB00017247013","spectrum_index":20574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.-ol-17-one (delta mass: 66.049 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.265,"smiles":null,"spectrum_id":"CCMSLIB00017247014","spectrum_index":20575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 304.2024 Da; putative annotation: N/A; putative formula: C15H24N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.419,"smiles":null,"spectrum_id":"CCMSLIB00017247017","spectrum_index":20576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP018201 Homovanillic acid|2-(4-hydroxy-3-methoxyphenyl)acetic acid (delta mass: 70.0534 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.119,"smiles":null,"spectrum_id":"CCMSLIB00017247018","spectrum_index":20577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 153.0458 Da; putative annotation: N/A; putative formula: C6H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.293,"smiles":null,"spectrum_id":"CCMSLIB00017247021","spectrum_index":20578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 298.211 Da; putative annotation: N/A; putative formula: C13H26N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.396,"smiles":null,"spectrum_id":"CCMSLIB00017247022","spectrum_index":20579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 173.0579 Da; putative annotation: N/A; putative formula: C9H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.207,"smiles":null,"spectrum_id":"CCMSLIB00017247025","spectrum_index":20580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 193.1104 Da; putative annotation: N/A; putative formula: C11H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.28,"smiles":null,"spectrum_id":"CCMSLIB00017247028","spectrum_index":20581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 42.0098 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017247029","spectrum_index":20582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Methoxybenzyl)piperidine (delta mass: 16.9403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.094,"smiles":null,"spectrum_id":"CCMSLIB00017247032","spectrum_index":20583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid, 4-(aminomethyl)-, ethyl ester (delta mass: 27.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017247033","spectrum_index":20584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU085504 dl-Norgestrel|(8R,9S,10R,13S,14S)-13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one (delta mass: 31.9902 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017247036","spectrum_index":20585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 24.0793 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017247038","spectrum_index":20586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 344.209 Da; putative annotation: N/A; putative formula: C14H29N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.3,"smiles":null,"spectrum_id":"CCMSLIB00017247040","spectrum_index":20587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 26.0287 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.109,"smiles":null,"spectrum_id":"CCMSLIB00017247043","spectrum_index":20588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Hydroxyphenyl)ethanol (delta mass: 39.0109 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017247045","spectrum_index":20589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of QuinicAcid (delta mass: 90.0475 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017247047","spectrum_index":20590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 204.1273 Da; putative annotation: N/A; putative formula: C10H21O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.255,"smiles":null,"spectrum_id":"CCMSLIB00017247049","spectrum_index":20591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,9-Dihydroxy-5Z,11Z,14Z-eicosatrienoic acid (delta mass: 84.0558 Da; putative annotation: N/A; putative formula: CH4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.309,"smiles":null,"spectrum_id":"CCMSLIB00017247051","spectrum_index":20592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Linolenic acid (delta mass: 163.0849 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.317,"smiles":null,"spectrum_id":"CCMSLIB00017247053","spectrum_index":20593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310669 Soyasapogenol B base + O-HexA-Pen-dHex (delta mass: 913.3434 Da; putative annotation: N/A; putative formula: C45H63N5O5S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1826.86,"smiles":null,"spectrum_id":"CCMSLIB00017247056","spectrum_index":20594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 13.0674 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.289,"smiles":null,"spectrum_id":"CCMSLIB00017247057","spectrum_index":20595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 252.2098 Da; putative annotation: N/A; putative formula: C16H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.318,"smiles":null,"spectrum_id":"CCMSLIB00017247060","spectrum_index":20596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 59.0378 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.285,"smiles":null,"spectrum_id":"CCMSLIB00017247061","spectrum_index":20597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 17.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.093,"smiles":null,"spectrum_id":"CCMSLIB00017247064","spectrum_index":20598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 28.0686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.123,"smiles":null,"spectrum_id":"CCMSLIB00017247066","spectrum_index":20599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301587 Harmol (delta mass: 176.0317 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.118,"smiles":null,"spectrum_id":"CCMSLIB00017247068","spectrum_index":20600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 691.4305 Da; putative annotation: N/A; putative formula: C39H65NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":884.501,"smiles":null,"spectrum_id":"CCMSLIB00017247071","spectrum_index":20601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 100.0691 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.322,"smiles":null,"spectrum_id":"CCMSLIB00017247072","spectrum_index":20602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentamethylene bisacetamide (delta mass: 147.0531 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.197,"smiles":null,"spectrum_id":"CCMSLIB00017247075","spectrum_index":20603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 194.1087 Da; putative annotation: N/A; putative formula: C9H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.174,"smiles":null,"spectrum_id":"CCMSLIB00017247076","spectrum_index":20604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 92.0157 Da; putative annotation: N/A; putative formula: H4N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.068,"smiles":null,"spectrum_id":"CCMSLIB00017247079","spectrum_index":20605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 107.0456 Da; putative annotation: N/A; putative formula: C5H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.127,"smiles":null,"spectrum_id":"CCMSLIB00017247080","spectrum_index":20606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 275.1032 Da; putative annotation: N/A; putative formula: C13H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.2,"smiles":null,"spectrum_id":"CCMSLIB00017247083","spectrum_index":20607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 9.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":109.102,"smiles":null,"spectrum_id":"CCMSLIB00017247086","spectrum_index":20608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 48.0361 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.273,"smiles":null,"spectrum_id":"CCMSLIB00017247087","spectrum_index":20609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 341.2943 Da; putative annotation: N/A; putative formula: C21H35N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.537,"smiles":null,"spectrum_id":"CCMSLIB00017247089","spectrum_index":20610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01042 Hexahydrocurcumin (delta mass: 132.0212 Da; putative annotation: N/A; putative formula: C8H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.201,"smiles":null,"spectrum_id":"CCMSLIB00017247091","spectrum_index":20611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxo-taurocholenic acid or isomer  putative (delta mass: 15.9945 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.267,"smiles":null,"spectrum_id":"CCMSLIB00017247094","spectrum_index":20612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-L-phenylalanine (delta mass: 146.1059 Da; putative annotation: N/A; putative formula: C6H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.182,"smiles":null,"spectrum_id":"CCMSLIB00017247096","spectrum_index":20613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 16.0915 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.064,"smiles":null,"spectrum_id":"CCMSLIB00017247098","spectrum_index":20614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 80.0538 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.12,"smiles":null,"spectrum_id":"CCMSLIB00017247101","spectrum_index":20615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lycorine hydrochloride (delta mass: 16.0405 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.14,"smiles":null,"spectrum_id":"CCMSLIB00017247103","spectrum_index":20616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 87.1041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.253,"smiles":null,"spectrum_id":"CCMSLIB00017247105","spectrum_index":20617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Diamino-2-methylpropane (delta mass: 23.9997 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":113.107,"smiles":null,"spectrum_id":"CCMSLIB00017247108","spectrum_index":20618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 77.0696 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.145,"smiles":null,"spectrum_id":"CCMSLIB00017247110","spectrum_index":20619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Castanospermine (delta mass: 318.1005 Da; putative annotation: N/A; putative formula: C19H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.208,"smiles":null,"spectrum_id":"CCMSLIB00017247112","spectrum_index":20620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 464.2772 Da; putative annotation: N/A; putative formula: C26H40O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.348,"smiles":null,"spectrum_id":"CCMSLIB00017247115","spectrum_index":20621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 244.0349 Da; putative annotation: N/A; putative formula: C6H13O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.121,"smiles":null,"spectrum_id":"CCMSLIB00017247118","spectrum_index":20622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 105.0789 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.181,"smiles":null,"spectrum_id":"CCMSLIB00017247120","spectrum_index":20623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 97.0378 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.29,"smiles":null,"spectrum_id":"CCMSLIB00017247122","spectrum_index":20624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,12-Tricosadiynoic acid (delta mass: 72.0422 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.337,"smiles":null,"spectrum_id":"CCMSLIB00017247125","spectrum_index":20625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-AMINOLEVULINIC ACID (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.065,"smiles":null,"spectrum_id":"CCMSLIB00017247126","spectrum_index":20626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 101.0447 Da; putative annotation: N/A; putative formula: H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.1,"smiles":null,"spectrum_id":"CCMSLIB00017247129","spectrum_index":20627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 174.107 Da; putative annotation: N/A; putative formula: C9H18OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.302,"smiles":null,"spectrum_id":"CCMSLIB00017247131","spectrum_index":20628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzenamine, 4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]- (delta mass: 86.0493 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.272,"smiles":null,"spectrum_id":"CCMSLIB00017247133","spectrum_index":20629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.alpha.,9.Xi.)-3-Hydroxyolean-12-en-24-oic acid (delta mass: 120.0996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.467,"smiles":null,"spectrum_id":"CCMSLIB00017247136","spectrum_index":20630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 684.403 Da; putative annotation: N/A; putative formula: C28H52N12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.489,"smiles":null,"spectrum_id":"CCMSLIB00017247138","spectrum_index":20631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one (delta mass: 92.0621 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.221,"smiles":null,"spectrum_id":"CCMSLIB00017247140","spectrum_index":20632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 78.083 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017247142","spectrum_index":20633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 59.0741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.16,"smiles":null,"spectrum_id":"CCMSLIB00017247145","spectrum_index":20634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 494.1787 Da; putative annotation: N/A; putative formula: C22H18N14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":999.355,"smiles":null,"spectrum_id":"CCMSLIB00017247147","spectrum_index":20635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-11.alpha.,16R-dihydroxy-17-cyclobutyl-5Z,13E-dien-1-oic acid (delta mass: 80.0614 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.325,"smiles":null,"spectrum_id":"CCMSLIB00017247149","spectrum_index":20636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 240.0266 Da; putative annotation: N/A; putative formula: C6H16N2P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.087,"smiles":null,"spectrum_id":"CCMSLIB00017247152","spectrum_index":20637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 145.9862 Da; putative annotation: N/A; putative formula: C5H6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.062,"smiles":null,"spectrum_id":"CCMSLIB00017247154","spectrum_index":20638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epitestosterone (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017247156","spectrum_index":20639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Pregnene-20.alpha.-ol-3-one (delta mass: 18.0089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.256,"smiles":null,"spectrum_id":"CCMSLIB00017247159","spectrum_index":20640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 98.927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.055,"smiles":null,"spectrum_id":"CCMSLIB00017247160","spectrum_index":20641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 186.056 Da; putative annotation: N/A; putative formula: C7H11N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.158,"smiles":null,"spectrum_id":"CCMSLIB00017247163","spectrum_index":20642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 116.154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.251,"smiles":null,"spectrum_id":"CCMSLIB00017247165","spectrum_index":20643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 90.0835 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017247167","spectrum_index":20644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tryptamine-C4:0 (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.175,"smiles":null,"spectrum_id":"CCMSLIB00017247170","spectrum_index":20645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 247.0453 Da; putative annotation: N/A; putative formula: C8H5N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.105,"smiles":null,"spectrum_id":"CCMSLIB00017247172","spectrum_index":20646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-Hydroxy-6'-methoxyacetophenone (delta mass: 44.0258 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017247174","spectrum_index":20647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Fluorophenyl)azepane (delta mass: 46.0012 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.135,"smiles":null,"spectrum_id":"CCMSLIB00017247177","spectrum_index":20648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Cysteine-glutathione disulfide (delta mass: 111.0323 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.128,"smiles":null,"spectrum_id":"CCMSLIB00017247179","spectrum_index":20649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 401.1532 Da; putative annotation: N/A; putative formula: C14H27NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.192,"smiles":null,"spectrum_id":"CCMSLIB00017247181","spectrum_index":20650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 593.3158 Da; putative annotation: N/A; putative formula: C26H47N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.459,"smiles":null,"spectrum_id":"CCMSLIB00017247184","spectrum_index":20651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 160.1026 Da; putative annotation: N/A; putative formula: C10H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.205,"smiles":null,"spectrum_id":"CCMSLIB00017247186","spectrum_index":20652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 142.1051 Da; putative annotation: N/A; putative formula: C7H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.342,"smiles":null,"spectrum_id":"CCMSLIB00017247188","spectrum_index":20653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017247190","spectrum_index":20654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-butyric acid CollisionEnergy:102040 (delta mass: 223.0695 Da; putative annotation: N/A; putative formula: C10H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.171,"smiles":null,"spectrum_id":"CCMSLIB00017247193","spectrum_index":20655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 56.0272 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.317,"smiles":null,"spectrum_id":"CCMSLIB00017247195","spectrum_index":20656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 20.4196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017247197","spectrum_index":20657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 68.0743 Da; putative annotation: N/A; putative formula: C4H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.213,"smiles":null,"spectrum_id":"CCMSLIB00017247200","spectrum_index":20658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 32.9892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.117,"smiles":null,"spectrum_id":"CCMSLIB00017247201","spectrum_index":20659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 14.073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.122,"smiles":null,"spectrum_id":"CCMSLIB00017247204","spectrum_index":20660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 474.2896 Da; putative annotation: N/A; putative formula: C31H34N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.386,"smiles":null,"spectrum_id":"CCMSLIB00017247205","spectrum_index":20661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 88.0522 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.221,"smiles":null,"spectrum_id":"CCMSLIB00017247208","spectrum_index":20662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5,9-trihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one (delta mass: 116.0578 Da; putative annotation: N/A; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.212,"smiles":null,"spectrum_id":"CCMSLIB00017247209","spectrum_index":20663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 162.0533 Da; putative annotation: N/A; putative formula: C7H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.15,"smiles":null,"spectrum_id":"CCMSLIB00017247212","spectrum_index":20664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 125.0635 Da; putative annotation: N/A; putative formula: C10H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.145,"smiles":null,"spectrum_id":"CCMSLIB00017247213","spectrum_index":20665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Thr (delta mass: 129.0436 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.152,"smiles":null,"spectrum_id":"CCMSLIB00017247216","spectrum_index":20666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8S-Hydroxy-9E,11Z,14Z-eicosatrienoic acid (delta mass: 259.2511 Da; putative annotation: N/A; putative formula: C11H29N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.509,"smiles":null,"spectrum_id":"CCMSLIB00017247219","spectrum_index":20667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 331.1624 Da; putative annotation: N/A; putative formula: C19H27NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.228,"smiles":null,"spectrum_id":"CCMSLIB00017247220","spectrum_index":20668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-15-Tetracosenoic acid (delta mass: 66.0465 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.404,"smiles":null,"spectrum_id":"CCMSLIB00017247223","spectrum_index":20669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017247225","spectrum_index":20670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 96.0938 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.326,"smiles":null,"spectrum_id":"CCMSLIB00017247227","spectrum_index":20671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Hydroperoxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 50.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.258,"smiles":null,"spectrum_id":"CCMSLIB00017247230","spectrum_index":20672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 193.0995 Da; putative annotation: N/A; putative formula: C5H15N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.212,"smiles":null,"spectrum_id":"CCMSLIB00017247231","spectrum_index":20673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthioamphetamine (delta mass: 86.1062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.243,"smiles":null,"spectrum_id":"CCMSLIB00017247234","spectrum_index":20674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Nitrophenethyl alcohol (delta mass: 83.0371 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.103,"smiles":null,"spectrum_id":"CCMSLIB00017247236","spectrum_index":20675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Piperazinyl)-1H-indole (delta mass: 160.0989 Da; putative annotation: N/A; putative formula: C10H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.233,"smiles":null,"spectrum_id":"CCMSLIB00017247239","spectrum_index":20676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 351.2272 Da; putative annotation: N/A; putative formula: C17H29N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.314,"smiles":null,"spectrum_id":"CCMSLIB00017247241","spectrum_index":20677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 209.2555 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.415,"smiles":null,"spectrum_id":"CCMSLIB00017247243","spectrum_index":20678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F1.alpha. alcohol (delta mass: 50.0513 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.336,"smiles":null,"spectrum_id":"CCMSLIB00017247246","spectrum_index":20679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 96.0933 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.44,"smiles":null,"spectrum_id":"CCMSLIB00017247247","spectrum_index":20680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-(-)-Nopol CollisionEnergy:102040 (delta mass: 321.2154 Da; putative annotation: N/A; putative formula: C15H31NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.358,"smiles":null,"spectrum_id":"CCMSLIB00017247250","spectrum_index":20681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 236.0213 Da; putative annotation: N/A; putative formula: C15H9O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.108,"smiles":null,"spectrum_id":"CCMSLIB00017247251","spectrum_index":20682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 89.0265 Da; putative annotation: N/A; putative formula: C6H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017247254","spectrum_index":20683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Decaethylene glycol from NIST14 (delta mass: 213.2471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.527,"smiles":null,"spectrum_id":"CCMSLIB00017247255","spectrum_index":20684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 675.7403 Da; putative annotation: N/A; putative formula: C45H93N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.838,"smiles":null,"spectrum_id":"CCMSLIB00017247258","spectrum_index":20685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 146.1099 Da; putative annotation: N/A; putative formula: C11H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.295,"smiles":null,"spectrum_id":"CCMSLIB00017247259","spectrum_index":20686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 60.015 Da; putative annotation: N/A; putative formula: CH4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.096,"smiles":null,"spectrum_id":"CCMSLIB00017247262","spectrum_index":20687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 881.4781 Da; putative annotation: N/A; putative formula: C59H59N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1044.54,"smiles":null,"spectrum_id":"CCMSLIB00017247263","spectrum_index":20688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 1-PHOSPHATE (delta mass: 282.2568 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.294,"smiles":null,"spectrum_id":"CCMSLIB00017247266","spectrum_index":20689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 96.0941 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.41,"smiles":null,"spectrum_id":"CCMSLIB00017247267","spectrum_index":20690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 57.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.15,"smiles":null,"spectrum_id":"CCMSLIB00017247270","spectrum_index":20691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 3.0091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.089,"smiles":null,"spectrum_id":"CCMSLIB00017247272","spectrum_index":20692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloropurine riboside (delta mass: 132.043 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.097,"smiles":null,"spectrum_id":"CCMSLIB00017247274","spectrum_index":20693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 96.0425 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.202,"smiles":null,"spectrum_id":"CCMSLIB00017247277","spectrum_index":20694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1,2,3,4-tetrahydroquinazolin-2-one (delta mass: 242.0364 Da; putative annotation: N/A; putative formula: C9H10N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.123,"smiles":null,"spectrum_id":"CCMSLIB00017247278","spectrum_index":20695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antiquorin (delta mass: 71.0089 Da; putative annotation: N/A; putative formula: CHN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.22,"smiles":null,"spectrum_id":"CCMSLIB00017247281","spectrum_index":20696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 168.1303 Da; putative annotation: N/A; putative formula: C14H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.362,"smiles":null,"spectrum_id":"CCMSLIB00017247282","spectrum_index":20697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Fluorophenyl)-1-(piperazin-1-yl)ethan-1-one (delta mass: 62.0456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.17,"smiles":null,"spectrum_id":"CCMSLIB00017247285","spectrum_index":20698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dehydro-16-epi-vincamine (delta mass: 416.1572 Da; putative annotation: N/A; putative formula: C15H25N6O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.343,"smiles":null,"spectrum_id":"CCMSLIB00017247286","spectrum_index":20699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 340.2642 Da; putative annotation: N/A; putative formula: C19H37N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.335,"smiles":null,"spectrum_id":"CCMSLIB00017247289","spectrum_index":20700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 192.2057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.301,"smiles":null,"spectrum_id":"CCMSLIB00017247290","spectrum_index":20701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Retinoic acid (delta mass: 92.0627 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.279,"smiles":null,"spectrum_id":"CCMSLIB00017247292","spectrum_index":20702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-3-pyrrolidin-1-yl-1H-pyrazole-4-carbonitrile (delta mass: 41.0272 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.136,"smiles":null,"spectrum_id":"CCMSLIB00017247294","spectrum_index":20703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetradecanedioic acid (delta mass: 38.0496 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.24,"smiles":null,"spectrum_id":"CCMSLIB00017247297","spectrum_index":20704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 349.2816 Da; putative annotation: N/A; putative formula: C15H31N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.513,"smiles":null,"spectrum_id":"CCMSLIB00017247298","spectrum_index":20705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 64.0679 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.232,"smiles":null,"spectrum_id":"CCMSLIB00017247301","spectrum_index":20706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 179.0796 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.155,"smiles":null,"spectrum_id":"CCMSLIB00017247304","spectrum_index":20707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 174.1 Da; putative annotation: N/A; putative formula: C9H19O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.146,"smiles":null,"spectrum_id":"CCMSLIB00017247305","spectrum_index":20708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 145.054 Da; putative annotation: N/A; putative formula: C2H7N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.095,"smiles":null,"spectrum_id":"CCMSLIB00017247308","spectrum_index":20709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 59.0258 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.131,"smiles":null,"spectrum_id":"CCMSLIB00017247309","spectrum_index":20710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1089.3254 Da; putative annotation: N/A; putative formula: C48H75N5O5S9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1311.42,"smiles":null,"spectrum_id":"CCMSLIB00017247312","spectrum_index":20711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 121.1116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.192,"smiles":null,"spectrum_id":"CCMSLIB00017247313","spectrum_index":20712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 170.168 Da; putative annotation: N/A; putative formula: C11H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.213,"smiles":null,"spectrum_id":"CCMSLIB00017247316","spectrum_index":20713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 35.9993 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.07,"smiles":null,"spectrum_id":"CCMSLIB00017247318","spectrum_index":20714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-C12:0 (delta mass: 43.0407 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.268,"smiles":null,"spectrum_id":"CCMSLIB00017247320","spectrum_index":20715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 729.2198 Da; putative annotation: N/A; putative formula: C47H31N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1073.41,"smiles":null,"spectrum_id":"CCMSLIB00017247322","spectrum_index":20716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 102.0828 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.341,"smiles":null,"spectrum_id":"CCMSLIB00017247324","spectrum_index":20717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 29.0271 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.108,"smiles":null,"spectrum_id":"CCMSLIB00017247327","spectrum_index":20718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 25.9715 Da; putative annotation: N/A; putative formula: C14H19N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.084,"smiles":null,"spectrum_id":"CCMSLIB00017247330","spectrum_index":20719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-piperidinamine (delta mass: 77.0342 Da; putative annotation: N/A; putative formula: C4H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.157,"smiles":null,"spectrum_id":"CCMSLIB00017247332","spectrum_index":20720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 108.1877 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.284,"smiles":null,"spectrum_id":"CCMSLIB00017247334","spectrum_index":20721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 233.1628 Da; putative annotation: N/A; putative formula: C11H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.385,"smiles":null,"spectrum_id":"CCMSLIB00017247336","spectrum_index":20722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 138.0468 Da; putative annotation: N/A; putative formula: C11H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.107,"smiles":null,"spectrum_id":"CCMSLIB00017247338","spectrum_index":20723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E2 isopropyl ester (delta mass: 48.0364 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.316,"smiles":null,"spectrum_id":"CCMSLIB00017247340","spectrum_index":20724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,5,6-trimethylbenzoic acid (delta mass: 236.2139 Da; putative annotation: N/A; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.295,"smiles":null,"spectrum_id":"CCMSLIB00017247343","spectrum_index":20725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norharmane (delta mass: 42.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.149,"smiles":null,"spectrum_id":"CCMSLIB00017247345","spectrum_index":20726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-5,6-dihydroxy-6-methyl-7-oxocyclopenta[c]pyridine-5-carboxylate (delta mass: 18.0141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.195,"smiles":null,"spectrum_id":"CCMSLIB00017247347","spectrum_index":20727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Allopurinol from NIST14 (delta mass: 132.03 Da; putative annotation: N/A; putative formula: C3N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.076,"smiles":null,"spectrum_id":"CCMSLIB00017247350","spectrum_index":20728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 454.4188 Da; putative annotation: N/A; putative formula: C25H54N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.609,"smiles":null,"spectrum_id":"CCMSLIB00017247351","spectrum_index":20729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Dihydrotestosterone (delta mass: 80.0623 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.294,"smiles":null,"spectrum_id":"CCMSLIB00017247354","spectrum_index":20730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-CARBOXYBENZALDEHYDE (delta mass: 75.0489 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.088,"smiles":null,"spectrum_id":"CCMSLIB00017247355","spectrum_index":20731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 578.5068 Da; putative annotation: N/A; putative formula: C40H66O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1187.78,"smiles":null,"spectrum_id":"CCMSLIB00017247358","spectrum_index":20732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 261.1226 Da; putative annotation: N/A; putative formula: C12H15N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.193,"smiles":null,"spectrum_id":"CCMSLIB00017247360","spectrum_index":20733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrouracil (delta mass: 41.0151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.065,"smiles":null,"spectrum_id":"CCMSLIB00017247362","spectrum_index":20734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 108.0985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.31,"smiles":null,"spectrum_id":"CCMSLIB00017247365","spectrum_index":20735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid (delta mass: 260.2148 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.468,"smiles":null,"spectrum_id":"CCMSLIB00017247367","spectrum_index":20736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 41.0502 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.152,"smiles":null,"spectrum_id":"CCMSLIB00017247369","spectrum_index":20737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D3 (delta mass: 44.0242 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.366,"smiles":null,"spectrum_id":"CCMSLIB00017247371","spectrum_index":20738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,16.Xi.)-17-Hydroxykauran-19-oic acid (delta mass: 68.0629 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017247373","spectrum_index":20739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 130.0784 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.295,"smiles":null,"spectrum_id":"CCMSLIB00017247376","spectrum_index":20740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 165.0788 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.171,"smiles":null,"spectrum_id":"CCMSLIB00017247378","spectrum_index":20741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 247.0693 Da; putative annotation: N/A; putative formula: C9H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.162,"smiles":null,"spectrum_id":"CCMSLIB00017247380","spectrum_index":20742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 328.0899 Da; putative annotation: N/A; putative formula: C15H21O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.212,"smiles":null,"spectrum_id":"CCMSLIB00017247383","spectrum_index":20743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 51.0473 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.113,"smiles":null,"spectrum_id":"CCMSLIB00017247385","spectrum_index":20744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 41.1205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.181,"smiles":null,"spectrum_id":"CCMSLIB00017247387","spectrum_index":20745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 187.0038 Da; putative annotation: N/A; putative formula: C6H6NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.074,"smiles":null,"spectrum_id":"CCMSLIB00017247389","spectrum_index":20746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4H-Pyrrolo[3,2-c]pyridin-4-one, 1,5,6,7-tetrahydro-2-[2-(3-quinolinyl)-4-pyridinyl]- (delta mass: 282.2643 Da; putative annotation: N/A; putative formula: C13H30N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.404,"smiles":null,"spectrum_id":"CCMSLIB00017247391","spectrum_index":20747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 284.0736 Da; putative annotation: N/A; putative formula: C6H18N6OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.176,"smiles":null,"spectrum_id":"CCMSLIB00017247394","spectrum_index":20748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU203801 Carbamazepine-10,11-epoxide|Carbamazepine epoxide (delta mass: 44.0713 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.168,"smiles":null,"spectrum_id":"CCMSLIB00017247396","spectrum_index":20749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 366.1468 Da; putative annotation: N/A; putative formula: C22H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.297,"smiles":null,"spectrum_id":"CCMSLIB00017247398","spectrum_index":20750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 366.1258 Da; putative annotation: N/A; putative formula: C18H26N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.207,"smiles":null,"spectrum_id":"CCMSLIB00017247401","spectrum_index":20751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-1-Benzyl-3-piperidinylamine (delta mass: 76.041 Da; putative annotation: N/A; putative formula: C5H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017247402","spectrum_index":20752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-1H-indole-3-carbaldehyde (delta mass: 89.0382 Da; putative annotation: N/A; putative formula: C5H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.059,"smiles":null,"spectrum_id":"CCMSLIB00017247405","spectrum_index":20753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250806 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 43.0064 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.066,"smiles":null,"spectrum_id":"CCMSLIB00017247408","spectrum_index":20754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017247409","spectrum_index":20755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Cycloisolongifol-5-ol (delta mass: 55.9898 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017247412","spectrum_index":20756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Resorcylic acid (delta mass: 202.0266 Da; putative annotation: N/A; putative formula: C11H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.06,"smiles":null,"spectrum_id":"CCMSLIB00017247413","spectrum_index":20757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 86.1196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017247416","spectrum_index":20758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 481.2886 Da; putative annotation: N/A; putative formula: C22H43NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.385,"smiles":null,"spectrum_id":"CCMSLIB00017247419","spectrum_index":20759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 82.0628 Da; putative annotation: N/A; putative formula: C3H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.295,"smiles":null,"spectrum_id":"CCMSLIB00017247420","spectrum_index":20760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 254.2332 Da; putative annotation: N/A; putative formula: C11H26N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.549,"smiles":null,"spectrum_id":"CCMSLIB00017247423","spectrum_index":20761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 55.8921 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.973,"smiles":null,"spectrum_id":"CCMSLIB00017247424","spectrum_index":20762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Dilinolenin (9c,12c,15c) from NIST14 (delta mass: 262.23 Da; putative annotation: Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.713,"smiles":null,"spectrum_id":"CCMSLIB00017247427","spectrum_index":20763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Pro (delta mass: 147.068 Da; putative annotation: N-(4-Hydroxyphenyl)propanamide; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.198,"smiles":null,"spectrum_id":"CCMSLIB00017247430","spectrum_index":20764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 200.1163 Da; putative annotation: Ile-Ser; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.25,"smiles":null,"spectrum_id":"CCMSLIB00017247431","spectrum_index":20765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 127.0631 Da; putative annotation: Massbank:PR311149 Allysine (not validated); putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.155,"smiles":null,"spectrum_id":"CCMSLIB00017247434","spectrum_index":20766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 143.0583 Da; putative annotation: 2-Aminoadipic acid; AIF; CE0; MS2Dec; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.182,"smiles":null,"spectrum_id":"CCMSLIB00017247435","spectrum_index":20767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Val (delta mass: 99.0681 Da; putative annotation: N-Methyl-.alpha.-aminoisobutyric acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.213,"smiles":null,"spectrum_id":"CCMSLIB00017247438","spectrum_index":20768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 160.0162 Da; putative annotation: Esculetin; putative formula: C9H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.087,"smiles":null,"spectrum_id":"CCMSLIB00017247441","spectrum_index":20769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 242.1283 Da; putative annotation: Glu-Ile; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.273,"smiles":null,"spectrum_id":"CCMSLIB00017247442","spectrum_index":20770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 97.0528 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.176,"smiles":null,"spectrum_id":"CCMSLIB00017247445","spectrum_index":20771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 14(15)-EpETE from NIST14 (delta mass: 336.2283 Da; putative annotation: NCGC00384809-01!5-[5-hydroxy-3-(hydroxymethyl)pentyl]-8a-(hydroxymethyl)-5,6-dimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid; putative formula: C20H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.455,"smiles":null,"spectrum_id":"CCMSLIB00017247446","spectrum_index":20772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 92.0374 Da; putative annotation: 4-Pyrimidinylmethanol; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.098,"smiles":null,"spectrum_id":"CCMSLIB00017247449","spectrum_index":20773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 242.1273 Da; putative annotation: Leu-Glu; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.272,"smiles":null,"spectrum_id":"CCMSLIB00017247450","spectrum_index":20774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180860-02_C20H34O3_2-Butene-1,4-diol, 2-[2-[(1S,8aR)-1,4,4a,5,6,7,8,8a-octahydro-2-(hydroxymethyl)-5,5,8a-trimethyl-1-naphthalenyl]ethyl]-, (2Z)- (delta mass: 304.2397 Da; putative annotation: NCGC00180860-02_C20H34O3_2-Butene-1,4-diol, 2-[2-[(1S,8aR)-1,4,4a,5,6,7,8,8a-octahydro-2-(hydroxymethyl)-5,5,8a-trimethyl-1-naphthalenyl]ethyl]-, (2Z)-; putative formula: C20H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.498,"smiles":null,"spectrum_id":"CCMSLIB00017247453","spectrum_index":20775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 312.2665 Da; putative annotation: 1-Palmitoylglycerol; putative formula: C19H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.327,"smiles":null,"spectrum_id":"CCMSLIB00017247455","spectrum_index":20776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 126.0305 Da; putative annotation: 3-Methyl-2-pentenedioic acid; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.154,"smiles":null,"spectrum_id":"CCMSLIB00017247457","spectrum_index":20777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 323.1427 Da; putative annotation: Trp-His; putative formula: C17H17N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.225,"smiles":null,"spectrum_id":"CCMSLIB00017247460","spectrum_index":20778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 148.0161 Da; putative annotation: 2-(4-Hydroxyphenyl)-2-oxoacetic acid; putative formula: C8H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.066,"smiles":null,"spectrum_id":"CCMSLIB00017247462","spectrum_index":20779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 87.0314 Da; putative annotation: L-Serine; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017247464","spectrum_index":20780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 330.1833 Da; putative annotation: 4-[2-[(1R,4aS,5R,6R,8aS)-6-Hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]acetyl]-2H-furan-5-one; putative formula: C20H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.307,"smiles":null,"spectrum_id":"CCMSLIB00017247467","spectrum_index":20781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 298.2517 Da; putative annotation: NCGC00347859-02!2,3-dihydroxypropyl 13-methyltetradecanoate; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.531,"smiles":null,"spectrum_id":"CCMSLIB00017247469","spectrum_index":20782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 319.2495 Da; putative annotation: Gly-C18:2; putative formula: C20H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.513,"smiles":null,"spectrum_id":"CCMSLIB00017247471","spectrum_index":20783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 182.1671 Da; putative annotation: Dodecanoic acid; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.436,"smiles":null,"spectrum_id":"CCMSLIB00017247474","spectrum_index":20784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:102040 (delta mass: 178.0757 Da; putative annotation: 2-(4-Methoxyphenoxy)acetohydrazide; putative formula: C9H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.156,"smiles":null,"spectrum_id":"CCMSLIB00017247475","spectrum_index":20785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 117.0597 Da; putative annotation: \"\"1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE\"\"; putative formula: C8H7N)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.182,"smiles":null,"spectrum_id":"CCMSLIB00017247478","spectrum_index":20786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 331.2736 Da; putative annotation: Arachidonoyl-2'-fluoroethylamide; putative formula: C22H34FN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.49,"smiles":null,"spectrum_id":"CCMSLIB00017247480","spectrum_index":20787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 144.0424 Da; putative annotation: Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.171,"smiles":null,"spectrum_id":"CCMSLIB00017247482","spectrum_index":20788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 362.2081 Da; putative annotation: 1,3,4a-Trihydroxy-4,4,6a,9,12b-pentamethyl-1,3,4,4a,5,6,6a,9,10,12,12a,12b-dodecahydro-2H,11H-benzo[f]pyrano[2,3-b]chromen-11-one; putative formula: C21H30O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.424,"smiles":null,"spectrum_id":"CCMSLIB00017247484","spectrum_index":20789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 178.0628 Da; putative annotation: 4-(2-Methyl-6-oxopyran-3-yl)butanoic acid; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.352,"smiles":null,"spectrum_id":"CCMSLIB00017247486","spectrum_index":20790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 159.0888 Da; putative annotation: 5-Amino-3-pyrrolidin-1-yl-1H-pyrazole-4-carbonitrile; putative formula: C8H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.181,"smiles":null,"spectrum_id":"CCMSLIB00017247489","spectrum_index":20791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 302.0911 Da; putative annotation: N/A; putative formula: C16H18N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.167,"smiles":null,"spectrum_id":"CCMSLIB00017247491","spectrum_index":20792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 244.1017 Da; putative annotation: N/A; putative formula: C15H17OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.219,"smiles":null,"spectrum_id":"CCMSLIB00017247494","spectrum_index":20793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.247,"smiles":null,"spectrum_id":"CCMSLIB00017247496","spectrum_index":20794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxo-5Z,8Z,10E,14Z-eicosatetraenoic acid (delta mass: 53.0472 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.274,"smiles":null,"spectrum_id":"CCMSLIB00017247498","spectrum_index":20795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Putative (3-hydroxyhexadecanoyl)glycine (aka Commendamide) (delta mass: 299.2788 Da; putative annotation: N/A; putative formula: C14H33N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.543,"smiles":null,"spectrum_id":"CCMSLIB00017247500","spectrum_index":20796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(1H-Benzimidazol-2-yl)-4-fluorobenzamide (delta mass: 159.0982 Da; putative annotation: N/A; putative formula: C2H9N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.186,"smiles":null,"spectrum_id":"CCMSLIB00017247503","spectrum_index":20797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYPHENYLACETIC ACID (delta mass: 31.0426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.097,"smiles":null,"spectrum_id":"CCMSLIB00017247505","spectrum_index":20798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 67.9891 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.07,"smiles":null,"spectrum_id":"CCMSLIB00017247508","spectrum_index":20799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 213.1153 Da; putative annotation: N/A; putative formula: C14H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.212,"smiles":null,"spectrum_id":"CCMSLIB00017247509","spectrum_index":20800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 202.0719 Da; putative annotation: N/A; putative formula: C7H6N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.148,"smiles":null,"spectrum_id":"CCMSLIB00017247512","spectrum_index":20801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 128.0626 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.185,"smiles":null,"spectrum_id":"CCMSLIB00017247515","spectrum_index":20802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meropenem (delta mass: 105.0598 Da; putative annotation: N/A; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.219,"smiles":null,"spectrum_id":"CCMSLIB00017247516","spectrum_index":20803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 86.0499 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.292,"smiles":null,"spectrum_id":"CCMSLIB00017247519","spectrum_index":20804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 130.1358 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.217,"smiles":null,"spectrum_id":"CCMSLIB00017247520","spectrum_index":20805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 58.033 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.13,"smiles":null,"spectrum_id":"CCMSLIB00017247523","spectrum_index":20806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Leu (delta mass: 168.054 Da; putative annotation: N/A; putative formula: C7H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.209,"smiles":null,"spectrum_id":"CCMSLIB00017247524","spectrum_index":20807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6.alpha.,11.beta.)-11-hydroxy-6-methylpregn-4-ene-3,20-dione (delta mass: 48.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.274,"smiles":null,"spectrum_id":"CCMSLIB00017247527","spectrum_index":20808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 57.0307 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.2,"smiles":null,"spectrum_id":"CCMSLIB00017247529","spectrum_index":20809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olaquindox (delta mass: 18.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.13,"smiles":null,"spectrum_id":"CCMSLIB00017247531","spectrum_index":20810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 115.9876 Da; putative annotation: N/A; putative formula: C3H4N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.048,"smiles":null,"spectrum_id":"CCMSLIB00017247534","spectrum_index":20811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine propyl ester (delta mass: 129.0526 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.16,"smiles":null,"spectrum_id":"CCMSLIB00017247535","spectrum_index":20812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 73.0156 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.117,"smiles":null,"spectrum_id":"CCMSLIB00017247538","spectrum_index":20813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 291.0367 Da; putative annotation: N/A; putative formula: C7H10N5O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.16,"smiles":null,"spectrum_id":"CCMSLIB00017247540","spectrum_index":20814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380550-01_C24H40O5_4-{[5-(6-Hydroxy-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl)-3-methylpentyl]oxy}-4-oxobutanoic acid (delta mass: 308.2704 Da; putative annotation: N/A; putative formula: C20H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.565,"smiles":null,"spectrum_id":"CCMSLIB00017247542","spectrum_index":20815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 720.2533 Da; putative annotation: N/A; putative formula: C24H48O24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":919.34,"smiles":null,"spectrum_id":"CCMSLIB00017247545","spectrum_index":20816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 326.1723 Da; putative annotation: N/A; putative formula: C17H26O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.342,"smiles":null,"spectrum_id":"CCMSLIB00017247547","spectrum_index":20817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroeburicoic acid (delta mass: 112.0676 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.435,"smiles":null,"spectrum_id":"CCMSLIB00017247548","spectrum_index":20818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid (delta mass: 70.0779 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.341,"smiles":null,"spectrum_id":"CCMSLIB00017247551","spectrum_index":20819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 158.0659 Da; putative annotation: N/A; putative formula: C2H6N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.168,"smiles":null,"spectrum_id":"CCMSLIB00017247554","spectrum_index":20820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 190.0998 Da; putative annotation: N/A; putative formula: C5H14N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.337,"smiles":null,"spectrum_id":"CCMSLIB00017247555","spectrum_index":20821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 327.2327 Da; putative annotation: N/A; putative formula: C18H34NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.47,"smiles":null,"spectrum_id":"CCMSLIB00017247558","spectrum_index":20822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 332.1473 Da; putative annotation: N/A; putative formula: C15H24O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.218,"smiles":null,"spectrum_id":"CCMSLIB00017247559","spectrum_index":20823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 15.0105 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.091,"smiles":null,"spectrum_id":"CCMSLIB00017247562","spectrum_index":20824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 148.085 Da; putative annotation: N/A; putative formula: C6H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.151,"smiles":null,"spectrum_id":"CCMSLIB00017247563","spectrum_index":20825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 136.0525 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.175,"smiles":null,"spectrum_id":"CCMSLIB00017247566","spectrum_index":20826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 236.1203 Da; putative annotation: N/A; putative formula: C12H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.196,"smiles":null,"spectrum_id":"CCMSLIB00017247567","spectrum_index":20827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dimyristoyl-sn-glycero-3-phospho-L-serine (delta mass: 82.0793 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.529,"smiles":null,"spectrum_id":"CCMSLIB00017247570","spectrum_index":20828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyclopropylcarbonyl)-3-piperidinamine (delta mass: 128.0106 Da; putative annotation: N/A; putative formula: C5H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.144,"smiles":null,"spectrum_id":"CCMSLIB00017247573","spectrum_index":20829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5,9-trihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one (delta mass: 88.0719 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.226,"smiles":null,"spectrum_id":"CCMSLIB00017247575","spectrum_index":20830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 60.0039 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.226,"smiles":null,"spectrum_id":"CCMSLIB00017247577","spectrum_index":20831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine, 2-(diphenylmethyl)-, (2S)- (delta mass: 116.0536 Da; putative annotation: N/A; putative formula: C3H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.213,"smiles":null,"spectrum_id":"CCMSLIB00017247580","spectrum_index":20832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 84.0688 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.129,"smiles":null,"spectrum_id":"CCMSLIB00017247581","spectrum_index":20833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine, 2-(diphenylmethyl)-, (2S)- (delta mass: 51.0181 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.177,"smiles":null,"spectrum_id":"CCMSLIB00017247584","spectrum_index":20834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 101.036 Da; putative annotation: N/A; putative formula: C6H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.138,"smiles":null,"spectrum_id":"CCMSLIB00017247587","spectrum_index":20835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hemslecin B (delta mass: 162.0527 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.4,"smiles":null,"spectrum_id":"CCMSLIB00017247588","spectrum_index":20836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 200.1172 Da; putative annotation: N/A; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.251,"smiles":null,"spectrum_id":"CCMSLIB00017247591","spectrum_index":20837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 9.0002 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.076,"smiles":null,"spectrum_id":"CCMSLIB00017247593","spectrum_index":20838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 361.1752 Da; putative annotation: N/A; putative formula: C17H23N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.246,"smiles":null,"spectrum_id":"CCMSLIB00017247595","spectrum_index":20839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 100.0671 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017247598","spectrum_index":20840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopentene-1-octanoic acid, 5-(2-carboxyethyl)-.epsilon.,4-dioxo-, (1S,5R)- (delta mass: 78.0468 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.196,"smiles":null,"spectrum_id":"CCMSLIB00017247599","spectrum_index":20841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000773 Dehydrohistidyl-tryptophanyl-diketopiperazine|(e)-3-(1h-imidazol-4-ylmethylene)-6-(1h-indol-3-ylmethyl)-2,5-piperazinedione (delta mass: 86.0728 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.203,"smiles":null,"spectrum_id":"CCMSLIB00017247602","spectrum_index":20842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 440.2271 Da; putative annotation: N/A; putative formula: C20H32N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.293,"smiles":null,"spectrum_id":"CCMSLIB00017247603","spectrum_index":20843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 433.2202 Da; putative annotation: N/A; putative formula: C16H32N7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.286,"smiles":null,"spectrum_id":"CCMSLIB00017247606","spectrum_index":20844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-11-(3-pentyl-2-oxiranyl)-10E-undecenoic acid (delta mass: 621.4891 Da; putative annotation: N/A; putative formula: C37H68NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":932.711,"smiles":null,"spectrum_id":"CCMSLIB00017247607","spectrum_index":20845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 37.9407 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.027,"smiles":null,"spectrum_id":"CCMSLIB00017247610","spectrum_index":20846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)propanamide (delta mass: 197.141 Da; putative annotation: N/A; putative formula: C11H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.275,"smiles":null,"spectrum_id":"CCMSLIB00017247613","spectrum_index":20847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 62.0521 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.279,"smiles":null,"spectrum_id":"CCMSLIB00017247614","spectrum_index":20848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 74.0544 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.37,"smiles":null,"spectrum_id":"CCMSLIB00017247617","spectrum_index":20849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terpestacin (delta mass: 82.0435 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.328,"smiles":null,"spectrum_id":"CCMSLIB00017247619","spectrum_index":20850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetinic acid (delta mass: 28.0314 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.378,"smiles":null,"spectrum_id":"CCMSLIB00017247621","spectrum_index":20851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 256.142 Da; putative annotation: N/A; putative formula: C12H20N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.254,"smiles":null,"spectrum_id":"CCMSLIB00017247623","spectrum_index":20852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Amyrenonol (delta mass: 16.9973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.37,"smiles":null,"spectrum_id":"CCMSLIB00017247626","spectrum_index":20853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-1-(2-Hydroxyethyl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol (delta mass: 62.0505 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.282,"smiles":null,"spectrum_id":"CCMSLIB00017247629","spectrum_index":20854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10-2 (delta mass: 156.1225 Da; putative annotation: N/A; putative formula: C4H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.37,"smiles":null,"spectrum_id":"CCMSLIB00017247631","spectrum_index":20855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 172.116 Da; putative annotation: N/A; putative formula: C7H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.348,"smiles":null,"spectrum_id":"CCMSLIB00017247633","spectrum_index":20856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 121.0725 Da; putative annotation: N/A; putative formula: H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.32,"smiles":null,"spectrum_id":"CCMSLIB00017247636","spectrum_index":20857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331602 Linoleic acid|(9Z,12Z)-octadeca-9,12-dienoic acid (delta mass: 370.2025 Da; putative annotation: N/A; putative formula: C18H31N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.45,"smiles":null,"spectrum_id":"CCMSLIB00017247638","spectrum_index":20858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 19.9889 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.07,"smiles":null,"spectrum_id":"CCMSLIB00017247641","spectrum_index":20859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 622.2786 Da; putative annotation: N/A; putative formula: C36H46O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1157.55,"smiles":null,"spectrum_id":"CCMSLIB00017247643","spectrum_index":20860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 112.0906 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.197,"smiles":null,"spectrum_id":"CCMSLIB00017247646","spectrum_index":20861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 88.0555 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.136,"smiles":null,"spectrum_id":"CCMSLIB00017247647","spectrum_index":20862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 319.1269 Da; putative annotation: N/A; putative formula: C13H21NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.266,"smiles":null,"spectrum_id":"CCMSLIB00017247650","spectrum_index":20863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:UA006001 L-(+)-Ergothioneine|L-Ergothioneine|5-[(2S)-2-Carboxy-2-(trimethylazaniumyl)ethyl]-1H-imidazole-2-thiolate (delta mass: 41.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.153,"smiles":null,"spectrum_id":"CCMSLIB00017247653","spectrum_index":20864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 101.0472 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017247655","spectrum_index":20865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4aR,5S)-9-Hydroxy-3,4a,5-trimethyl-4,5,6,7,8,8a,9,9a-octahydrobenzo[f][1]benzofuran-2-one (delta mass: 72.032 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.196,"smiles":null,"spectrum_id":"CCMSLIB00017247657","spectrum_index":20866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((6aR,9R,10aR)-7-methyl-4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg]quinolin-9-yl)methanol (delta mass: 75.024 Da; putative annotation: N/A; putative formula: C2H6NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.189,"smiles":null,"spectrum_id":"CCMSLIB00017247659","spectrum_index":20867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 131.0976 Da; putative annotation: N/A; putative formula: C5H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.147,"smiles":null,"spectrum_id":"CCMSLIB00017247662","spectrum_index":20868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 60.1295 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.179,"smiles":null,"spectrum_id":"CCMSLIB00017247663","spectrum_index":20869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 52.9854 Da; putative annotation: N/A; putative formula: C2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017247666","spectrum_index":20870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 130.003 Da; putative annotation: N/A; putative formula: C4H6N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.074,"smiles":null,"spectrum_id":"CCMSLIB00017247669","spectrum_index":20871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 44.0243 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017247670","spectrum_index":20872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12,13-Dihydroxy-9Z-octadecenoic acid (delta mass: 38.0154 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.268,"smiles":null,"spectrum_id":"CCMSLIB00017247672","spectrum_index":20873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[5-(7-Hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentoxy]-4-oxobutanoic acid (delta mass: 50.0517 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.347,"smiles":null,"spectrum_id":"CCMSLIB00017247674","spectrum_index":20874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 414.2989 Da; putative annotation: N/A; putative formula: C24H46OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.338,"smiles":null,"spectrum_id":"CCMSLIB00017247677","spectrum_index":20875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 173.1417 Da; putative annotation: N/A; putative formula: C9H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.222,"smiles":null,"spectrum_id":"CCMSLIB00017247678","spectrum_index":20876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 114.0832 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.154,"smiles":null,"spectrum_id":"CCMSLIB00017247681","spectrum_index":20877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 209.1055 Da; putative annotation: N/A; putative formula: C11H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.181,"smiles":null,"spectrum_id":"CCMSLIB00017247682","spectrum_index":20878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cys-His (delta mass: 100.9918 Da; putative annotation: N/A; putative formula: C6H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.078,"smiles":null,"spectrum_id":"CCMSLIB00017247685","spectrum_index":20879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antipain (delta mass: 103.0087 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.36,"smiles":null,"spectrum_id":"CCMSLIB00017247687","spectrum_index":20880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384874-01!6-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxypyran-2-one (delta mass: 245.127 Da; putative annotation: N/A; putative formula: C12H23NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.234,"smiles":null,"spectrum_id":"CCMSLIB00017247690","spectrum_index":20881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 184.1397 Da; putative annotation: N/A; putative formula: C10H20N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.189,"smiles":null,"spectrum_id":"CCMSLIB00017247693","spectrum_index":20882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 696.1739 Da; putative annotation: N/A; putative formula: C25H40N6O9S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":877.245,"smiles":null,"spectrum_id":"CCMSLIB00017247694","spectrum_index":20883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 198.0894 Da; putative annotation: N/A; putative formula: C10H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.196,"smiles":null,"spectrum_id":"CCMSLIB00017247697","spectrum_index":20884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 41.0277 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.103,"smiles":null,"spectrum_id":"CCMSLIB00017247700","spectrum_index":20885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinic Acid (delta mass: 76.0313 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.102,"smiles":null,"spectrum_id":"CCMSLIB00017247701","spectrum_index":20886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 338.3179 Da; putative annotation: N/A; putative formula: C22H42O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.623,"smiles":null,"spectrum_id":"CCMSLIB00017247704","spectrum_index":20887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 361.3194 Da; putative annotation: N/A; putative formula: C21H39N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.4,"smiles":null,"spectrum_id":"CCMSLIB00017247705","spectrum_index":20888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4,6-difluoro-1H-indole-2-carboxylate (delta mass: 31.0126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.064,"smiles":null,"spectrum_id":"CCMSLIB00017247708","spectrum_index":20889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 82.0262 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.065,"smiles":null,"spectrum_id":"CCMSLIB00017247711","spectrum_index":20890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 47.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.192,"smiles":null,"spectrum_id":"CCMSLIB00017247712","spectrum_index":20891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 124.0516 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.221,"smiles":null,"spectrum_id":"CCMSLIB00017247715","spectrum_index":20892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Leu from NIST14 (delta mass: 282.1475 Da; putative annotation: N/A; putative formula: C8H22N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.318,"smiles":null,"spectrum_id":"CCMSLIB00017247716","spectrum_index":20893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 410.1547 Da; putative annotation: N/A; putative formula: C26H23N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.25,"smiles":null,"spectrum_id":"CCMSLIB00017247719","spectrum_index":20894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 643.3406 Da; putative annotation: N/A; putative formula: C33H49N5O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.401,"smiles":null,"spectrum_id":"CCMSLIB00017247721","spectrum_index":20895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 17.9923 Da; putative annotation: N/A; putative formula: C3H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.042,"smiles":null,"spectrum_id":"CCMSLIB00017247723","spectrum_index":20896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-7-carboxylic acid (delta mass: 51.0671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.13,"smiles":null,"spectrum_id":"CCMSLIB00017247725","spectrum_index":20897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-1,3-Dihydroxydammara-12,24-dien-26-oic acid (delta mass: 90.089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.451,"smiles":null,"spectrum_id":"CCMSLIB00017247728","spectrum_index":20898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 146.1093 Da; putative annotation: N/A; putative formula: C11H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.336,"smiles":null,"spectrum_id":"CCMSLIB00017247730","spectrum_index":20899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-Butaprost (delta mass: 66.0466 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.341,"smiles":null,"spectrum_id":"CCMSLIB00017247732","spectrum_index":20900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 152.0474 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.176,"smiles":null,"spectrum_id":"CCMSLIB00017247734","spectrum_index":20901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 116.0989 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.31,"smiles":null,"spectrum_id":"CCMSLIB00017247736","spectrum_index":20902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 95.0373 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.097,"smiles":null,"spectrum_id":"CCMSLIB00017247739","spectrum_index":20903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU249104 2-Hydroxyquinoline|1H-quinolin-2-one (delta mass: 41.4214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.481,"smiles":null,"spectrum_id":"CCMSLIB00017247740","spectrum_index":20904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 139.0309 Da; putative annotation: N/A; putative formula: C4H5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.086,"smiles":null,"spectrum_id":"CCMSLIB00017247743","spectrum_index":20905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 175.0632 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017247746","spectrum_index":20906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 38.1084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.21,"smiles":null,"spectrum_id":"CCMSLIB00017247747","spectrum_index":20907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 485.2637 Da; putative annotation: N/A; putative formula: C35H36NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.324,"smiles":null,"spectrum_id":"CCMSLIB00017247750","spectrum_index":20908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trimellitic acid anhydride (delta mass: 60.0218 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.035,"smiles":null,"spectrum_id":"CCMSLIB00017247751","spectrum_index":20909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tripropylene glycol (delta mass: 567.4327 Da; putative annotation: N/A; putative formula: C33H61NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.576,"smiles":null,"spectrum_id":"CCMSLIB00017247754","spectrum_index":20910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole - 40.0 eV (delta mass: 32.0618 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.127,"smiles":null,"spectrum_id":"CCMSLIB00017247755","spectrum_index":20911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethylpiperazine (delta mass: 41.0139 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.137,"smiles":null,"spectrum_id":"CCMSLIB00017247758","spectrum_index":20912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-Butylidene-6,7-dihydroxy-4,5,6,7-tetrahydro-2-benzofuran-1-one (delta mass: 17.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.139,"smiles":null,"spectrum_id":"CCMSLIB00017247759","spectrum_index":20913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Loggerpeptin A (delta mass: 17.0241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1010.55,"smiles":null,"spectrum_id":"CCMSLIB00017247762","spectrum_index":20914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxybenzoic acid (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.06,"smiles":null,"spectrum_id":"CCMSLIB00017247763","spectrum_index":20915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 941.3577 Da; putative annotation: N/A; putative formula: C41H59N5O18S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1284.48,"smiles":null,"spectrum_id":"CCMSLIB00017247766","spectrum_index":20916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Leu (delta mass: 113.0839 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.254,"smiles":null,"spectrum_id":"CCMSLIB00017247768","spectrum_index":20917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 36.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.202,"smiles":null,"spectrum_id":"CCMSLIB00017247770","spectrum_index":20918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 149.0846 Da; putative annotation: N/A; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.176,"smiles":null,"spectrum_id":"CCMSLIB00017247773","spectrum_index":20919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 297.1218 Da; putative annotation: N/A; putative formula: C15H23NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.193,"smiles":null,"spectrum_id":"CCMSLIB00017247775","spectrum_index":20920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 388.2766 Da; putative annotation: N/A; putative formula: C28H36O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.368,"smiles":null,"spectrum_id":"CCMSLIB00017247777","spectrum_index":20921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Hydroxy-15-kauren-19-oic acid (delta mass: 78.0841 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.311,"smiles":null,"spectrum_id":"CCMSLIB00017247780","spectrum_index":20922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Lys (delta mass: 128.0951 Da; putative annotation: N/A; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.267,"smiles":null,"spectrum_id":"CCMSLIB00017247782","spectrum_index":20923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 332.1101 Da; putative annotation: N/A; putative formula: C12H8N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.259,"smiles":null,"spectrum_id":"CCMSLIB00017247784","spectrum_index":20924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 69.0425 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.254,"smiles":null,"spectrum_id":"CCMSLIB00017247787","spectrum_index":20925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 94.0848 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.18,"smiles":null,"spectrum_id":"CCMSLIB00017247789","spectrum_index":20926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 140.2297 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.311,"smiles":null,"spectrum_id":"CCMSLIB00017247791","spectrum_index":20927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-6E,8Z,11Z,14Z,17Z-eicosapentaenoic acid (delta mass: 34.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.28,"smiles":null,"spectrum_id":"CCMSLIB00017247793","spectrum_index":20928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 alcohol (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.279,"smiles":null,"spectrum_id":"CCMSLIB00017247795","spectrum_index":20929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Arabinose (delta mass: 112.0674 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017247798","spectrum_index":20930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 60.0689 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.129,"smiles":null,"spectrum_id":"CCMSLIB00017247800","spectrum_index":20931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 243.2081 Da; putative annotation: N/A; putative formula: C16H25N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.284,"smiles":null,"spectrum_id":"CCMSLIB00017247802","spectrum_index":20932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 114.039 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.162,"smiles":null,"spectrum_id":"CCMSLIB00017247805","spectrum_index":20933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 70.0417 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.31,"smiles":null,"spectrum_id":"CCMSLIB00017247807","spectrum_index":20934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 443.3492 Da; putative annotation: N/A; putative formula: C23H41N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.628,"smiles":null,"spectrum_id":"CCMSLIB00017247809","spectrum_index":20935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 109.0529 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.139,"smiles":null,"spectrum_id":"CCMSLIB00017247812","spectrum_index":20936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 739.27 Da; putative annotation: N/A; putative formula: C35H41N5O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.33,"smiles":null,"spectrum_id":"CCMSLIB00017247813","spectrum_index":20937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 50.0517 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.175,"smiles":null,"spectrum_id":"CCMSLIB00017247816","spectrum_index":20938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 430.1153 Da; putative annotation: N/A; putative formula: C28H20N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.212,"smiles":null,"spectrum_id":"CCMSLIB00017247818","spectrum_index":20939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 114.0312 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.208,"smiles":null,"spectrum_id":"CCMSLIB00017247820","spectrum_index":20940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 19.0406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.122,"smiles":null,"spectrum_id":"CCMSLIB00017247823","spectrum_index":20941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentaethylene glycol (delta mass: 154.1725 Da; putative annotation: N/A; putative formula: C11H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.321,"smiles":null,"spectrum_id":"CCMSLIB00017247824","spectrum_index":20942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 183.0888 Da; putative annotation: N/A; putative formula: C9H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017247827","spectrum_index":20943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 16.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017247828","spectrum_index":20944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 147.053 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.124,"smiles":null,"spectrum_id":"CCMSLIB00017247831","spectrum_index":20945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 101.0476 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.118,"smiles":null,"spectrum_id":"CCMSLIB00017247833","spectrum_index":20946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Gln (delta mass: 113.0843 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.229,"smiles":null,"spectrum_id":"CCMSLIB00017247835","spectrum_index":20947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 335.3534 Da; putative annotation: N/A; putative formula: C23H45N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.445,"smiles":null,"spectrum_id":"CCMSLIB00017247838","spectrum_index":20948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisucaberin (delta mass: 217.1421 Da; putative annotation: N/A; putative formula: C11H24NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.382,"smiles":null,"spectrum_id":"CCMSLIB00017247839","spectrum_index":20949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 417.2596 Da; putative annotation: N/A; putative formula: C19H31N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.346,"smiles":null,"spectrum_id":"CCMSLIB00017247842","spectrum_index":20950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetylbenzoic acid (delta mass: 74.0722 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.127,"smiles":null,"spectrum_id":"CCMSLIB00017247843","spectrum_index":20951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 43.9565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.059,"smiles":null,"spectrum_id":"CCMSLIB00017247846","spectrum_index":20952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 135.0801 Da; putative annotation: N/A; putative formula: C7H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.156,"smiles":null,"spectrum_id":"CCMSLIB00017247847","spectrum_index":20953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 155.0223 Da; putative annotation: N/A; putative formula: C6H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.049,"smiles":null,"spectrum_id":"CCMSLIB00017247850","spectrum_index":20954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthro[3,2-b]furan-9(1H)-one, 2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro-6,10a-dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl- (delta mass: 118.0775 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.294,"smiles":null,"spectrum_id":"CCMSLIB00017247852","spectrum_index":20955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 75.0895 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.145,"smiles":null,"spectrum_id":"CCMSLIB00017247854","spectrum_index":20956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Hydroxy-7-oxoabiet-8(14)-en-18-oic acid (delta mass: 45.0583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.28,"smiles":null,"spectrum_id":"CCMSLIB00017247857","spectrum_index":20957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 599.4033 Da; putative annotation: N/A; putative formula: C32H57NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.536,"smiles":null,"spectrum_id":"CCMSLIB00017247859","spectrum_index":20958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Deoxy-11-methyleneprostaglandin D2 (delta mass: 301.239 Da; putative annotation: N/A; putative formula: C14H32N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.492,"smiles":null,"spectrum_id":"CCMSLIB00017247861","spectrum_index":20959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 399.1752 Da; putative annotation: N/A; putative formula: C26H26NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.246,"smiles":null,"spectrum_id":"CCMSLIB00017247864","spectrum_index":20960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(10)-EpOME from NIST14 (delta mass: 281.2716 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.514,"smiles":null,"spectrum_id":"CCMSLIB00017247867","spectrum_index":20961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 47.0217 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.104,"smiles":null,"spectrum_id":"CCMSLIB00017247869","spectrum_index":20962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 41.0822 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.163,"smiles":null,"spectrum_id":"CCMSLIB00017247871","spectrum_index":20963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 142.1389 Da; putative annotation: N/A; putative formula: C9H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.246,"smiles":null,"spectrum_id":"CCMSLIB00017247874","spectrum_index":20964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 202.1721 Da; putative annotation: N/A; putative formula: C15H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.177,"smiles":null,"spectrum_id":"CCMSLIB00017247875","spectrum_index":20965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 102.0138 Da; putative annotation: N/A; putative formula: C4H6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.147,"smiles":null,"spectrum_id":"CCMSLIB00017247878","spectrum_index":20966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 (delta mass: 64.0308 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.279,"smiles":null,"spectrum_id":"CCMSLIB00017247880","spectrum_index":20967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Populin (delta mass: 268.0842 Da; putative annotation: N/A; putative formula: C7H16N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.223,"smiles":null,"spectrum_id":"CCMSLIB00017247883","spectrum_index":20968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 123.0684 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.197,"smiles":null,"spectrum_id":"CCMSLIB00017247885","spectrum_index":20969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ramosetron (delta mass: 145.0721 Da; putative annotation: N/A; putative formula: C2H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.216,"smiles":null,"spectrum_id":"CCMSLIB00017247887","spectrum_index":20970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 59.0006 Da; putative annotation: N/A; putative formula: CHNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.097,"smiles":null,"spectrum_id":"CCMSLIB00017247890","spectrum_index":20971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 108.114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.221,"smiles":null,"spectrum_id":"CCMSLIB00017247892","spectrum_index":20972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 136.0458 Da; putative annotation: N/A; putative formula: C7H8N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.142,"smiles":null,"spectrum_id":"CCMSLIB00017247894","spectrum_index":20973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid CollisionEnergy:205060\"\" (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017247897","spectrum_index":20974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 77.0844 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.306,"smiles":null,"spectrum_id":"CCMSLIB00017247899","spectrum_index":20975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS000728643-01!spiro[1H-indole-3,3'-pyrrolidine]-2,2'-dione\"\" (delta mass: 82.0784 Da; putative annotation: N/A; putative formula: C6H10)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.16,"smiles":null,"spectrum_id":"CCMSLIB00017247901","spectrum_index":20976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 211.1204 Da; putative annotation: N/A; putative formula: C11H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.196,"smiles":null,"spectrum_id":"CCMSLIB00017247904","spectrum_index":20977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(8Z,11Z,14Z-Eicosatrienoyl)ethanolamine (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.368,"smiles":null,"spectrum_id":"CCMSLIB00017247905","spectrum_index":20978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 36.036 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.226,"smiles":null,"spectrum_id":"CCMSLIB00017247908","spectrum_index":20979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 78.0466 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.101,"smiles":null,"spectrum_id":"CCMSLIB00017247911","spectrum_index":20980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 53.0158 Da; putative annotation: N/A; putative formula: H-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.118,"smiles":null,"spectrum_id":"CCMSLIB00017247914","spectrum_index":20981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 32.0236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.052,"smiles":null,"spectrum_id":"CCMSLIB00017247916","spectrum_index":20982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thelephoric acid (delta mass: 64.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.08,"smiles":null,"spectrum_id":"CCMSLIB00017247919","spectrum_index":20983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 4.9118 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":114.972,"smiles":null,"spectrum_id":"CCMSLIB00017247922","spectrum_index":20984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 483.3186 Da; putative annotation: N/A; putative formula: C30H47NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.405,"smiles":null,"spectrum_id":"CCMSLIB00017247923","spectrum_index":20985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10Z,14E)-6,14-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.217,"smiles":null,"spectrum_id":"CCMSLIB00017247926","spectrum_index":20986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 31.0787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.3,"smiles":null,"spectrum_id":"CCMSLIB00017247929","spectrum_index":20987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Hydroperoxy-5Z,8Z,10E,14Z,17Z-eicosapentaenoic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017247931","spectrum_index":20988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 321.1677 Da; putative annotation: N/A; putative formula: C18H28NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.317,"smiles":null,"spectrum_id":"CCMSLIB00017247934","spectrum_index":20989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 83.0361 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.096,"smiles":null,"spectrum_id":"CCMSLIB00017247937","spectrum_index":20990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Methylsulfonyl)-13-(3-pentyloxiranyl)-5Z,8Z,11Z-tridecatrienamide (delta mass: 106.0721 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.308,"smiles":null,"spectrum_id":"CCMSLIB00017247939","spectrum_index":20991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 160.1487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.328,"smiles":null,"spectrum_id":"CCMSLIB00017247941","spectrum_index":20992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 199.0487 Da; putative annotation: N/A; putative formula: C9H13NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.14,"smiles":null,"spectrum_id":"CCMSLIB00017247944","spectrum_index":20993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycerol (delta mass: 256.178 Da; putative annotation: N/A; putative formula: C15H29O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":877.723,"smiles":null,"spectrum_id":"CCMSLIB00017247947","spectrum_index":20994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine; AIF; CE0; MS2Dec (delta mass: 59.0158 Da; putative annotation: N/A; putative formula: C5HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.102,"smiles":null,"spectrum_id":"CCMSLIB00017247950","spectrum_index":20995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 194.0424 Da; putative annotation: N/A; putative formula: C6H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.207,"smiles":null,"spectrum_id":"CCMSLIB00017247953","spectrum_index":20996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 31.3837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.443,"smiles":null,"spectrum_id":"CCMSLIB00017247956","spectrum_index":20997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Diethyl-2-aminoethanol (delta mass: 12.0365 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":130.159,"smiles":null,"spectrum_id":"CCMSLIB00017247959","spectrum_index":20998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 104.0635 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.301,"smiles":null,"spectrum_id":"CCMSLIB00017247962","spectrum_index":20999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 17.8588 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.044,"smiles":null,"spectrum_id":"CCMSLIB00017247964","spectrum_index":21000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 105.1193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.216,"smiles":null,"spectrum_id":"CCMSLIB00017247967","spectrum_index":21001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 24.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.18,"smiles":null,"spectrum_id":"CCMSLIB00017247969","spectrum_index":21002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 32.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.086,"smiles":null,"spectrum_id":"CCMSLIB00017247972","spectrum_index":21003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 131.058 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.16,"smiles":null,"spectrum_id":"CCMSLIB00017247975","spectrum_index":21004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-.beta.-carboline (delta mass: 338.1928 Da; putative annotation: N/A; putative formula: C12H22N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.3,"smiles":null,"spectrum_id":"CCMSLIB00017247977","spectrum_index":21005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 216.0995 Da; putative annotation: N/A; putative formula: C10H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.14,"smiles":null,"spectrum_id":"CCMSLIB00017247980","spectrum_index":21006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 78.0443 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.156,"smiles":null,"spectrum_id":"CCMSLIB00017247983","spectrum_index":21007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 372.2882 Da; putative annotation: N/A; putative formula: C22H44S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.338,"smiles":null,"spectrum_id":"CCMSLIB00017247986","spectrum_index":21008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 304.1917 Da; putative annotation: N/A; putative formula: C14H29N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.331,"smiles":null,"spectrum_id":"CCMSLIB00017247988","spectrum_index":21009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eicosapentaenoyl ethanolamide (delta mass: 618.4617 Da; putative annotation: N/A; putative formula: C37H58N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":964.736,"smiles":null,"spectrum_id":"CCMSLIB00017247991","spectrum_index":21010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 90.0468 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.248,"smiles":null,"spectrum_id":"CCMSLIB00017247995","spectrum_index":21011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 120.0559 Da; putative annotation: N/A; putative formula: C2H9N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.127,"smiles":null,"spectrum_id":"CCMSLIB00017247998","spectrum_index":21012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 204.0426 Da; putative annotation: N/A; putative formula: C11H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.113,"smiles":null,"spectrum_id":"CCMSLIB00017247999","spectrum_index":21013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Penten-1-ol, 5-phenyl-, (4E)- (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.127,"smiles":null,"spectrum_id":"CCMSLIB00017248003","spectrum_index":21014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 35.0411 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.159,"smiles":null,"spectrum_id":"CCMSLIB00017248006","spectrum_index":21015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 346.1712 Da; putative annotation: N/A; putative formula: C21H23N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.294,"smiles":null,"spectrum_id":"CCMSLIB00017248009","spectrum_index":21016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 302.0997 Da; putative annotation: N/A; putative formula: C13H18O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.249,"smiles":null,"spectrum_id":"CCMSLIB00017248011","spectrum_index":21017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Hydroperoxy-5Z,8Z,11Z,13E-eicosatetraenoic acid (delta mass: 14.0161 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017248013","spectrum_index":21018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aminoglutethimide (delta mass: 28.9973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.126,"smiles":null,"spectrum_id":"CCMSLIB00017248016","spectrum_index":21019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 93.976 Da; putative annotation: N/A; putative formula: H3N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.49,"smiles":null,"spectrum_id":"CCMSLIB00017248020","spectrum_index":21020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Ethoxy-2-mercaptobenzimidazole (delta mass: 18.0643 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.123,"smiles":null,"spectrum_id":"CCMSLIB00017248021","spectrum_index":21021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile (delta mass: 55.1231 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.135,"smiles":null,"spectrum_id":"CCMSLIB00017248024","spectrum_index":21022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodecanoic acid (delta mass: 28.0312 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.216,"smiles":null,"spectrum_id":"CCMSLIB00017248027","spectrum_index":21023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 229.0948 Da; putative annotation: N/A; putative formula: C10H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.264,"smiles":null,"spectrum_id":"CCMSLIB00017248031","spectrum_index":21024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 40.0321 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.098,"smiles":null,"spectrum_id":"CCMSLIB00017248032","spectrum_index":21025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 152.1531 Da; putative annotation: N/A; putative formula: C11H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.39,"smiles":null,"spectrum_id":"CCMSLIB00017248035","spectrum_index":21026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lithocholylglycine (delta mass: 48.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.369,"smiles":null,"spectrum_id":"CCMSLIB00017248039","spectrum_index":21027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 93.0574 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.133,"smiles":null,"spectrum_id":"CCMSLIB00017248042","spectrum_index":21028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017248044","spectrum_index":21029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzoic acid (delta mass: 54.0832 Da; putative annotation: N/A; putative formula: C5H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017248047","spectrum_index":21030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mer-N5075-A_35716_dereplictor_pv_5.17819e-12 (delta mass: 310.0704 Da; putative annotation: N/A; putative formula: C15H10N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":908.405,"smiles":null,"spectrum_id":"CCMSLIB00017248050","spectrum_index":21031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 494.3476 Da; putative annotation: N/A; putative formula: C27H50N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.408,"smiles":null,"spectrum_id":"CCMSLIB00017248052","spectrum_index":21032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 87.068 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.154,"smiles":null,"spectrum_id":"CCMSLIB00017248055","spectrum_index":21033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 80.035 Da; putative annotation: N/A; putative formula: C4H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.076,"smiles":null,"spectrum_id":"CCMSLIB00017248058","spectrum_index":21034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 98.0345 Da; putative annotation: N/A; putative formula: CH2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.111,"smiles":null,"spectrum_id":"CCMSLIB00017248059","spectrum_index":21035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 185.1393 Da; putative annotation: N/A; putative formula: C6H15N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.335,"smiles":null,"spectrum_id":"CCMSLIB00017248062","spectrum_index":21036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 78.083 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.325,"smiles":null,"spectrum_id":"CCMSLIB00017248064","spectrum_index":21037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 63.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.129,"smiles":null,"spectrum_id":"CCMSLIB00017248066","spectrum_index":21038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 173.0197 Da; putative annotation: N/A; putative formula: C4H-1N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.054,"smiles":null,"spectrum_id":"CCMSLIB00017248069","spectrum_index":21039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 68.0613 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.289,"smiles":null,"spectrum_id":"CCMSLIB00017248071","spectrum_index":21040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 209.07 Da; putative annotation: N/A; putative formula: C11H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.198,"smiles":null,"spectrum_id":"CCMSLIB00017248074","spectrum_index":21041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 122.1089 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.341,"smiles":null,"spectrum_id":"CCMSLIB00017248077","spectrum_index":21042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169963-02_C15H26O_(3,3,7-Trimethyltricyclo[5.4.0.0~2,9~]undec-8-yl)methanol (delta mass: 160.1102 Da; putative annotation: N/A; putative formula: C8H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.316,"smiles":null,"spectrum_id":"CCMSLIB00017248079","spectrum_index":21043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 163.9585 Da; putative annotation: N/A; putative formula: C3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.07,"smiles":null,"spectrum_id":"CCMSLIB00017248081","spectrum_index":21044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl syringate (delta mass: 226.1486 Da; putative annotation: N/A; putative formula: C13H23OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.24,"smiles":null,"spectrum_id":"CCMSLIB00017248084","spectrum_index":21045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,19-Dihydroxy-3-oxo-12-ursen-28-oic acid (delta mass: 82.0413 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.383,"smiles":null,"spectrum_id":"CCMSLIB00017248085","spectrum_index":21046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 194.138 Da; putative annotation: N/A; putative formula: C7H14N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.261,"smiles":null,"spectrum_id":"CCMSLIB00017248088","spectrum_index":21047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 453.2223 Da; putative annotation: N/A; putative formula: C20H31N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.325,"smiles":null,"spectrum_id":"CCMSLIB00017248091","spectrum_index":21048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 59.9653 Da; putative annotation: N/A; putative formula: COS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.047,"smiles":null,"spectrum_id":"CCMSLIB00017248093","spectrum_index":21049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 113.8914 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.983,"smiles":null,"spectrum_id":"CCMSLIB00017248096","spectrum_index":21050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,10a-Dihydroxy-4,4,7,11b-tetramethyl-1,2,3,4a,5,6,6a,7,11,11a-decahydronaphtho[2,1-f][1]benzofuran-9-one (delta mass: 50.0514 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.273,"smiles":null,"spectrum_id":"CCMSLIB00017248098","spectrum_index":21051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.233,"smiles":null,"spectrum_id":"CCMSLIB00017248101","spectrum_index":21052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 242.1928 Da; putative annotation: N/A; putative formula: C12H26N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.253,"smiles":null,"spectrum_id":"CCMSLIB00017248104","spectrum_index":21053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 77.9943 Da; putative annotation: N/A; putative formula: CH2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.143,"smiles":null,"spectrum_id":"CCMSLIB00017248107","spectrum_index":21054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidinol (delta mass: 310.2884 Da; putative annotation: N/A; putative formula: C20H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.469,"smiles":null,"spectrum_id":"CCMSLIB00017248109","spectrum_index":21055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 12.0 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.06,"smiles":null,"spectrum_id":"CCMSLIB00017248112","spectrum_index":21056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 84.0157 Da; putative annotation: N/A; putative formula: C3H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.192,"smiles":null,"spectrum_id":"CCMSLIB00017248115","spectrum_index":21057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin A (delta mass: 54.0108 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017248116","spectrum_index":21058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 119.0578 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.285,"smiles":null,"spectrum_id":"CCMSLIB00017248119","spectrum_index":21059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017248122","spectrum_index":21060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 424.3393 Da; putative annotation: N/A; putative formula: C26H50P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.577,"smiles":null,"spectrum_id":"CCMSLIB00017248125","spectrum_index":21061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Propoxyphenyl)-4-quinolinecarboxylic acid (delta mass: 17.0326 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.161,"smiles":null,"spectrum_id":"CCMSLIB00017248128","spectrum_index":21062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 162.0529 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.111,"smiles":null,"spectrum_id":"CCMSLIB00017248130","spectrum_index":21063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-[(3S)-piperidin-3-yl]acetate (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.202,"smiles":null,"spectrum_id":"CCMSLIB00017248133","spectrum_index":21064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Chlorobenzyl)-2-(1H-indol-3-yl)ethanamine (delta mass: 393.215 Da; putative annotation: N/A; putative formula: C21H31NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.33,"smiles":null,"spectrum_id":"CCMSLIB00017248136","spectrum_index":21065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 88.0679 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017248138","spectrum_index":21066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 250.1315 Da; putative annotation: N/A; putative formula: C13H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.271,"smiles":null,"spectrum_id":"CCMSLIB00017248141","spectrum_index":21067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 180.0184 Da; putative annotation: N/A; putative formula: C8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.1,"smiles":null,"spectrum_id":"CCMSLIB00017248144","spectrum_index":21068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 87.0317 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.097,"smiles":null,"spectrum_id":"CCMSLIB00017248146","spectrum_index":21069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 14.0163 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.071,"smiles":null,"spectrum_id":"CCMSLIB00017248148","spectrum_index":21070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Glu (delta mass: 191.0615 Da; putative annotation: N/A; putative formula: C7H13NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.181,"smiles":null,"spectrum_id":"CCMSLIB00017248151","spectrum_index":21071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 346.2356 Da; putative annotation: N/A; putative formula: C18H34O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.302,"smiles":null,"spectrum_id":"CCMSLIB00017248154","spectrum_index":21072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 63.0297 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.169,"smiles":null,"spectrum_id":"CCMSLIB00017248157","spectrum_index":21073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylpiperidine (delta mass: 364.1368 Da; putative annotation: N/A; putative formula: C15H24O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.28,"smiles":null,"spectrum_id":"CCMSLIB00017248159","spectrum_index":21074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholic Acid, Methyl Ester (delta mass: 212.1567 Da; putative annotation: N/A; putative formula: C16H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.467,"smiles":null,"spectrum_id":"CCMSLIB00017248162","spectrum_index":21075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM836501 Morpholine|Morpholin (delta mass: 40.0066 Da; putative annotation: N/A; putative formula: CN2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.082,"smiles":null,"spectrum_id":"CCMSLIB00017248165","spectrum_index":21076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 69.0942 Da; putative annotation: N/A; putative formula: C5H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017248167","spectrum_index":21077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylbenzoic acid (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017248170","spectrum_index":21078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 103.0392 Da; putative annotation: N/A; putative formula: C2H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.24,"smiles":null,"spectrum_id":"CCMSLIB00017248173","spectrum_index":21079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 9.9841 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.216,"smiles":null,"spectrum_id":"CCMSLIB00017248176","spectrum_index":21080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 355.7551 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.982,"smiles":null,"spectrum_id":"CCMSLIB00017248177","spectrum_index":21081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 206.1236 Da; putative annotation: N/A; putative formula: C12H18N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.215,"smiles":null,"spectrum_id":"CCMSLIB00017248180","spectrum_index":21082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-O-((2E)-3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoyl)hex-2-ulofuranosyl hexopyranoside (delta mass: 158.0338 Da; putative annotation: N/A; putative formula: C6H10N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.205,"smiles":null,"spectrum_id":"CCMSLIB00017248183","spectrum_index":21083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 363.2612 Da; putative annotation: N/A; putative formula: C22H39NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.483,"smiles":null,"spectrum_id":"CCMSLIB00017248186","spectrum_index":21084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Fluoro-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 179.0673 Da; putative annotation: N/A; putative formula: C4H5N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.165,"smiles":null,"spectrum_id":"CCMSLIB00017248188","spectrum_index":21085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 359.2307 Da; putative annotation: N/A; putative formula: C18H33NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.458,"smiles":null,"spectrum_id":"CCMSLIB00017248191","spectrum_index":21086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 228.0858 Da; putative annotation: N/A; putative formula: C8H12N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.135,"smiles":null,"spectrum_id":"CCMSLIB00017248193","spectrum_index":21087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydrozingerone (delta mass: 27.9944 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.08,"smiles":null,"spectrum_id":"CCMSLIB00017248195","spectrum_index":21088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-palmitoyl-D-erythro-sphinganine (delta mass: 162.0497 Da; putative annotation: N/A; putative formula: C4H11N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.585,"smiles":null,"spectrum_id":"CCMSLIB00017248198","spectrum_index":21089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,17-Dihydroxy-7-kauranone (delta mass: 98.0499 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.292,"smiles":null,"spectrum_id":"CCMSLIB00017248200","spectrum_index":21090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 868.1802 Da; putative annotation: N/A; putative formula: C28H34N14O15P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.29,"smiles":null,"spectrum_id":"CCMSLIB00017248203","spectrum_index":21091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 447.8213 Da; putative annotation: N/A; putative formula: C8H16O-1S11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.945,"smiles":null,"spectrum_id":"CCMSLIB00017248206","spectrum_index":21092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 904.4659 Da; putative annotation: N/A; putative formula: C49H68N4O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1214.58,"smiles":null,"spectrum_id":"CCMSLIB00017248208","spectrum_index":21093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 71.0431 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.218,"smiles":null,"spectrum_id":"CCMSLIB00017248210","spectrum_index":21094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 289.2426 Da; putative annotation: N/A; putative formula: C19H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.518,"smiles":null,"spectrum_id":"CCMSLIB00017248213","spectrum_index":21095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 324.1352 Da; putative annotation: N/A; putative formula: C14H21N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.185,"smiles":null,"spectrum_id":"CCMSLIB00017248217","spectrum_index":21096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Hyodeoxycholic acid (delta mass: 74.0522 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.352,"smiles":null,"spectrum_id":"CCMSLIB00017248219","spectrum_index":21097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Fluorobenzoyl)piperazine (delta mass: 78.0388 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.147,"smiles":null,"spectrum_id":"CCMSLIB00017248223","spectrum_index":21098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 14.0137 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.105,"smiles":null,"spectrum_id":"CCMSLIB00017248225","spectrum_index":21099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 46.0424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.269,"smiles":null,"spectrum_id":"CCMSLIB00017248227","spectrum_index":21100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 187.1481 Da; putative annotation: N/A; putative formula: C12H17N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.275,"smiles":null,"spectrum_id":"CCMSLIB00017248230","spectrum_index":21101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androsten-3.beta.-ol-17-one (delta mass: 50.0522 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.268,"smiles":null,"spectrum_id":"CCMSLIB00017248232","spectrum_index":21102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 694.8381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.935,"smiles":null,"spectrum_id":"CCMSLIB00017248235","spectrum_index":21103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androst-16-en-3.beta.-ol (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.289,"smiles":null,"spectrum_id":"CCMSLIB00017248238","spectrum_index":21104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 26.0255 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017248239","spectrum_index":21105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 314.2474 Da; putative annotation: N/A; putative formula: C19H30N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.313,"smiles":null,"spectrum_id":"CCMSLIB00017248242","spectrum_index":21106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 241.2039 Da; putative annotation: N/A; putative formula: C14H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.488,"smiles":null,"spectrum_id":"CCMSLIB00017248244","spectrum_index":21107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethyl ester (delta mass: 78.0461 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.325,"smiles":null,"spectrum_id":"CCMSLIB00017248246","spectrum_index":21108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 14.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.174,"smiles":null,"spectrum_id":"CCMSLIB00017248249","spectrum_index":21109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatinine (delta mass: 53.0136 Da; putative annotation: N/A; putative formula: H-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.08,"smiles":null,"spectrum_id":"CCMSLIB00017248251","spectrum_index":21110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 203.1158 Da; putative annotation: N/A; putative formula: C9H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.186,"smiles":null,"spectrum_id":"CCMSLIB00017248253","spectrum_index":21111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-linoleoyl-rac-glycerol (delta mass: 259.0507 Da; putative annotation: N/A; putative formula: C12H10N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":878.58,"smiles":null,"spectrum_id":"CCMSLIB00017248256","spectrum_index":21112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PETROSELINIC ACID (delta mass: 280.1479 Da; putative annotation: N/A; putative formula: C5H12N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.411,"smiles":null,"spectrum_id":"CCMSLIB00017248259","spectrum_index":21113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodecanoic acid (delta mass: 82.0782 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.263,"smiles":null,"spectrum_id":"CCMSLIB00017248262","spectrum_index":21114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 98.0227 Da; putative annotation: N/A; putative formula: C2H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.109,"smiles":null,"spectrum_id":"CCMSLIB00017248264","spectrum_index":21115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 517.3598 Da; putative annotation: N/A; putative formula: C24H43N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.42,"smiles":null,"spectrum_id":"CCMSLIB00017248267","spectrum_index":21116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 131.0585 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.145,"smiles":null,"spectrum_id":"CCMSLIB00017248270","spectrum_index":21117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 470.161 Da; putative annotation: N/A; putative formula: C22H30O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.2,"smiles":null,"spectrum_id":"CCMSLIB00017248273","spectrum_index":21118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of oleic acid (delta mass: 72.0574 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.321,"smiles":null,"spectrum_id":"CCMSLIB00017248276","spectrum_index":21119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 100.0684 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.316,"smiles":null,"spectrum_id":"CCMSLIB00017248278","spectrum_index":21120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol (delta mass: 74.0363 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.196,"smiles":null,"spectrum_id":"CCMSLIB00017248281","spectrum_index":21121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 72.0577 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017248283","spectrum_index":21122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 27.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.102,"smiles":null,"spectrum_id":"CCMSLIB00017248286","spectrum_index":21123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Testosterone (delta mass: 140.084 Da; putative annotation: N/A; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.3,"smiles":null,"spectrum_id":"CCMSLIB00017248289","spectrum_index":21124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"5,6alpha-epoxy-5alpha-cholestan-3beta-ol\"\" (delta mass: 345.2406 Da; putative annotation: N/A; putative formula: C20H31N3O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.598,"smiles":null,"spectrum_id":"CCMSLIB00017248291","spectrum_index":21125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Dehydroperuvinine (delta mass: 17.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017248294","spectrum_index":21126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 223.079 Da; putative annotation: N/A; putative formula: C3H5N13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.119,"smiles":null,"spectrum_id":"CCMSLIB00017248297","spectrum_index":21127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 92.0624 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.3,"smiles":null,"spectrum_id":"CCMSLIB00017248299","spectrum_index":21128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 675.4918 Da; putative annotation: N/A; putative formula: C49H61N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":988.729,"smiles":null,"spectrum_id":"CCMSLIB00017248302","spectrum_index":21129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 641.491 Da; putative annotation: N/A; putative formula: C42H63N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":918.707,"smiles":null,"spectrum_id":"CCMSLIB00017248303","spectrum_index":21130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 62.964 Da; putative annotation: N/A; putative formula: HNO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.013,"smiles":null,"spectrum_id":"CCMSLIB00017248306","spectrum_index":21131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 63.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.263,"smiles":null,"spectrum_id":"CCMSLIB00017248310","spectrum_index":21132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 142.0631 Da; putative annotation: N/A; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.3,"smiles":null,"spectrum_id":"CCMSLIB00017248311","spectrum_index":21133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 280.2399 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.327,"smiles":null,"spectrum_id":"CCMSLIB00017248314","spectrum_index":21134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 62.0298 Da; putative annotation: N/A; putative formula: C4H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.158,"smiles":null,"spectrum_id":"CCMSLIB00017248317","spectrum_index":21135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 281.0716 Da; putative annotation: N/A; putative formula: C15H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.152,"smiles":null,"spectrum_id":"CCMSLIB00017248320","spectrum_index":21136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 258.1832 Da; putative annotation: N/A; putative formula: C14H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.248,"smiles":null,"spectrum_id":"CCMSLIB00017248323","spectrum_index":21137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 378.4725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.544,"smiles":null,"spectrum_id":"CCMSLIB00017248326","spectrum_index":21138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alisol B acetate (delta mass: 144.1359 Da; putative annotation: N/A; putative formula: C6H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.509,"smiles":null,"spectrum_id":"CCMSLIB00017248329","spectrum_index":21139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017248331","spectrum_index":21140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 160.0524 Da; putative annotation: N/A; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.097,"smiles":null,"spectrum_id":"CCMSLIB00017248334","spectrum_index":21141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 130.0312 Da; putative annotation: N/A; putative formula: C3H6N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.085,"smiles":null,"spectrum_id":"CCMSLIB00017248337","spectrum_index":21142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Cycloisolongifol-5-ol (delta mass: 261.1578 Da; putative annotation: N/A; putative formula: C12H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.348,"smiles":null,"spectrum_id":"CCMSLIB00017248340","spectrum_index":21143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 875.6541 Da; putative annotation: N/A; putative formula: C57H85N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1260.82,"smiles":null,"spectrum_id":"CCMSLIB00017248342","spectrum_index":21144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 197.0695 Da; putative annotation: N/A; putative formula: C2H11N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.208,"smiles":null,"spectrum_id":"CCMSLIB00017248345","spectrum_index":21145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-hydroxybenzoate (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017248347","spectrum_index":21146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylnorfloxacin (delta mass: 18.0206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.172,"smiles":null,"spectrum_id":"CCMSLIB00017248350","spectrum_index":21147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEPROPIONIC ACID (delta mass: 262.0962 Da; putative annotation: N/A; putative formula: C14H18N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.182,"smiles":null,"spectrum_id":"CCMSLIB00017248353","spectrum_index":21148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-hydroxybut-3-en-2-yl)-3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran-4,5-diol (delta mass: 98.077 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.33,"smiles":null,"spectrum_id":"CCMSLIB00017248355","spectrum_index":21149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 189.1395 Da; putative annotation: N/A; putative formula: C8H20N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.377,"smiles":null,"spectrum_id":"CCMSLIB00017248358","spectrum_index":21150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 241.1898 Da; putative annotation: N/A; putative formula: C11H23N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.266,"smiles":null,"spectrum_id":"CCMSLIB00017248361","spectrum_index":21151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,10-Bisaboladiene-1,4-diol (delta mass: 52.031 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.232,"smiles":null,"spectrum_id":"CCMSLIB00017248363","spectrum_index":21152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-(3-Hydroxy-2,3-dimethyl-2-bicyclo[2.2.1]heptanyl)-2-methylpent-2-enoic acid (delta mass: 36.0361 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.216,"smiles":null,"spectrum_id":"CCMSLIB00017248366","spectrum_index":21153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester (delta mass: 125.9816 Da; putative annotation: N/A; putative formula: C2H-2N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.24,"smiles":null,"spectrum_id":"CCMSLIB00017248369","spectrum_index":21154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,12.alpha.-Epidioxy-13(14)-abieten-18-oic acid (delta mass: 98.056 Da; putative annotation: N/A; putative formula: C6H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.278,"smiles":null,"spectrum_id":"CCMSLIB00017248371","spectrum_index":21155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU045906 Icaridin|butan-2-yl 2-(2-hydroxyethyl)piperidine-1-carboxylate (delta mass: 120.0932 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.268,"smiles":null,"spectrum_id":"CCMSLIB00017248374","spectrum_index":21156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510507 Tyramine|4-(2-aminoethyl)phenol (delta mass: 206.0408 Da; putative annotation: N/A; putative formula: C4H10N6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.132,"smiles":null,"spectrum_id":"CCMSLIB00017248377","spectrum_index":21157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 52.0719 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.167,"smiles":null,"spectrum_id":"CCMSLIB00017248380","spectrum_index":21158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxy-5.beta.-pregnane-3,11,20-trione (delta mass: 54.0462 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.268,"smiles":null,"spectrum_id":"CCMSLIB00017248382","spectrum_index":21159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 22(S)-Hydroxycholesterol (delta mass: 171.1269 Da; putative annotation: N/A; putative formula: C9H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.484,"smiles":null,"spectrum_id":"CCMSLIB00017248385","spectrum_index":21160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 4.0489 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.136,"smiles":null,"spectrum_id":"CCMSLIB00017248389","spectrum_index":21161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 145.024 Da; putative annotation: N/A; putative formula: C2H3N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.115,"smiles":null,"spectrum_id":"CCMSLIB00017248390","spectrum_index":21162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 342.2019 Da; putative annotation: N/A; putative formula: C22H30OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.298,"smiles":null,"spectrum_id":"CCMSLIB00017248393","spectrum_index":21163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 123.1017 Da; putative annotation: N/A; putative formula: C8H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.144,"smiles":null,"spectrum_id":"CCMSLIB00017248396","spectrum_index":21164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 112.1256 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.206,"smiles":null,"spectrum_id":"CCMSLIB00017248398","spectrum_index":21165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 173.1207 Da; putative annotation: N/A; putative formula: C12H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.228,"smiles":null,"spectrum_id":"CCMSLIB00017248401","spectrum_index":21166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-methyl-4-methylidene-7-(propan-2-yl)-1,2,3,3a,4,5,6,8a-octahydroazulen-1-ol (delta mass: 186.1762 Da; putative annotation: N/A; putative formula: C15H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.366,"smiles":null,"spectrum_id":"CCMSLIB00017248404","spectrum_index":21167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Aminobenzoic acid (delta mass: 101.0561 Da; putative annotation: N/A; putative formula: C3H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.111,"smiles":null,"spectrum_id":"CCMSLIB00017248408","spectrum_index":21168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-coumaric acid-4-O-glucopyranoside (delta mass: 69.0585 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.166,"smiles":null,"spectrum_id":"CCMSLIB00017248409","spectrum_index":21169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 179.0946 Da; putative annotation: N/A; putative formula: C10H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.175,"smiles":null,"spectrum_id":"CCMSLIB00017248412","spectrum_index":21170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 264.0845 Da; putative annotation: N/A; putative formula: C10H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.254,"smiles":null,"spectrum_id":"CCMSLIB00017248416","spectrum_index":21171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 16.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.216,"smiles":null,"spectrum_id":"CCMSLIB00017248417","spectrum_index":21172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyl-DL-serine (delta mass: 41.9038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.969,"smiles":null,"spectrum_id":"CCMSLIB00017248420","spectrum_index":21173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methoxybenzaldehyde (delta mass: 50.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.091,"smiles":null,"spectrum_id":"CCMSLIB00017248423","spectrum_index":21174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 101.0416 Da; putative annotation: N/A; putative formula: C3H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.128,"smiles":null,"spectrum_id":"CCMSLIB00017248425","spectrum_index":21175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 44.0375 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.29,"smiles":null,"spectrum_id":"CCMSLIB00017248428","spectrum_index":21176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,5R,9S,13R)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 59.0367 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.269,"smiles":null,"spectrum_id":"CCMSLIB00017248430","spectrum_index":21177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 282.0851 Da; putative annotation: N/A; putative formula: C12H14N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.135,"smiles":null,"spectrum_id":"CCMSLIB00017248432","spectrum_index":21178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 175.0471 Da; putative annotation: N/A; putative formula: C3HN11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.212,"smiles":null,"spectrum_id":"CCMSLIB00017248435","spectrum_index":21179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 135.0632 Da; putative annotation: N/A; putative formula: C3H9N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.16,"smiles":null,"spectrum_id":"CCMSLIB00017248436","spectrum_index":21180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 108.0211 Da; putative annotation: 1,3,5-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.197,"smiles":null,"spectrum_id":"CCMSLIB00017248439","spectrum_index":21181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 99.0684 Da; putative annotation: 4-Amino-2-methylbutanoic acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.166,"smiles":null,"spectrum_id":"CCMSLIB00017248440","spectrum_index":21182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Oxocleroda-3,13-dien-15-oic acid (delta mass: 282.199 Da; putative annotation: 5,8,11-Eicosatriynoic acid; putative formula: C20H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.426,"smiles":null,"spectrum_id":"CCMSLIB00017248443","spectrum_index":21183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 278.2236 Da; putative annotation: 9(10)-Epoxy-12Z-octadecenoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.503,"smiles":null,"spectrum_id":"CCMSLIB00017248444","spectrum_index":21184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 330.2193 Da; putative annotation: 2-[4a-methyl-8-methylidene-4-(3-methylpentanoyloxy)-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid; putative formula: C21H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.435,"smiles":null,"spectrum_id":"CCMSLIB00017248447","spectrum_index":21185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde - 40.0 eV (delta mass: 110.0742 Da; putative annotation: 2,2-Dimethyl-4-pentenoic acid; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.118,"smiles":null,"spectrum_id":"CCMSLIB00017248450","spectrum_index":21186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 177.0787 Da; putative annotation: 3-Amino-4-(4-hydroxyphenyl)butyric Acid; putative formula: C10H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.248,"smiles":null,"spectrum_id":"CCMSLIB00017248451","spectrum_index":21187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 268.181 Da; putative annotation: 3.beta.-Hydroxyandrosta-5,15-dien-17-one; putative formula: C19H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.434,"smiles":null,"spectrum_id":"CCMSLIB00017248454","spectrum_index":21188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Arachidonoylglycerol (delta mass: 319.2506 Da; putative annotation: Linoleoylglycine; putative formula: C20H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.535,"smiles":null,"spectrum_id":"CCMSLIB00017248455","spectrum_index":21189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 107.0041 Da; putative annotation: Taurine - 40.0 eV; putative formula: C2H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.075,"smiles":null,"spectrum_id":"CCMSLIB00017248458","spectrum_index":21190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR,5S)-5-[(E)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carbaldehyde (delta mass: 132.0936 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.341,"smiles":null,"spectrum_id":"CCMSLIB00017248459","spectrum_index":21191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 129.0428 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.166,"smiles":null,"spectrum_id":"CCMSLIB00017248462","spectrum_index":21192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 225.1372 Da; putative annotation: 8-Acetamido-2-methyl-7-oxononanoic acid; putative formula: C12H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.359,"smiles":null,"spectrum_id":"CCMSLIB00017248464","spectrum_index":21193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 232.1457 Da; putative annotation: 7-Hydroxy-9-(hydroxymethyl)-1,4,9-trimethyl-2,4,5,7,8,8a-hexahydro-4,7-methanoazulen-6(1H)-one; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.226,"smiles":null,"spectrum_id":"CCMSLIB00017248466","spectrum_index":21194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 414.1516 Da; putative annotation: (2R,3S,4S,5R,6R)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxane-3,4-diol; putative formula: C19H26O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.212,"smiles":null,"spectrum_id":"CCMSLIB00017248469","spectrum_index":21195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 267.217 Da; putative annotation: Gly-C14:0; putative formula: C16H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.36,"smiles":null,"spectrum_id":"CCMSLIB00017248472","spectrum_index":21196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 112.0531 Da; putative annotation: 4-Oxohexanoic acid; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.124,"smiles":null,"spectrum_id":"CCMSLIB00017248473","spectrum_index":21197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 381.1996 Da; putative annotation: N-((3s,5s,7s)-Adamantan-1-yl)-1-(5-chloropentyl)-1H-indazole-3-carboxamide; putative formula: C23H28ClN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.275,"smiles":null,"spectrum_id":"CCMSLIB00017248476","spectrum_index":21198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 264.2462 Da; putative annotation: (Z)-6-Octadecenoic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.431,"smiles":null,"spectrum_id":"CCMSLIB00017248477","spectrum_index":21199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 270.2191 Da; putative annotation: NCGC00381202-01!3,15-dihydroxyhexadecanoic acid; putative formula: C16H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.446,"smiles":null,"spectrum_id":"CCMSLIB00017248480","spectrum_index":21200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 281.2699 Da; putative annotation: Palmitoyl Ethanolamide; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.517,"smiles":null,"spectrum_id":"CCMSLIB00017248482","spectrum_index":21201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Carboxyibuprofen from NIST14 (delta mass: 236.1034 Da; putative annotation: Phomalone; putative formula: C13H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.216,"smiles":null,"spectrum_id":"CCMSLIB00017248485","spectrum_index":21202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E,9E)-5,6-Dihydroxy-9,12,13-trimethyl-14-(2-methylpropyl)-6,7,8,10a,13,13a,14,15-octahydro-2H-oxacyclododecino[2,3-d]isoindole-2,16(5H)-dione (delta mass: 152.105 Da; putative annotation: N/A; putative formula: C7H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.364,"smiles":null,"spectrum_id":"CCMSLIB00017248488","spectrum_index":21203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyurs-12-en-23-oic acid (delta mass: 261.2313 Da; putative annotation: N/A; putative formula: C15H27N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.599,"smiles":null,"spectrum_id":"CCMSLIB00017248490","spectrum_index":21204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 120.0937 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.143,"smiles":null,"spectrum_id":"CCMSLIB00017248492","spectrum_index":21205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 484.3746 Da; putative annotation: N/A; putative formula: C25H44N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.654,"smiles":null,"spectrum_id":"CCMSLIB00017248494","spectrum_index":21206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 82.0056 Da; putative annotation: N/A; putative formula: C4H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017248497","spectrum_index":21207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 182.1608 Da; putative annotation: N/A; putative formula: C12H23O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.241,"smiles":null,"spectrum_id":"CCMSLIB00017248499","spectrum_index":21208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 242.0191 Da; putative annotation: N/A; putative formula: C6H11O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.09,"smiles":null,"spectrum_id":"CCMSLIB00017248501","spectrum_index":21209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 330.1447 Da; putative annotation: N/A; putative formula: C23H22S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.199,"smiles":null,"spectrum_id":"CCMSLIB00017248504","spectrum_index":21210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 90.0681 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017248505","spectrum_index":21211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphtho[2,1-b]furan-4,5-diol, dodecahydro-2-(1-hydroxy-1-methyl-2-propen-1-yl)-3a,6,6,9a-tetramethyl- (delta mass: 86.0518 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.305,"smiles":null,"spectrum_id":"CCMSLIB00017248508","spectrum_index":21212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 72.0363 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.289,"smiles":null,"spectrum_id":"CCMSLIB00017248509","spectrum_index":21213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 204.9868 Da; putative annotation: N/A; putative formula: C6H7NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.032,"smiles":null,"spectrum_id":"CCMSLIB00017248512","spectrum_index":21214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 59.0154 Da; putative annotation: N/A; putative formula: C5HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.269,"smiles":null,"spectrum_id":"CCMSLIB00017248514","spectrum_index":21215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 90.0831 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.346,"smiles":null,"spectrum_id":"CCMSLIB00017248516","spectrum_index":21216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 41.0472 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.337,"smiles":null,"spectrum_id":"CCMSLIB00017248519","spectrum_index":21217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 139.1061 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.182,"smiles":null,"spectrum_id":"CCMSLIB00017248520","spectrum_index":21218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 36.9865 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.077,"smiles":null,"spectrum_id":"CCMSLIB00017248523","spectrum_index":21219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 67.0287 Da; putative annotation: N/A; putative formula: CHN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.115,"smiles":null,"spectrum_id":"CCMSLIB00017248525","spectrum_index":21220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 539.209 Da; putative annotation: N/A; putative formula: C28H33N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.274,"smiles":null,"spectrum_id":"CCMSLIB00017248527","spectrum_index":21221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 26.0154 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.075,"smiles":null,"spectrum_id":"CCMSLIB00017248530","spectrum_index":21222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 33.0942 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017248531","spectrum_index":21223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(18)-Epoxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid (delta mass: 21.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.247,"smiles":null,"spectrum_id":"CCMSLIB00017248534","spectrum_index":21224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 210.1985 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.467,"smiles":null,"spectrum_id":"CCMSLIB00017248537","spectrum_index":21225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 247.142 Da; putative annotation: N/A; putative formula: C11H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.213,"smiles":null,"spectrum_id":"CCMSLIB00017248538","spectrum_index":21226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Hydroxydodecanoic acid CollisionEnergy:102040 (delta mass: 70.0777 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.258,"smiles":null,"spectrum_id":"CCMSLIB00017248541","spectrum_index":21227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-4Z,6E,10Z,13Z,16Z,19Z-docosahexaenoic acid (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017248543","spectrum_index":21228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 128.1203 Da; putative annotation: N/A; putative formula: C8H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017248545","spectrum_index":21229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 63.0689 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.291,"smiles":null,"spectrum_id":"CCMSLIB00017248548","spectrum_index":21230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spermidine-CA (delta mass: 431.3392 Da; putative annotation: N/A; putative formula: C21H46N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":967.781,"smiles":null,"spectrum_id":"CCMSLIB00017248550","spectrum_index":21231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 144.0978 Da; putative annotation: N/A; putative formula: C8H16S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.377,"smiles":null,"spectrum_id":"CCMSLIB00017248552","spectrum_index":21232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pregabalin (delta mass: 45.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.19,"smiles":null,"spectrum_id":"CCMSLIB00017248555","spectrum_index":21233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 32.0176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.193,"smiles":null,"spectrum_id":"CCMSLIB00017248556","spectrum_index":21234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 293.1481 Da; putative annotation: N/A; putative formula: C13H27NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.219,"smiles":null,"spectrum_id":"CCMSLIB00017248559","spectrum_index":21235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 84.0214 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017248560","spectrum_index":21236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 92.0259 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.122,"smiles":null,"spectrum_id":"CCMSLIB00017248563","spectrum_index":21237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 271.1555 Da; putative annotation: N/A; putative formula: C11H22N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.356,"smiles":null,"spectrum_id":"CCMSLIB00017248566","spectrum_index":21238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 876.8027 Da; putative annotation: N/A; putative formula: C54H100N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1053.9,"smiles":null,"spectrum_id":"CCMSLIB00017248567","spectrum_index":21239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 73.042 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.217,"smiles":null,"spectrum_id":"CCMSLIB00017248570","spectrum_index":21240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000497 3-Acetylindole|1-(1H-indol-3-yl)ethanone (delta mass: 71.0215 Da; putative annotation: N/A; putative formula: HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.097,"smiles":null,"spectrum_id":"CCMSLIB00017248572","spectrum_index":21241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 118.0629 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.165,"smiles":null,"spectrum_id":"CCMSLIB00017248574","spectrum_index":21242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 80.0621 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.263,"smiles":null,"spectrum_id":"CCMSLIB00017248577","spectrum_index":21243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 154.058 Da; putative annotation: N/A; putative formula: H2N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.128,"smiles":null,"spectrum_id":"CCMSLIB00017248578","spectrum_index":21244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 84.0939 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.171,"smiles":null,"spectrum_id":"CCMSLIB00017248581","spectrum_index":21245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of veratramine (delta mass: 158.1168 Da; putative annotation: N/A; putative formula: C6H14N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.422,"smiles":null,"spectrum_id":"CCMSLIB00017248583","spectrum_index":21246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 18.0142 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.054,"smiles":null,"spectrum_id":"CCMSLIB00017248585","spectrum_index":21247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 59.0483 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.197,"smiles":null,"spectrum_id":"CCMSLIB00017248588","spectrum_index":21248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 425.317 Da; putative annotation: N/A; putative formula: C25H39N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.601,"smiles":null,"spectrum_id":"CCMSLIB00017248590","spectrum_index":21249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 355.2751 Da; putative annotation: N/A; putative formula: C19H38N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.549,"smiles":null,"spectrum_id":"CCMSLIB00017248592","spectrum_index":21250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 161.153 Da; putative annotation: N/A; putative formula: C3H15N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.287,"smiles":null,"spectrum_id":"CCMSLIB00017248595","spectrum_index":21251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 215.0888 Da; putative annotation: N/A; putative formula: C12H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.13,"smiles":null,"spectrum_id":"CCMSLIB00017248597","spectrum_index":21252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 245.0897 Da; putative annotation: N/A; putative formula: C10H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.24,"smiles":null,"spectrum_id":"CCMSLIB00017248599","spectrum_index":21253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 615.2282 Da; putative annotation: N/A; putative formula: C40H25N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":880.383,"smiles":null,"spectrum_id":"CCMSLIB00017248601","spectrum_index":21254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 250.1933 Da; putative annotation: N/A; putative formula: C16H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.3,"smiles":null,"spectrum_id":"CCMSLIB00017248603","spectrum_index":21255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 177.0635 Da; putative annotation: N/A; putative formula: C6H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.196,"smiles":null,"spectrum_id":"CCMSLIB00017248606","spectrum_index":21256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.alpha.'-Dilaurin (delta mass: 118.1102 Da; putative annotation: N/A; putative formula: CH10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.499,"smiles":null,"spectrum_id":"CCMSLIB00017248607","spectrum_index":21257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 351.7003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.772,"smiles":null,"spectrum_id":"CCMSLIB00017248610","spectrum_index":21258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 66.0314 Da; putative annotation: N/A; putative formula: C2H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.065,"smiles":null,"spectrum_id":"CCMSLIB00017248612","spectrum_index":21259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 423.1999 Da; putative annotation: N/A; putative formula: C22H34NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.265,"smiles":null,"spectrum_id":"CCMSLIB00017248614","spectrum_index":21260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 500.4589 Da; putative annotation: N/A; putative formula: C34H60O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.602,"smiles":null,"spectrum_id":"CCMSLIB00017248617","spectrum_index":21261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Hydroxymethylbicyclo[2.2.1]hept-2-yl)methanol (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.148,"smiles":null,"spectrum_id":"CCMSLIB00017248619","spectrum_index":21262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Acetyl-11-keto-.beta.-boswellic acid (delta mass: 88.0625 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.42,"smiles":null,"spectrum_id":"CCMSLIB00017248621","spectrum_index":21263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 92.0731 Da; putative annotation: N/A; putative formula: C6H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.42,"smiles":null,"spectrum_id":"CCMSLIB00017248624","spectrum_index":21264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.389,"smiles":null,"spectrum_id":"CCMSLIB00017248626","spectrum_index":21265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9S-Hydroxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 313.2628 Da; putative annotation: N/A; putative formula: C19H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.49,"smiles":null,"spectrum_id":"CCMSLIB00017248628","spectrum_index":21266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 160.0747 Da; putative annotation: N/A; putative formula: C8H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.225,"smiles":null,"spectrum_id":"CCMSLIB00017248631","spectrum_index":21267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(R)-4-((3S,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid\"\" (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.295,"smiles":null,"spectrum_id":"CCMSLIB00017248632","spectrum_index":21268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 76.1671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.227,"smiles":null,"spectrum_id":"CCMSLIB00017248635","spectrum_index":21269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 41.026 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.086,"smiles":null,"spectrum_id":"CCMSLIB00017248636","spectrum_index":21270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 288.7002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.76,"smiles":null,"spectrum_id":"CCMSLIB00017248639","spectrum_index":21271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Procyanidin B2 from NIST14 (delta mass: 286.0476 Da; putative annotation: N/A; putative formula: C15H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":865.197,"smiles":null,"spectrum_id":"CCMSLIB00017248642","spectrum_index":21272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 449.172 Da; putative annotation: N/A; putative formula: C19H31NO9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.253,"smiles":null,"spectrum_id":"CCMSLIB00017248644","spectrum_index":21273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 116.0588 Da; putative annotation: N/A; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.176,"smiles":null,"spectrum_id":"CCMSLIB00017248646","spectrum_index":21274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 584.5182 Da; putative annotation: N/A; putative formula: C40H64N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":878.797,"smiles":null,"spectrum_id":"CCMSLIB00017248649","spectrum_index":21275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-(+)-Citronellic acid (delta mass: 125.1206 Da; putative annotation: N/A; putative formula: C8H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.259,"smiles":null,"spectrum_id":"CCMSLIB00017248650","spectrum_index":21276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-4-(trifluoromethyl)- (delta mass: 34.9751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.08,"smiles":null,"spectrum_id":"CCMSLIB00017248653","spectrum_index":21277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthro[3,2-b]furan-9(1H)-one, 2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro-6,10a-dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl- (delta mass: 120.0927 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.309,"smiles":null,"spectrum_id":"CCMSLIB00017248656","spectrum_index":21278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 31.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.311,"smiles":null,"spectrum_id":"CCMSLIB00017248657","spectrum_index":21279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 186.1247 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.237,"smiles":null,"spectrum_id":"CCMSLIB00017248660","spectrum_index":21280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-8,11,14-Eicosatrienoic acid (delta mass: 233.1237 Da; putative annotation: N/A; putative formula: C14H19NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.387,"smiles":null,"spectrum_id":"CCMSLIB00017248662","spectrum_index":21281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10Z,14E)-6,14-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid (delta mass: 74.0372 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.228,"smiles":null,"spectrum_id":"CCMSLIB00017248664","spectrum_index":21282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 96.0939 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.175,"smiles":null,"spectrum_id":"CCMSLIB00017248666","spectrum_index":21283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 143.1303 Da; putative annotation: N/A; putative formula: C8H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.264,"smiles":null,"spectrum_id":"CCMSLIB00017248669","spectrum_index":21284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 171.1287 Da; putative annotation: N/A; putative formula: C8H18N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.215,"smiles":null,"spectrum_id":"CCMSLIB00017248672","spectrum_index":21285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl Deoxycholate (delta mass: 94.0779 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.393,"smiles":null,"spectrum_id":"CCMSLIB00017248673","spectrum_index":21286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,20-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0,?.0?,?.0?,?]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaen-17-ol (delta mass: 166.1733 Da; putative annotation: N/A; putative formula: C12H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.307,"smiles":null,"spectrum_id":"CCMSLIB00017248676","spectrum_index":21287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Sitosterol (delta mass: 189.1736 Da; putative annotation: N/A; putative formula: C6H19N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.567,"smiles":null,"spectrum_id":"CCMSLIB00017248677","spectrum_index":21288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 116.0583 Da; putative annotation: N/A; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.197,"smiles":null,"spectrum_id":"CCMSLIB00017248680","spectrum_index":21289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 172.0712 Da; putative annotation: N/A; putative formula: C12H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.152,"smiles":null,"spectrum_id":"CCMSLIB00017248681","spectrum_index":21290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 351.9231 Da; putative annotation: N/A; putative formula: C6H8O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.96,"smiles":null,"spectrum_id":"CCMSLIB00017248684","spectrum_index":21291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 292.0629 Da; putative annotation: N/A; putative formula: C4H8N10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.186,"smiles":null,"spectrum_id":"CCMSLIB00017248685","spectrum_index":21292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[6-(3,4-Dihydroxy-2-methylidenebutanoyl)oxy-4-ethenyl-2-hydroxy-3-(3-hydroxyprop-1-en-2-yl)-4-methylcyclohexyl]prop-2-enoic acid (delta mass: 413.2002 Da; putative annotation: N/A; putative formula: C28H23N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.386,"smiles":null,"spectrum_id":"CCMSLIB00017248688","spectrum_index":21293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aloeresin A (delta mass: 478.2202 Da; putative annotation: N/A; putative formula: C23H22N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1019.39,"smiles":null,"spectrum_id":"CCMSLIB00017248691","spectrum_index":21294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 404.2713 Da; putative annotation: N/A; putative formula: C28H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.404,"smiles":null,"spectrum_id":"CCMSLIB00017248692","spectrum_index":21295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 912.363 Da; putative annotation: N/A; putative formula: C49H52N8O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1157.46,"smiles":null,"spectrum_id":"CCMSLIB00017248695","spectrum_index":21296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHIP (delta mass: 22.3865 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.5,"smiles":null,"spectrum_id":"CCMSLIB00017248697","spectrum_index":21297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 76.016 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017248699","spectrum_index":21298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Pro (delta mass: 73.016 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.129,"smiles":null,"spectrum_id":"CCMSLIB00017248702","spectrum_index":21299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 311.2811 Da; putative annotation: N/A; putative formula: C15H33N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.492,"smiles":null,"spectrum_id":"CCMSLIB00017248703","spectrum_index":21300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 44.0639 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.145,"smiles":null,"spectrum_id":"CCMSLIB00017248706","spectrum_index":21301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethoxybenzoic acid (delta mass: 44.0258 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017248707","spectrum_index":21302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 239.0811 Da; putative annotation: N/A; putative formula: C12H9N5O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.146,"smiles":null,"spectrum_id":"CCMSLIB00017248710","spectrum_index":21303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-(5-O-Methylpentofuranosyl)-1,9-dihydro-6H-purin-6-one (delta mass: 118.0247 Da; putative annotation: N/A; putative formula: C8H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.128,"smiles":null,"spectrum_id":"CCMSLIB00017248713","spectrum_index":21304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 93.0424 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.254,"smiles":null,"spectrum_id":"CCMSLIB00017248714","spectrum_index":21305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 669.448 Da; putative annotation: N/A; putative formula: C38H55N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.519,"smiles":null,"spectrum_id":"CCMSLIB00017248717","spectrum_index":21306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 158.1312 Da; putative annotation: N/A; putative formula: C9H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.191,"smiles":null,"spectrum_id":"CCMSLIB00017248718","spectrum_index":21307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 112.0678 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017248721","spectrum_index":21308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6.alpha.,11.beta.)-11-hydroxy-6-methylpregn-4-ene-3,20-dione (delta mass: 106.0776 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.32,"smiles":null,"spectrum_id":"CCMSLIB00017248724","spectrum_index":21309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 106.0827 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.32,"smiles":null,"spectrum_id":"CCMSLIB00017248725","spectrum_index":21310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxypimara-8(14),15-dien-18-oic acid (delta mass: 106.0789 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.306,"smiles":null,"spectrum_id":"CCMSLIB00017248728","spectrum_index":21311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 214.0699 Da; putative annotation: N/A; putative formula: C7H10N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.13,"smiles":null,"spectrum_id":"CCMSLIB00017248729","spectrum_index":21312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethanolamide (delta mass: 130.0795 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.37,"smiles":null,"spectrum_id":"CCMSLIB00017248732","spectrum_index":21313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatrienoic acid (delta mass: 17.9199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.214,"smiles":null,"spectrum_id":"CCMSLIB00017248734","spectrum_index":21314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 48.0364 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.206,"smiles":null,"spectrum_id":"CCMSLIB00017248736","spectrum_index":21315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacetonitrile (delta mass: 30.0181 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.094,"smiles":null,"spectrum_id":"CCMSLIB00017248739","spectrum_index":21316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Arachidonoylglycerol (delta mass: 137.0237 Da; putative annotation: N/A; putative formula: C3H8NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.308,"smiles":null,"spectrum_id":"CCMSLIB00017248740","spectrum_index":21317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 148.0372 Da; putative annotation: N/A; putative formula: C5H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.118,"smiles":null,"spectrum_id":"CCMSLIB00017248743","spectrum_index":21318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 78.0496 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.313,"smiles":null,"spectrum_id":"CCMSLIB00017248745","spectrum_index":21319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Methylsulfonyl)-13-(3-pentyloxiranyl)-5Z,8Z,11Z-tridecatrienamide (delta mass: 78.048 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.284,"smiles":null,"spectrum_id":"CCMSLIB00017248747","spectrum_index":21320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisucaberin (delta mass: 289.1278 Da; putative annotation: N/A; putative formula: C12H23N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.367,"smiles":null,"spectrum_id":"CCMSLIB00017248750","spectrum_index":21321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 190.0593 Da; putative annotation: N/A; putative formula: C8H17O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.13,"smiles":null,"spectrum_id":"CCMSLIB00017248751","spectrum_index":21322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 96.0941 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.378,"smiles":null,"spectrum_id":"CCMSLIB00017248754","spectrum_index":21323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Acetyl-11-keto-.beta.-boswellic acid (delta mass: 138.0769 Da; putative annotation: N/A; putative formula: C3H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.434,"smiles":null,"spectrum_id":"CCMSLIB00017248755","spectrum_index":21324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-3-Methyl-5-(1,2,5,5-tetramethyl-7-oxo-3,4,4a,6-tetrahydro-2H-naphthalen-1-yl)pent-2-enoic acid (delta mass: 118.0832 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.31,"smiles":null,"spectrum_id":"CCMSLIB00017248758","spectrum_index":21325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-methylolivetolcarboxylic acid (delta mass: 272.0689 Da; putative annotation: N/A; putative formula: C15H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.197,"smiles":null,"spectrum_id":"CCMSLIB00017248759","spectrum_index":21326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexamethyleneimine (delta mass: 70.0055 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.118,"smiles":null,"spectrum_id":"CCMSLIB00017248762","spectrum_index":21327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethandrolone (delta mass: 116.0624 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.294,"smiles":null,"spectrum_id":"CCMSLIB00017248764","spectrum_index":21328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 271.2508 Da; putative annotation: N/A; putative formula: C16H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.478,"smiles":null,"spectrum_id":"CCMSLIB00017248766","spectrum_index":21329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-Butaprost (free acid) (delta mass: 366.2187 Da; putative annotation: N/A; putative formula: C16H34N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.498,"smiles":null,"spectrum_id":"CCMSLIB00017248769","spectrum_index":21330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxo-4-cholestenoic acid (delta mass: 35.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.358,"smiles":null,"spectrum_id":"CCMSLIB00017248770","spectrum_index":21331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 41.0269 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017248773","spectrum_index":21332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 84.079 Da; putative annotation: N/A; putative formula: C3H8N4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.149,"smiles":null,"spectrum_id":"CCMSLIB00017248775","spectrum_index":21333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 471.1914 Da; putative annotation: N/A; putative formula: C27H29N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.32,"smiles":null,"spectrum_id":"CCMSLIB00017248777","spectrum_index":21334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrrolidinecarboximidamide (delta mass: 143.1309 Da; putative annotation: N/A; putative formula: C8H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.233,"smiles":null,"spectrum_id":"CCMSLIB00017248780","spectrum_index":21335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hautriwaic acid (delta mass: 104.0256 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.232,"smiles":null,"spectrum_id":"CCMSLIB00017248782","spectrum_index":21336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 189.1726 Da; putative annotation: N/A; putative formula: C6H19N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.238,"smiles":null,"spectrum_id":"CCMSLIB00017248784","spectrum_index":21337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Plinabulin (delta mass: 35.0353 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.201,"smiles":null,"spectrum_id":"CCMSLIB00017248787","spectrum_index":21338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Dehydroperuvinine (delta mass: 207.1106 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.238,"smiles":null,"spectrum_id":"CCMSLIB00017248788","spectrum_index":21339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 41.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.124,"smiles":null,"spectrum_id":"CCMSLIB00017248791","spectrum_index":21340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 168.0533 Da; putative annotation: N/A; putative formula: C7H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.124,"smiles":null,"spectrum_id":"CCMSLIB00017248793","spectrum_index":21341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 112.0523 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.196,"smiles":null,"spectrum_id":"CCMSLIB00017248795","spectrum_index":21342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 160.0904 Da; putative annotation: N/A; putative formula: C4H12N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.167,"smiles":null,"spectrum_id":"CCMSLIB00017248798","spectrum_index":21343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP015603 3-Hydroxyphenylacetic acid|2-(3-hydroxyphenyl)acetic acid (delta mass: 10.9221 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.977,"smiles":null,"spectrum_id":"CCMSLIB00017248800","spectrum_index":21344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 462.2596 Da; putative annotation: N/A; putative formula: C30H38O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1129.49,"smiles":null,"spectrum_id":"CCMSLIB00017248802","spectrum_index":21345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,2-Trichloro-1-(4-chloro-1H-pyrrol-2-yl)ethanone (delta mass: 82.9693 Da; putative annotation: N/A; putative formula: CH-2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.874,"smiles":null,"spectrum_id":"CCMSLIB00017248805","spectrum_index":21346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 90.0318 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.086,"smiles":null,"spectrum_id":"CCMSLIB00017248806","spectrum_index":21347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 103.0631 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.149,"smiles":null,"spectrum_id":"CCMSLIB00017248809","spectrum_index":21348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 44.0149 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.091,"smiles":null,"spectrum_id":"CCMSLIB00017248811","spectrum_index":21349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 134.073 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.321,"smiles":null,"spectrum_id":"CCMSLIB00017248813","spectrum_index":21350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300283 Calycanthine (delta mass: 18.0087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.232,"smiles":null,"spectrum_id":"CCMSLIB00017248816","spectrum_index":21351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 16.0063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.39,"smiles":null,"spectrum_id":"CCMSLIB00017248817","spectrum_index":21352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 17.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.378,"smiles":null,"spectrum_id":"CCMSLIB00017248820","spectrum_index":21353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(5H)-Furanone, 5-(7-hydroxy-6-methyloctyl)- (delta mass: 96.9837 Da; putative annotation: N/A; putative formula: C2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.148,"smiles":null,"spectrum_id":"CCMSLIB00017248823","spectrum_index":21354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Formyl-3-hydroxyphenoxy)methyl]benzoic acid (delta mass: 304.0946 Da; putative annotation: N/A; putative formula: C16H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.17,"smiles":null,"spectrum_id":"CCMSLIB00017248824","spectrum_index":21355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 31.0197 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017248827","spectrum_index":21356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 52.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.145,"smiles":null,"spectrum_id":"CCMSLIB00017248828","spectrum_index":21357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,19-Cyclolanost-25-ene-3,24-diol (delta mass: 255.2408 Da; putative annotation: N/A; putative formula: C13H29N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.629,"smiles":null,"spectrum_id":"CCMSLIB00017248831","spectrum_index":21358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 123.065 Da; putative annotation: N/A; putative formula: C3H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.156,"smiles":null,"spectrum_id":"CCMSLIB00017248834","spectrum_index":21359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 46.0059 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.129,"smiles":null,"spectrum_id":"CCMSLIB00017248835","spectrum_index":21360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 25.0174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.077,"smiles":null,"spectrum_id":"CCMSLIB00017248838","spectrum_index":21361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 41.0258 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.393,"smiles":null,"spectrum_id":"CCMSLIB00017248839","spectrum_index":21362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 42.0314 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017248842","spectrum_index":21363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-hydroxyquinoline (delta mass: 42.0506 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.111,"smiles":null,"spectrum_id":"CCMSLIB00017248843","spectrum_index":21364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1H-Indole-4-carboxaldehyde from NIST14 (delta mass: 11.9823 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.042,"smiles":null,"spectrum_id":"CCMSLIB00017248846","spectrum_index":21365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 54.0759 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.183,"smiles":null,"spectrum_id":"CCMSLIB00017248848","spectrum_index":21366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 52.0071 Da; putative annotation: N/A; putative formula: C2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.072,"smiles":null,"spectrum_id":"CCMSLIB00017248850","spectrum_index":21367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 16.0158 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.107,"smiles":null,"spectrum_id":"CCMSLIB00017248853","spectrum_index":21368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 125.0845 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.149,"smiles":null,"spectrum_id":"CCMSLIB00017248855","spectrum_index":21369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurane-17,18-dioic acid (delta mass: 78.0465 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.268,"smiles":null,"spectrum_id":"CCMSLIB00017248857","spectrum_index":21370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 27.9114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.977,"smiles":null,"spectrum_id":"CCMSLIB00017248860","spectrum_index":21371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 154.0628 Da; putative annotation: N/A; putative formula: C8H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017248861","spectrum_index":21372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 73.0405 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017248864","spectrum_index":21373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 135.0505 Da; putative annotation: N/A; putative formula: H5N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.152,"smiles":null,"spectrum_id":"CCMSLIB00017248867","spectrum_index":21374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 282.1783 Da; putative annotation: N/A; putative formula: C15H28N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.259,"smiles":null,"spectrum_id":"CCMSLIB00017248868","spectrum_index":21375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa - 30.0 eV (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.102,"smiles":null,"spectrum_id":"CCMSLIB00017248870","spectrum_index":21376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 92.0472 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017248873","spectrum_index":21377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 665.3409 Da; putative annotation: N/A; putative formula: C32H39N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.412,"smiles":null,"spectrum_id":"CCMSLIB00017248875","spectrum_index":21378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 409.2817 Da; putative annotation: N/A; putative formula: C20H31N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.534,"smiles":null,"spectrum_id":"CCMSLIB00017248878","spectrum_index":21379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 96.0212 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017248879","spectrum_index":21380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 368.0893 Da; putative annotation: N/A; putative formula: C15H21N4OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.16,"smiles":null,"spectrum_id":"CCMSLIB00017248882","spectrum_index":21381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 78.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.175,"smiles":null,"spectrum_id":"CCMSLIB00017248883","spectrum_index":21382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 31.9127 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.02,"smiles":null,"spectrum_id":"CCMSLIB00017248886","spectrum_index":21383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyadamantan-2-one (delta mass: 37.9785 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.085,"smiles":null,"spectrum_id":"CCMSLIB00017248889","spectrum_index":21384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 867.5923 Da; putative annotation: N/A; putative formula: C44H85NO15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1030.65,"smiles":null,"spectrum_id":"CCMSLIB00017248890","spectrum_index":21385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 189.0519 Da; putative annotation: N/A; putative formula: C5H3N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.138,"smiles":null,"spectrum_id":"CCMSLIB00017248893","spectrum_index":21386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dehydrocoelenterazine (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.176,"smiles":null,"spectrum_id":"CCMSLIB00017248894","spectrum_index":21387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 306.0954 Da; putative annotation: N/A; putative formula: C15H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":811.272,"smiles":null,"spectrum_id":"CCMSLIB00017248897","spectrum_index":21388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 10.4447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.5,"smiles":null,"spectrum_id":"CCMSLIB00017248900","spectrum_index":21389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyisophthalic acid (delta mass: 56.0653 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.094,"smiles":null,"spectrum_id":"CCMSLIB00017248901","spectrum_index":21390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-C18:3 (delta mass: 18.007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.34,"smiles":null,"spectrum_id":"CCMSLIB00017248904","spectrum_index":21391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 53.0031 Da; putative annotation: N/A; putative formula: CH-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.188,"smiles":null,"spectrum_id":"CCMSLIB00017248905","spectrum_index":21392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinoleoylglycerol (delta mass: 347.2658 Da; putative annotation: N/A; putative formula: C15H29N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":964.78,"smiles":null,"spectrum_id":"CCMSLIB00017248908","spectrum_index":21393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Wikstromol (delta mass: 17.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.17,"smiles":null,"spectrum_id":"CCMSLIB00017248911","spectrum_index":21394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Thiophen-2-yl)piperazin-2-one (delta mass: 40.9968 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.055,"smiles":null,"spectrum_id":"CCMSLIB00017248912","spectrum_index":21395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 17.0235 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.12,"smiles":null,"spectrum_id":"CCMSLIB00017248915","spectrum_index":21396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 107.0752 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.162,"smiles":null,"spectrum_id":"CCMSLIB00017248916","spectrum_index":21397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 45.0215 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.081,"smiles":null,"spectrum_id":"CCMSLIB00017248919","spectrum_index":21398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Eicosanoyl)sphingosine (delta mass: 50.0511 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.633,"smiles":null,"spectrum_id":"CCMSLIB00017248922","spectrum_index":21399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 216.0858 Da; putative annotation: N/A; putative formula: C7H12N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.167,"smiles":null,"spectrum_id":"CCMSLIB00017248923","spectrum_index":21400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-tetrahydro-6-methoxy-1-oxo-beta-carboline (delta mass: 43.9899 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.087,"smiles":null,"spectrum_id":"CCMSLIB00017248926","spectrum_index":21401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 53.0264 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017248928","spectrum_index":21402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 130.0424 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.139,"smiles":null,"spectrum_id":"CCMSLIB00017248930","spectrum_index":21403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ent-15-Hydroxy-8(17)-labden-2-one (delta mass: 102.0833 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.346,"smiles":null,"spectrum_id":"CCMSLIB00017248933","spectrum_index":21404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-4-[(E)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017248935","spectrum_index":21405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 161.0692 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.135,"smiles":null,"spectrum_id":"CCMSLIB00017248937","spectrum_index":21406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 249.1364 Da; putative annotation: N/A; putative formula: C14H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.233,"smiles":null,"spectrum_id":"CCMSLIB00017248940","spectrum_index":21407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 241.0949 Da; putative annotation: N/A; putative formula: C11H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.332,"smiles":null,"spectrum_id":"CCMSLIB00017248943","spectrum_index":21408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 195.9695 Da; putative annotation: N/A; putative formula: C5N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.061,"smiles":null,"spectrum_id":"CCMSLIB00017248944","spectrum_index":21409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 344.1717 Da; putative annotation: N/A; putative formula: C23H24N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.294,"smiles":null,"spectrum_id":"CCMSLIB00017248947","spectrum_index":21410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 245.0897 Da; putative annotation: N/A; putative formula: C10H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.17,"smiles":null,"spectrum_id":"CCMSLIB00017248949","spectrum_index":21411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 339.2774 Da; putative annotation: N/A; putative formula: C20H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.348,"smiles":null,"spectrum_id":"CCMSLIB00017248951","spectrum_index":21412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 170.091 Da; putative annotation: N/A; putative formula: C5H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.219,"smiles":null,"spectrum_id":"CCMSLIB00017248954","spectrum_index":21413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 256.275 Da; putative annotation: N/A; putative formula: C13H32N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.377,"smiles":null,"spectrum_id":"CCMSLIB00017248955","spectrum_index":21414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 105.042 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.148,"smiles":null,"spectrum_id":"CCMSLIB00017248958","spectrum_index":21415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 176.0708 Da; putative annotation: N/A; putative formula: C6H13N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.158,"smiles":null,"spectrum_id":"CCMSLIB00017248960","spectrum_index":21416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301328 Ethylbeta-carboline (delta mass: 117.0584 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.166,"smiles":null,"spectrum_id":"CCMSLIB00017248962","spectrum_index":21417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 45.0209 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.243,"smiles":null,"spectrum_id":"CCMSLIB00017248965","spectrum_index":21418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dehydrodocosahexaenoic acid (delta mass: 28.0306 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.263,"smiles":null,"spectrum_id":"CCMSLIB00017248966","spectrum_index":21419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017248969","spectrum_index":21420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 350.2901 Da; putative annotation: N/A; putative formula: C17H34N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.449,"smiles":null,"spectrum_id":"CCMSLIB00017248970","spectrum_index":21421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 43.9818 Da; putative annotation: N/A; putative formula: CHP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.108,"smiles":null,"spectrum_id":"CCMSLIB00017248973","spectrum_index":21422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 152.9207 Da; putative annotation: N/A; putative formula: C2H3NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.2,"smiles":null,"spectrum_id":"CCMSLIB00017248975","spectrum_index":21423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 581.2106 Da; putative annotation: N/A; putative formula: C25H31N11O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":744.271,"smiles":null,"spectrum_id":"CCMSLIB00017248977","spectrum_index":21424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 811.4364 Da; putative annotation: N/A; putative formula: C55H53N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.497,"smiles":null,"spectrum_id":"CCMSLIB00017248980","spectrum_index":21425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 462.2811 Da; putative annotation: N/A; putative formula: C20H42N6O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.471,"smiles":null,"spectrum_id":"CCMSLIB00017248981","spectrum_index":21426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 101.982 Da; putative annotation: N/A; putative formula: H-2N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.993,"smiles":null,"spectrum_id":"CCMSLIB00017248984","spectrum_index":21427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 203.1157 Da; putative annotation: N/A; putative formula: C9H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.186,"smiles":null,"spectrum_id":"CCMSLIB00017248985","spectrum_index":21428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to L-Tyrosine from NIST14 (delta mass: 123.0685 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.15,"smiles":null,"spectrum_id":"CCMSLIB00017248988","spectrum_index":21429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytisine (delta mass: 43.017 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.135,"smiles":null,"spectrum_id":"CCMSLIB00017248989","spectrum_index":21430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 510.2311 Da; putative annotation: N/A; putative formula: C20H26N14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.291,"smiles":null,"spectrum_id":"CCMSLIB00017248992","spectrum_index":21431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 142.0779 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.3,"smiles":null,"spectrum_id":"CCMSLIB00017248994","spectrum_index":21432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin C (delta mass: 62.0514 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.231,"smiles":null,"spectrum_id":"CCMSLIB00017248996","spectrum_index":21433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trehalose-6-phosphate (delta mass: 810.2652 Da; putative annotation: N/A; putative formula: C37H46N8O7S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1233.35,"smiles":null,"spectrum_id":"CCMSLIB00017248999","spectrum_index":21434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Octylsphingosine (delta mass: 94.0782 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.493,"smiles":null,"spectrum_id":"CCMSLIB00017249002","spectrum_index":21435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 alcohol (delta mass: 140.0475 Da; putative annotation: N/A; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.316,"smiles":null,"spectrum_id":"CCMSLIB00017249004","spectrum_index":21436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(4-Ethyl-1-piperazinyl)carbonyl]-1H-indole (delta mass: 114.0704 Da; putative annotation: N/A; putative formula: C5H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.23,"smiles":null,"spectrum_id":"CCMSLIB00017249006","spectrum_index":21437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid (delta mass: 102.0824 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.315,"smiles":null,"spectrum_id":"CCMSLIB00017249008","spectrum_index":21438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 549.3506 Da; putative annotation: N/A; putative formula: C40H43N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.411,"smiles":null,"spectrum_id":"CCMSLIB00017249010","spectrum_index":21439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 66.0465 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.279,"smiles":null,"spectrum_id":"CCMSLIB00017249013","spectrum_index":21440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hymeglusin (delta mass: 116.0623 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.263,"smiles":null,"spectrum_id":"CCMSLIB00017249015","spectrum_index":21441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 64.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017249017","spectrum_index":21442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.248,"smiles":null,"spectrum_id":"CCMSLIB00017249020","spectrum_index":21443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4aR,5S)-9-Hydroxy-3,4a,5-trimethyl-4,5,6,7,8,8a,9,9a-octahydrobenzo[f][1]benzofuran-2-one (delta mass: 94.078 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.242,"smiles":null,"spectrum_id":"CCMSLIB00017249022","spectrum_index":21444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Resorcylic acid (delta mass: 118.0417 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.076,"smiles":null,"spectrum_id":"CCMSLIB00017249024","spectrum_index":21445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetylbenzoic acid (delta mass: 88.0305 Da; putative annotation: N/A; putative formula: CH5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.085,"smiles":null,"spectrum_id":"CCMSLIB00017249027","spectrum_index":21446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 64.0312 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017249029","spectrum_index":21447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Ala-Lys (delta mass: 71.0318 Da; putative annotation: N/A; putative formula: C3H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.266,"smiles":null,"spectrum_id":"CCMSLIB00017249031","spectrum_index":21448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 146.0996 Da; putative annotation: N/A; putative formula: C5H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.175,"smiles":null,"spectrum_id":"CCMSLIB00017249033","spectrum_index":21449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltryptophan (delta mass: 231.1372 Da; putative annotation: N/A; putative formula: C13H17N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.245,"smiles":null,"spectrum_id":"CCMSLIB00017249036","spectrum_index":21450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 57.034 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.105,"smiles":null,"spectrum_id":"CCMSLIB00017249038","spectrum_index":21451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terrein (delta mass: 140.0263 Da; putative annotation: N/A; putative formula: C10H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.097,"smiles":null,"spectrum_id":"CCMSLIB00017249040","spectrum_index":21452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-glutamic acid (delta mass: 96.0939 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017249043","spectrum_index":21453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 163.132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.218,"smiles":null,"spectrum_id":"CCMSLIB00017249044","spectrum_index":21454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Hexadecanoyl-sn-glycerol from NIST14 (delta mass: 109.0741 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.358,"smiles":null,"spectrum_id":"CCMSLIB00017249047","spectrum_index":21455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maresin 1 (delta mass: 35.0375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.275,"smiles":null,"spectrum_id":"CCMSLIB00017249049","spectrum_index":21456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003123 Intermedine N-oxide|[(7R,8R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl (2S)-2-hydroxy-2-[(1R)-1-hydroxyethyl]-3-methylbutanoate (delta mass: 86.0368 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.212,"smiles":null,"spectrum_id":"CCMSLIB00017249051","spectrum_index":21457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Piperidinyl)-2-pyrrolidinone (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.144,"smiles":null,"spectrum_id":"CCMSLIB00017249054","spectrum_index":21458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 71.0689 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.176,"smiles":null,"spectrum_id":"CCMSLIB00017249055","spectrum_index":21459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 28.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.096,"smiles":null,"spectrum_id":"CCMSLIB00017249058","spectrum_index":21460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methylbenzoic acid (delta mass: 94.0527 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.107,"smiles":null,"spectrum_id":"CCMSLIB00017249060","spectrum_index":21461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S(-)-Cathinone (delta mass: 102.0653 Da; putative annotation: N/A; putative formula: CH6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.157,"smiles":null,"spectrum_id":"CCMSLIB00017249062","spectrum_index":21462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 116.0441 Da; putative annotation: N/A; putative formula: CH4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.088,"smiles":null,"spectrum_id":"CCMSLIB00017249064","spectrum_index":21463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 541.2904 Da; putative annotation: N/A; putative formula: C30H46N3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.361,"smiles":null,"spectrum_id":"CCMSLIB00017249066","spectrum_index":21464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 38.0159 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.274,"smiles":null,"spectrum_id":"CCMSLIB00017249069","spectrum_index":21465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 130.0821 Da; putative annotation: N/A; putative formula: C7H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.288,"smiles":null,"spectrum_id":"CCMSLIB00017249072","spectrum_index":21466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 285.1007 Da; putative annotation: N/A; putative formula: C9H15N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.308,"smiles":null,"spectrum_id":"CCMSLIB00017249073","spectrum_index":21467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aloesin (delta mass: 57.9982 Da; putative annotation: N/A; putative formula: CH2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.132,"smiles":null,"spectrum_id":"CCMSLIB00017249076","spectrum_index":21468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 173.0656 Da; putative annotation: N/A; putative formula: C3H7N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.194,"smiles":null,"spectrum_id":"CCMSLIB00017249077","spectrum_index":21469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 48.0354 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.236,"smiles":null,"spectrum_id":"CCMSLIB00017249080","spectrum_index":21470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,6-Dihydroxyheptyl)-4-methyl-2H-furan-5-one (delta mass: 36.0363 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.18,"smiles":null,"spectrum_id":"CCMSLIB00017249082","spectrum_index":21471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydiethyltryptamine (delta mass: 147.0525 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.217,"smiles":null,"spectrum_id":"CCMSLIB00017249084","spectrum_index":21472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 62.019 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.235,"smiles":null,"spectrum_id":"CCMSLIB00017249087","spectrum_index":21473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 144.115 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.284,"smiles":null,"spectrum_id":"CCMSLIB00017249088","spectrum_index":21474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017249091","spectrum_index":21475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 383.1795 Da; putative annotation: N/A; putative formula: C20H27N5O-1P2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.25,"smiles":null,"spectrum_id":"CCMSLIB00017249094","spectrum_index":21476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 118.0786 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.326,"smiles":null,"spectrum_id":"CCMSLIB00017249095","spectrum_index":21477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 155.0591 Da; putative annotation: N/A; putative formula: C8H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.134,"smiles":null,"spectrum_id":"CCMSLIB00017249098","spectrum_index":21478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 264.1212 Da; putative annotation: N/A; putative formula: C14H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.223,"smiles":null,"spectrum_id":"CCMSLIB00017249099","spectrum_index":21479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 244.1398 Da; putative annotation: N/A; putative formula: C15H20N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.181,"smiles":null,"spectrum_id":"CCMSLIB00017249102","spectrum_index":21480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 244.219 Da; putative annotation: N/A; putative formula: C18H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.316,"smiles":null,"spectrum_id":"CCMSLIB00017249103","spectrum_index":21481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 66.0106 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.134,"smiles":null,"spectrum_id":"CCMSLIB00017249106","spectrum_index":21482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholesterol (delta mass: 267.2524 Da; putative annotation: N/A; putative formula: C13H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.615,"smiles":null,"spectrum_id":"CCMSLIB00017249107","spectrum_index":21483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 547.3353 Da; putative annotation: N/A; putative formula: C40H41N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.604,"smiles":null,"spectrum_id":"CCMSLIB00017249110","spectrum_index":21484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 508.1412 Da; putative annotation: N/A; putative formula: C25H32O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":851.265,"smiles":null,"spectrum_id":"CCMSLIB00017249113","spectrum_index":21485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 270.0743 Da; putative annotation: N/A; putative formula: C15H15N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.161,"smiles":null,"spectrum_id":"CCMSLIB00017249114","spectrum_index":21486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 148.1253 Da; putative annotation: N/A; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.498,"smiles":null,"spectrum_id":"CCMSLIB00017249117","spectrum_index":21487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 128.0833 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017249118","spectrum_index":21488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 228.0729 Da; putative annotation: N/A; putative formula: C6H4N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.159,"smiles":null,"spectrum_id":"CCMSLIB00017249121","spectrum_index":21489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Trihydroxy-4-(((2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyl)oxy)cyclohexanecarboxylic acid (delta mass: 158.0366 Da; putative annotation: N/A; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.155,"smiles":null,"spectrum_id":"CCMSLIB00017249122","spectrum_index":21490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid CollisionEnergy:205060 (delta mass: 147.069 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.171,"smiles":null,"spectrum_id":"CCMSLIB00017249125","spectrum_index":21491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-((8a-(Hydroxymethyl)-5-(5-hydroxy-3-((((2Z)-2-methylbut-2-enoyl)oxy)methyl)pentyl)-5,6-dimethyl-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methoxy)-4-oxobutanoic acid (delta mass: 90.0824 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.409,"smiles":null,"spectrum_id":"CCMSLIB00017249126","spectrum_index":21492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 195.1598 Da; putative annotation: N/A; putative formula: C8H17N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.246,"smiles":null,"spectrum_id":"CCMSLIB00017249129","spectrum_index":21493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 904.9743 Da; putative annotation: N/A; putative formula: C55H120N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1215.09,"smiles":null,"spectrum_id":"CCMSLIB00017249130","spectrum_index":21494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZOIC ACID (delta mass: 243.0093 Da; putative annotation: N/A; putative formula: C3HN9O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.048,"smiles":null,"spectrum_id":"CCMSLIB00017249133","spectrum_index":21495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 17.063 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017249134","spectrum_index":21496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 238.1401 Da; putative annotation: N/A; putative formula: C7H14N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.274,"smiles":null,"spectrum_id":"CCMSLIB00017249137","spectrum_index":21497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 304.2709 Da; putative annotation: N/A; putative formula: C12H32N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.373,"smiles":null,"spectrum_id":"CCMSLIB00017249138","spectrum_index":21498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 98.0728 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017249141","spectrum_index":21499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 197.8088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.874,"smiles":null,"spectrum_id":"CCMSLIB00017249142","spectrum_index":21500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 45.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.306,"smiles":null,"spectrum_id":"CCMSLIB00017249145","spectrum_index":21501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:102040\"\" (delta mass: 103.063 Da; putative annotation: N/A; putative formula: C4H9NO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.181,"smiles":null,"spectrum_id":"CCMSLIB00017249148","spectrum_index":21502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,15-Labdanediol (delta mass: 302.2755 Da; putative annotation: N/A; putative formula: C20H34N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.57,"smiles":null,"spectrum_id":"CCMSLIB00017249149","spectrum_index":21503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Decaethylene glycol from NIST14 (delta mass: 199.2307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.511,"smiles":null,"spectrum_id":"CCMSLIB00017249151","spectrum_index":21504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 410.178 Da; putative annotation: N/A; putative formula: C30H22N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.249,"smiles":null,"spectrum_id":"CCMSLIB00017249153","spectrum_index":21505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 714.9947 Da; putative annotation: N/A; putative formula: C15H29N3O19S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":937.092,"smiles":null,"spectrum_id":"CCMSLIB00017249156","spectrum_index":21506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 91.0267 Da; putative annotation: N/A; putative formula: C2H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.274,"smiles":null,"spectrum_id":"CCMSLIB00017249157","spectrum_index":21507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA000962 Daphnetin (delta mass: 420.3389 Da; putative annotation: N/A; putative formula: C30H44O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.373,"smiles":null,"spectrum_id":"CCMSLIB00017249160","spectrum_index":21508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 36.0367 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.112,"smiles":null,"spectrum_id":"CCMSLIB00017249161","spectrum_index":21509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 259.0396 Da; putative annotation: N/A; putative formula: C13H10NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.11,"smiles":null,"spectrum_id":"CCMSLIB00017249164","spectrum_index":21510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Deoxy-.DELTA.12,14-prostaglandin D2 (delta mass: 64.0283 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.25,"smiles":null,"spectrum_id":"CCMSLIB00017249165","spectrum_index":21511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-7,24-dien-21-oic acid (delta mass: 158.0221 Da; putative annotation: N/A; putative formula: C7H10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.39,"smiles":null,"spectrum_id":"CCMSLIB00017249168","spectrum_index":21512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bellericagenin B (delta mass: 36.0348 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.382,"smiles":null,"spectrum_id":"CCMSLIB00017249169","spectrum_index":21513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 48.0352 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.246,"smiles":null,"spectrum_id":"CCMSLIB00017249172","spectrum_index":21514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017249173","spectrum_index":21515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Cyclopentyloxy)benzoic acid (delta mass: 76.0164 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017249176","spectrum_index":21516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of a-Santal-10-en-12-oic acid (delta mass: 143.0347 Da; putative annotation: N/A; putative formula: C5HN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.204,"smiles":null,"spectrum_id":"CCMSLIB00017249179","spectrum_index":21517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 55.0269 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.196,"smiles":null,"spectrum_id":"CCMSLIB00017249180","spectrum_index":21518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. ethylamide (delta mass: 118.0839 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.379,"smiles":null,"spectrum_id":"CCMSLIB00017249183","spectrum_index":21519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroferulic acid (delta mass: 31.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017249184","spectrum_index":21520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-3,5,7-trimethyltetradeca-2,4-dienedioic acid (delta mass: 48.036 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.247,"smiles":null,"spectrum_id":"CCMSLIB00017249187","spectrum_index":21521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PLATYPHYLLENONE (delta mass: 329.1625 Da; putative annotation: N/A; putative formula: C19H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.311,"smiles":null,"spectrum_id":"CCMSLIB00017249188","spectrum_index":21522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. alcohol methyl ether (delta mass: 589.483 Da; putative annotation: N/A; putative formula: C36H59N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.767,"smiles":null,"spectrum_id":"CCMSLIB00017249191","spectrum_index":21523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 86.0004 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.071,"smiles":null,"spectrum_id":"CCMSLIB00017249192","spectrum_index":21524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 38.0268 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.129,"smiles":null,"spectrum_id":"CCMSLIB00017249195","spectrum_index":21525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-amino-1-piperidinecarboxylate (delta mass: 61.0052 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017249196","spectrum_index":21526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10-2 (delta mass: 118.0784 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017249199","spectrum_index":21527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 189.1365 Da; putative annotation: N/A; putative formula: C9H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.327,"smiles":null,"spectrum_id":"CCMSLIB00017249201","spectrum_index":21528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 306.222 Da; putative annotation: N/A; putative formula: C18H31N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.303,"smiles":null,"spectrum_id":"CCMSLIB00017249203","spectrum_index":21529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxychalcone (delta mass: 38.0156 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.102,"smiles":null,"spectrum_id":"CCMSLIB00017249206","spectrum_index":21530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 149.0895 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.17,"smiles":null,"spectrum_id":"CCMSLIB00017249208","spectrum_index":21531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 393.1427 Da; putative annotation: N/A; putative formula: C19H23NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.208,"smiles":null,"spectrum_id":"CCMSLIB00017249210","spectrum_index":21532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 218.076 Da; putative annotation: N/A; putative formula: C13H14OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.187,"smiles":null,"spectrum_id":"CCMSLIB00017249213","spectrum_index":21533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-[(Z)-oct-2-enyl]pentanedioic acid (delta mass: 62.0514 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.205,"smiles":null,"spectrum_id":"CCMSLIB00017249215","spectrum_index":21534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 106.0819 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.34,"smiles":null,"spectrum_id":"CCMSLIB00017249217","spectrum_index":21535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17-Octadecynoic acid (delta mass: 317.0775 Da; putative annotation: N/A; putative formula: C14H7N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.325,"smiles":null,"spectrum_id":"CCMSLIB00017249220","spectrum_index":21536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 104.0175 Da; putative annotation: N/A; putative formula: C7H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.084,"smiles":null,"spectrum_id":"CCMSLIB00017249221","spectrum_index":21537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 182.1666 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.243,"smiles":null,"spectrum_id":"CCMSLIB00017249224","spectrum_index":21538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 461.2225 Da; putative annotation: N/A; putative formula: C27H32N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.361,"smiles":null,"spectrum_id":"CCMSLIB00017249225","spectrum_index":21539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 660.424 Da; putative annotation: N/A; putative formula: C41H61N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":823.484,"smiles":null,"spectrum_id":"CCMSLIB00017249228","spectrum_index":21540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 758.5914 Da; putative annotation: N/A; putative formula: C43H82O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1065.85,"smiles":null,"spectrum_id":"CCMSLIB00017249231","spectrum_index":21541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 61.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.202,"smiles":null,"spectrum_id":"CCMSLIB00017249232","spectrum_index":21542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385097-01_C20H22O9_beta-D-Glucopyranoside, 4-hydroxy-2-(hydroxymethyl)phenyl, 6-benzoate (delta mass: 296.0299 Da; putative annotation: N/A; putative formula: C9H13O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.164,"smiles":null,"spectrum_id":"CCMSLIB00017249235","spectrum_index":21543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroeburicoic acid (delta mass: 170.1024 Da; putative annotation: N/A; putative formula: C4H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.47,"smiles":null,"spectrum_id":"CCMSLIB00017249236","spectrum_index":21544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-formyl-16-hydroxy-1,2,14,17,17-pentamethyl-8-(prop-1-en-2-yl)pentacyclo[11.7.0.0,?.0?,?.0?,?]icosane-5-carboxylic acid (delta mass: 53.0485 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.395,"smiles":null,"spectrum_id":"CCMSLIB00017249238","spectrum_index":21545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 180.1138 Da; putative annotation: N/A; putative formula: C11H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.168,"smiles":null,"spectrum_id":"CCMSLIB00017249240","spectrum_index":21546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 181.0839 Da; putative annotation: N/A; putative formula: C8H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.222,"smiles":null,"spectrum_id":"CCMSLIB00017249243","spectrum_index":21547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 296.2298 Da; putative annotation: N/A; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.28,"smiles":null,"spectrum_id":"CCMSLIB00017249245","spectrum_index":21548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 106.0814 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.35,"smiles":null,"spectrum_id":"CCMSLIB00017249247","spectrum_index":21549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 63.0791 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.16,"smiles":null,"spectrum_id":"CCMSLIB00017249249","spectrum_index":21550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-methyl-1,3-propanediol (delta mass: 43.0058 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.092,"smiles":null,"spectrum_id":"CCMSLIB00017249251","spectrum_index":21551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11,14-Eicosadienoic acid (delta mass: 174.1424 Da; putative annotation: N/A; putative formula: C13H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.421,"smiles":null,"spectrum_id":"CCMSLIB00017249254","spectrum_index":21552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pygenic acid C (delta mass: 112.068 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.42,"smiles":null,"spectrum_id":"CCMSLIB00017249256","spectrum_index":21553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Patchouli alcohol (delta mass: 104.0985 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.304,"smiles":null,"spectrum_id":"CCMSLIB00017249258","spectrum_index":21554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100009 (R)-(-)-Phenylephrine|Neo-Synephrine|Metasympatol|Visadron|Mesaton|Mezaton|Metaoxedrine|m-Sympatol|m-Oxedrine|(R)-(?)-1-(3-Hydroxyphenyl)-2-methylaminoethanol|L-(3-Hydroxyphenyl)-N-methylethanolamine (delta mass: 236.214 Da; putative annotation: N/A; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.316,"smiles":null,"spectrum_id":"CCMSLIB00017249261","spectrum_index":21555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 276.2458 Da; putative annotation: N/A; putative formula: C19H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.353,"smiles":null,"spectrum_id":"CCMSLIB00017249263","spectrum_index":21556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 46.0413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.242,"smiles":null,"spectrum_id":"CCMSLIB00017249265","spectrum_index":21557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dehydroabietic acid (delta mass: 124.073 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.289,"smiles":null,"spectrum_id":"CCMSLIB00017249268","spectrum_index":21558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 106.0782 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.138,"smiles":null,"spectrum_id":"CCMSLIB00017249271","spectrum_index":21559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 22(S)-Hydroxycholesterol (delta mass: 129.0785 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.436,"smiles":null,"spectrum_id":"CCMSLIB00017249272","spectrum_index":21560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Diethylaniline (delta mass: 73.0989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.227,"smiles":null,"spectrum_id":"CCMSLIB00017249275","spectrum_index":21561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,6,7,8-Hexahydro-2H-pyrimido[1,2-a]pyrimidine (delta mass: 63.0297 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.148,"smiles":null,"spectrum_id":"CCMSLIB00017249276","spectrum_index":21562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 120.0977 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.356,"smiles":null,"spectrum_id":"CCMSLIB00017249279","spectrum_index":21563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 132.0066 Da; putative annotation: N/A; putative formula: C5H8S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.072,"smiles":null,"spectrum_id":"CCMSLIB00017249282","spectrum_index":21564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 57.0339 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.109,"smiles":null,"spectrum_id":"CCMSLIB00017249283","spectrum_index":21565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 129.0791 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.16,"smiles":null,"spectrum_id":"CCMSLIB00017249286","spectrum_index":21566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 143.0943 Da; putative annotation: N/A; putative formula: C7H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.175,"smiles":null,"spectrum_id":"CCMSLIB00017249287","spectrum_index":21567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 51.3354 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.5,"smiles":null,"spectrum_id":"CCMSLIB00017249290","spectrum_index":21568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geranyllinalool (delta mass: 157.037 Da; putative annotation: N/A; putative formula: C6H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.305,"smiles":null,"spectrum_id":"CCMSLIB00017249292","spectrum_index":21569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 180.0637 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.187,"smiles":null,"spectrum_id":"CCMSLIB00017249294","spectrum_index":21570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Phenylcyclopentyl)acetic acid (delta mass: 265.0802 Da; putative annotation: N/A; putative formula: C12H16N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.203,"smiles":null,"spectrum_id":"CCMSLIB00017249297","spectrum_index":21571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benz[a]anthracen-1-ol, 8-methoxy-3-methyl- (delta mass: 16.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.165,"smiles":null,"spectrum_id":"CCMSLIB00017249298","spectrum_index":21572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-2-methylpropiophenone (delta mass: 67.0528 Da; putative annotation: N/A; putative formula: C3H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.144,"smiles":null,"spectrum_id":"CCMSLIB00017249301","spectrum_index":21573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 87.0852 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.161,"smiles":null,"spectrum_id":"CCMSLIB00017249303","spectrum_index":21574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzoic acid (delta mass: 54.0661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017249305","spectrum_index":21575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 226.2016 Da; putative annotation: N/A; putative formula: C9H22N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.517,"smiles":null,"spectrum_id":"CCMSLIB00017249308","spectrum_index":21576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Oxoandrostenediol (delta mass: 45.0212 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.232,"smiles":null,"spectrum_id":"CCMSLIB00017249309","spectrum_index":21577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 135.0532 Da; putative annotation: N/A; putative formula: C4H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.301,"smiles":null,"spectrum_id":"CCMSLIB00017249312","spectrum_index":21578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-AMINOOCTANOIC ACID (delta mass: 324.1072 Da; putative annotation: N/A; putative formula: C14H28S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.24,"smiles":null,"spectrum_id":"CCMSLIB00017249313","spectrum_index":21579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 94.0166 Da; putative annotation: URACIL; putative formula: C4H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.082,"smiles":null,"spectrum_id":"CCMSLIB00017249316","spectrum_index":21580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 113.0838 Da; putative annotation: Massbank:PB000396 Isoleucine|2-amino-3-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.228,"smiles":null,"spectrum_id":"CCMSLIB00017249319","spectrum_index":21581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 108.0212 Da; putative annotation: 1,2,4-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.092,"smiles":null,"spectrum_id":"CCMSLIB00017249320","spectrum_index":21582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 294.2558 Da; putative annotation: Ricinoleic acid methyl ester; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.467,"smiles":null,"spectrum_id":"CCMSLIB00017249323","spectrum_index":21583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 262.2263 Da; putative annotation: Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.313,"smiles":null,"spectrum_id":"CCMSLIB00017249324","spectrum_index":21584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 310.2514 Da; putative annotation: NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match]; putative formula: C19H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.468,"smiles":null,"spectrum_id":"CCMSLIB00017249327","spectrum_index":21585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 278.2215 Da; putative annotation: 9(10)-Epoxy-12Z-octadecenoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.427,"smiles":null,"spectrum_id":"CCMSLIB00017249328","spectrum_index":21586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 164.1191 Da; putative annotation: 10-Undecynoic acid; putative formula: C11H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.403,"smiles":null,"spectrum_id":"CCMSLIB00017249331","spectrum_index":21587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 279.2558 Da; putative annotation: Palmitoleoyl ethanolamide; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.493,"smiles":null,"spectrum_id":"CCMSLIB00017249332","spectrum_index":21588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 310.2138 Da; putative annotation: (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.451,"smiles":null,"spectrum_id":"CCMSLIB00017249335","spectrum_index":21589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 220.1835 Da; putative annotation: ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.307,"smiles":null,"spectrum_id":"CCMSLIB00017249337","spectrum_index":21590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 8-HETE from NIST14 (delta mass: 292.242 Da; putative annotation: 13S-Hydroxy-9Z,11E-octadecadienoic acid, methyl ester; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.484,"smiles":null,"spectrum_id":"CCMSLIB00017249340","spectrum_index":21591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 262.2288 Da; putative annotation: 17-Octadecynoic acid; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.294,"smiles":null,"spectrum_id":"CCMSLIB00017249342","spectrum_index":21592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Noretiocholanolone (delta mass: 204.1538 Da; putative annotation: 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one; putative formula: C14H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.37,"smiles":null,"spectrum_id":"CCMSLIB00017249344","spectrum_index":21593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 298.1923 Da; putative annotation: Polyalthic acid; putative formula: C20H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.321,"smiles":null,"spectrum_id":"CCMSLIB00017249347","spectrum_index":21594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 132.0929 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.335,"smiles":null,"spectrum_id":"CCMSLIB00017249349","spectrum_index":21595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 124.0886 Da; putative annotation: 3-Methyl-1-cyclohexanecarboxylic acid; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.315,"smiles":null,"spectrum_id":"CCMSLIB00017249351","spectrum_index":21596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid (delta mass: 122.0728 Da; putative annotation: (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.112,"smiles":null,"spectrum_id":"CCMSLIB00017249354","spectrum_index":21597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 295.2511 Da; putative annotation: N-Palmitoylglycine; putative formula: C18H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.535,"smiles":null,"spectrum_id":"CCMSLIB00017249355","spectrum_index":21598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 358.2506 Da; putative annotation: Mevastatin; putative formula: C23H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.482,"smiles":null,"spectrum_id":"CCMSLIB00017249358","spectrum_index":21599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 142.0993 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.185,"smiles":null,"spectrum_id":"CCMSLIB00017249359","spectrum_index":21600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 116.0836 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017249362","spectrum_index":21601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 269.1402 Da; putative annotation: N/A; putative formula: C11H20N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.221,"smiles":null,"spectrum_id":"CCMSLIB00017249365","spectrum_index":21602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Asn (delta mass: 43.99 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.152,"smiles":null,"spectrum_id":"CCMSLIB00017249366","spectrum_index":21603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid (delta mass: 62.0517 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.279,"smiles":null,"spectrum_id":"CCMSLIB00017249369","spectrum_index":21604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid (delta mass: 82.0726 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.164,"smiles":null,"spectrum_id":"CCMSLIB00017249370","spectrum_index":21605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Norketamine (delta mass: 176.0307 Da; putative annotation: N/A; putative formula: C3N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.114,"smiles":null,"spectrum_id":"CCMSLIB00017249373","spectrum_index":21606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-5,8,11,14-Eicosatetraenoic acid from NIST14 (delta mass: 96.0955 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.343,"smiles":null,"spectrum_id":"CCMSLIB00017249374","spectrum_index":21607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 99.9855 Da; putative annotation: N/A; putative formula: CN4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.212,"smiles":null,"spectrum_id":"CCMSLIB00017249377","spectrum_index":21608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 182.1098 Da; putative annotation: N/A; putative formula: C14H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.347,"smiles":null,"spectrum_id":"CCMSLIB00017249378","spectrum_index":21609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 235.1613 Da; putative annotation: N/A; putative formula: C13H22N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.393,"smiles":null,"spectrum_id":"CCMSLIB00017249381","spectrum_index":21610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 144.0689 Da; putative annotation: N/A; putative formula: C9H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.14,"smiles":null,"spectrum_id":"CCMSLIB00017249382","spectrum_index":21611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Oxocleroda-3,13-dien-15-oic acid (delta mass: 94.0781 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017249385","spectrum_index":21612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenol (delta mass: 188.1562 Da; putative annotation: N/A; putative formula: C14H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.227,"smiles":null,"spectrum_id":"CCMSLIB00017249386","spectrum_index":21613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Glutamic acid, dimethyl ester (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017249389","spectrum_index":21614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 103.8996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.163,"smiles":null,"spectrum_id":"CCMSLIB00017249390","spectrum_index":21615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheximide (delta mass: 241.1301 Da; putative annotation: N/A; putative formula: C16H19NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.3,"smiles":null,"spectrum_id":"CCMSLIB00017249393","spectrum_index":21616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 245.1249 Da; putative annotation: N/A; putative formula: C8H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.216,"smiles":null,"spectrum_id":"CCMSLIB00017249394","spectrum_index":21617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24,25-Epoxylanost-7-ene-3,23-diol (delta mass: 117.0754 Da; putative annotation: N/A; putative formula: CH7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.459,"smiles":null,"spectrum_id":"CCMSLIB00017249397","spectrum_index":21618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenyl)-1H-indole-3-carbaldehyde (delta mass: 18.0676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.12,"smiles":null,"spectrum_id":"CCMSLIB00017249398","spectrum_index":21619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 331.1642 Da; putative annotation: N/A; putative formula: C16H21N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.271,"smiles":null,"spectrum_id":"CCMSLIB00017249401","spectrum_index":21620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidinol (delta mass: 112.0064 Da; putative annotation: N/A; putative formula: C7N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.187,"smiles":null,"spectrum_id":"CCMSLIB00017249402","spectrum_index":21621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380162-01_C16H28O12_alpha-D-Glucopyranoside, alpha-D-glucopyranosyl, 3-(2-methylpropanoate) (delta mass: 78.0137 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.179,"smiles":null,"spectrum_id":"CCMSLIB00017249405","spectrum_index":21622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 240.1694 Da; putative annotation: N/A; putative formula: C14H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.214,"smiles":null,"spectrum_id":"CCMSLIB00017249408","spectrum_index":21623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoic acid (delta mass: 38.0157 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017249409","spectrum_index":21624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 120.094 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.138,"smiles":null,"spectrum_id":"CCMSLIB00017249412","spectrum_index":21625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 154.0037 Da; putative annotation: N/A; putative formula: C3H7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.272,"smiles":null,"spectrum_id":"CCMSLIB00017249413","spectrum_index":21626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-O-(Phenylacetyl)-.beta.-D-glucopyranose (delta mass: 179.0775 Da; putative annotation: N/A; putative formula: C3H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.19,"smiles":null,"spectrum_id":"CCMSLIB00017249416","spectrum_index":21627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 292.2127 Da; putative annotation: N/A; putative formula: C13H24N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.45,"smiles":null,"spectrum_id":"CCMSLIB00017249417","spectrum_index":21628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[5-[(3Z,6Z)-2,12-Dihydroxydodeca-3,6-dienyl]oxolan-2-yl]acetic acid (delta mass: 62.0529 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.27,"smiles":null,"spectrum_id":"CCMSLIB00017249420","spectrum_index":21629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 310.2306 Da; putative annotation: N/A; putative formula: C7H26N12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.327,"smiles":null,"spectrum_id":"CCMSLIB00017249423","spectrum_index":21630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Piperidyl)propan-2-ol (delta mass: 270.1228 Da; putative annotation: N/A; putative formula: C13H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.261,"smiles":null,"spectrum_id":"CCMSLIB00017249425","spectrum_index":21631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-3-yl)propanenitrile (delta mass: 27.9683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.06,"smiles":null,"spectrum_id":"CCMSLIB00017249427","spectrum_index":21632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Hydroxytestosterone (delta mass: 126.0829 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.294,"smiles":null,"spectrum_id":"CCMSLIB00017249430","spectrum_index":21633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Linoleoyl-2-oleoyl-rac-glycerol (delta mass: 96.0537 Da; putative annotation: N/A; putative formula: C2H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.583,"smiles":null,"spectrum_id":"CCMSLIB00017249431","spectrum_index":21634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP004601 2-Hydroxyphenylacetic acid|2-(2-hydroxyphenyl)acetic acid (delta mass: 178.0641 Da; putative annotation: N/A; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.119,"smiles":null,"spectrum_id":"CCMSLIB00017249434","spectrum_index":21635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 97.0413 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017249435","spectrum_index":21636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 72.9709 Da; putative annotation: N/A; putative formula: CNOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.13,"smiles":null,"spectrum_id":"CCMSLIB00017249438","spectrum_index":21637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 90.0834 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.3,"smiles":null,"spectrum_id":"CCMSLIB00017249440","spectrum_index":21638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 158.152 Da; putative annotation: N/A; putative formula: C7H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.233,"smiles":null,"spectrum_id":"CCMSLIB00017249442","spectrum_index":21639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bellericagenin B (delta mass: 64.0691 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.416,"smiles":null,"spectrum_id":"CCMSLIB00017249445","spectrum_index":21640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetinic acid (delta mass: 62.0499 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.397,"smiles":null,"spectrum_id":"CCMSLIB00017249446","spectrum_index":21641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of penicillin g CollisionEnergy:102040 (delta mass: 92.0475 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.154,"smiles":null,"spectrum_id":"CCMSLIB00017249449","spectrum_index":21642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanol, decahydro-6-hydroxy-.gamma.,5,5,8a-tetramethyl-2-methylene-, 1-acetate (delta mass: 108.0937 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.383,"smiles":null,"spectrum_id":"CCMSLIB00017249450","spectrum_index":21643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethosuximide (delta mass: 130.1357 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.222,"smiles":null,"spectrum_id":"CCMSLIB00017249453","spectrum_index":21644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 106.0773 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.424,"smiles":null,"spectrum_id":"CCMSLIB00017249454","spectrum_index":21645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Corey lactone diol (delta mass: 117.125 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.206,"smiles":null,"spectrum_id":"CCMSLIB00017249457","spectrum_index":21646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycerol (delta mass: 297.2689 Da; putative annotation: N/A; putative formula: C17H36N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":918.814,"smiles":null,"spectrum_id":"CCMSLIB00017249458","spectrum_index":21647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 46.0743 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.129,"smiles":null,"spectrum_id":"CCMSLIB00017249461","spectrum_index":21648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 40.0678 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.133,"smiles":null,"spectrum_id":"CCMSLIB00017249462","spectrum_index":21649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cephradine (delta mass: 72.0271 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.144,"smiles":null,"spectrum_id":"CCMSLIB00017249465","spectrum_index":21650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 637.3498 Da; putative annotation: N/A; putative formula: C30H55NO11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":818.42,"smiles":null,"spectrum_id":"CCMSLIB00017249466","spectrum_index":21651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 481.167 Da; putative annotation: N/A; putative formula: C17H23N9O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.208,"smiles":null,"spectrum_id":"CCMSLIB00017249469","spectrum_index":21652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4'-Bipiperidin-3-ol (delta mass: 583.3708 Da; putative annotation: N/A; putative formula: C28H45N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.536,"smiles":null,"spectrum_id":"CCMSLIB00017249470","spectrum_index":21653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 54.0099 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.242,"smiles":null,"spectrum_id":"CCMSLIB00017249473","spectrum_index":21654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,11-Tridecadienoic acid, 13-(3-pentyl-2-oxiranyl)-, (8Z,11Z)- (delta mass: 54.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.326,"smiles":null,"spectrum_id":"CCMSLIB00017249474","spectrum_index":21655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 96.0424 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.098,"smiles":null,"spectrum_id":"CCMSLIB00017249477","spectrum_index":21656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 186.1224 Da; putative annotation: N/A; putative formula: C6H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.235,"smiles":null,"spectrum_id":"CCMSLIB00017249478","spectrum_index":21657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E,10Z)-N-(2-Methylpropyl)hexadeca-2,4,10-trienamide (delta mass: 257.2242 Da; putative annotation: N/A; putative formula: C17H27N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.503,"smiles":null,"spectrum_id":"CCMSLIB00017249481","spectrum_index":21658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-[(3S)-piperidin-3-yl]acetate (delta mass: 59.9852 Da; putative annotation: N/A; putative formula: CO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.103,"smiles":null,"spectrum_id":"CCMSLIB00017249482","spectrum_index":21659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"Brefeldin A, natural CollisionEnergy:102040\"\" (delta mass: 49.053 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.228,"smiles":null,"spectrum_id":"CCMSLIB00017249485","spectrum_index":21660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 117.0427 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.139,"smiles":null,"spectrum_id":"CCMSLIB00017249486","spectrum_index":21661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythine (delta mass: 58.0418 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.155,"smiles":null,"spectrum_id":"CCMSLIB00017249489","spectrum_index":21662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zizanoic acid (delta mass: 125.0139 Da; putative annotation: N/A; putative formula: C4H4N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.183,"smiles":null,"spectrum_id":"CCMSLIB00017249490","spectrum_index":21663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 71.0363 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.186,"smiles":null,"spectrum_id":"CCMSLIB00017249493","spectrum_index":21664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 126.0311 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017249494","spectrum_index":21665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380115-01_C15H14O5_2-Hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylbenzoic acid (delta mass: 60.0232 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.115,"smiles":null,"spectrum_id":"CCMSLIB00017249497","spectrum_index":21666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5.alpha.-Dihydronorethisterone (delta mass: 155.0767 Da; putative annotation: N/A; putative formula: C8H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.293,"smiles":null,"spectrum_id":"CCMSLIB00017249498","spectrum_index":21667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385640-01!5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one (delta mass: 652.1962 Da; putative annotation: N/A; putative formula: C40H35N2OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1305.4,"smiles":null,"spectrum_id":"CCMSLIB00017249501","spectrum_index":21668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 178.0644 Da; putative annotation: N/A; putative formula: C11H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.192,"smiles":null,"spectrum_id":"CCMSLIB00017249502","spectrum_index":21669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match] (delta mass: 559.4967 Da; putative annotation: N/A; putative formula: C36H65NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.765,"smiles":null,"spectrum_id":"CCMSLIB00017249505","spectrum_index":21670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-4-HYDROXYBENZOIC ACID (delta mass: 71.0344 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.084,"smiles":null,"spectrum_id":"CCMSLIB00017249506","spectrum_index":21671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 273.2664 Da; putative annotation: N/A; putative formula: C12H31N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.332,"smiles":null,"spectrum_id":"CCMSLIB00017249509","spectrum_index":21672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)cyclopentanol (delta mass: 17.9747 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.139,"smiles":null,"spectrum_id":"CCMSLIB00017249510","spectrum_index":21673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5S,6R)-2-[(3R)-1,7-bis(3,4-dihydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 88.0275 Da; putative annotation: N/A; putative formula: C2H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.25,"smiles":null,"spectrum_id":"CCMSLIB00017249513","spectrum_index":21674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 38.9314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.033,"smiles":null,"spectrum_id":"CCMSLIB00017249514","spectrum_index":21675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 11.9997 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.081,"smiles":null,"spectrum_id":"CCMSLIB00017249517","spectrum_index":21676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jasmonic acid (delta mass: 133.1103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017249518","spectrum_index":21677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,2,6,6-Pentamethyl-4-piperidinol (delta mass: 182.9006 Da; putative annotation: N/A; putative formula: H2N3O-1P5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.07,"smiles":null,"spectrum_id":"CCMSLIB00017249521","spectrum_index":21678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 260.0512 Da; putative annotation: N/A; putative formula: C7H12N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.132,"smiles":null,"spectrum_id":"CCMSLIB00017249522","spectrum_index":21679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 141.026 Da; putative annotation: N/A; putative formula: C6H9NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.237,"smiles":null,"spectrum_id":"CCMSLIB00017249525","spectrum_index":21680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 84.0583 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.337,"smiles":null,"spectrum_id":"CCMSLIB00017249526","spectrum_index":21681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 292.0696 Da; putative annotation: N/A; putative formula: C13H12N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.151,"smiles":null,"spectrum_id":"CCMSLIB00017249529","spectrum_index":21682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1211.6498 Da; putative annotation: N/A; putative formula: C67H93N3O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1374.71,"smiles":null,"spectrum_id":"CCMSLIB00017249530","spectrum_index":21683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 102.0315 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.174,"smiles":null,"spectrum_id":"CCMSLIB00017249533","spectrum_index":21684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 426.0798 Da; putative annotation: N/A; putative formula: C18H18O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.181,"smiles":null,"spectrum_id":"CCMSLIB00017249534","spectrum_index":21685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 631.6397 Da; putative annotation: N/A; putative formula: C41H81N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":817.711,"smiles":null,"spectrum_id":"CCMSLIB00017249537","spectrum_index":21686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cryptopimaric acid (delta mass: 132.0981 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.33,"smiles":null,"spectrum_id":"CCMSLIB00017249538","spectrum_index":21687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Hyodeoxycholic acid (delta mass: 78.0831 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.383,"smiles":null,"spectrum_id":"CCMSLIB00017249541","spectrum_index":21688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrodicranenone B (delta mass: 30.0105 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017249542","spectrum_index":21689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylbenzoic acid (delta mass: 12.9954 Da; putative annotation: N/A; putative formula: C22H32N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.071,"smiles":null,"spectrum_id":"CCMSLIB00017249545","spectrum_index":21690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylecgonine (delta mass: 40.0311 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.159,"smiles":null,"spectrum_id":"CCMSLIB00017249546","spectrum_index":21691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 344.1109 Da; putative annotation: N/A; putative formula: C10H17N8O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.15,"smiles":null,"spectrum_id":"CCMSLIB00017249549","spectrum_index":21692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-hydroxy-4-methyl-1,4,4a,5,6,8a-hexahydropyrimido[4,5-d]pyrimidin-2(3H)-one (delta mass: 111.0877 Da; putative annotation: N/A; putative formula: C4H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.191,"smiles":null,"spectrum_id":"CCMSLIB00017249550","spectrum_index":21693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006102 Tyramine|4-(2-aminoethyl)phenol (delta mass: 232.0436 Da; putative annotation: N/A; putative formula: C8H13N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.135,"smiles":null,"spectrum_id":"CCMSLIB00017249551","spectrum_index":21694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 79.966 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.005,"smiles":null,"spectrum_id":"CCMSLIB00017249554","spectrum_index":21695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 358.1666 Da; putative annotation: N/A; putative formula: C17H23N6OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.243,"smiles":null,"spectrum_id":"CCMSLIB00017249555","spectrum_index":21696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Bisabolol (delta mass: 102.0104 Da; putative annotation: N/A; putative formula: C7H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.216,"smiles":null,"spectrum_id":"CCMSLIB00017249558","spectrum_index":21697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 13.9788 Da; putative annotation: N/A; putative formula: H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017249559","spectrum_index":21698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroeburicoic acid (delta mass: 128.0924 Da; putative annotation: N/A; putative formula: C2H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.46,"smiles":null,"spectrum_id":"CCMSLIB00017249562","spectrum_index":21699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 86.0717 Da; putative annotation: N/A; putative formula: CH6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.142,"smiles":null,"spectrum_id":"CCMSLIB00017249563","spectrum_index":21700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Piperazin-1-yl)ethanamine (delta mass: 74.0961 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.23,"smiles":null,"spectrum_id":"CCMSLIB00017249566","spectrum_index":21701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Methyl-5.beta.-androstan-3.alpha.,17.beta.-diol (delta mass: 191.1287 Da; putative annotation: N/A; putative formula: C8H13N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.392,"smiles":null,"spectrum_id":"CCMSLIB00017249567","spectrum_index":21702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 166.0996 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.191,"smiles":null,"spectrum_id":"CCMSLIB00017249570","spectrum_index":21703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3r,5r,7r)-Adamantan-1-yl)piperidine (delta mass: 188.9563 Da; putative annotation: N/A; putative formula: C6H-1N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.162,"smiles":null,"spectrum_id":"CCMSLIB00017249571","spectrum_index":21704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 352.1895 Da; putative annotation: N/A; putative formula: C20H32OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.26,"smiles":null,"spectrum_id":"CCMSLIB00017249574","spectrum_index":21705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 136.0045 Da; putative annotation: N/A; putative formula: C2H5N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.054,"smiles":null,"spectrum_id":"CCMSLIB00017249577","spectrum_index":21706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 23.9998 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.242,"smiles":null,"spectrum_id":"CCMSLIB00017249578","spectrum_index":21707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austinoneol (delta mass: 118.0777 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.289,"smiles":null,"spectrum_id":"CCMSLIB00017249581","spectrum_index":21708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Mannitol from NIST14 (delta mass: 220.2225 Da; putative annotation: N/A; putative formula: C16H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.309,"smiles":null,"spectrum_id":"CCMSLIB00017249582","spectrum_index":21709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 18.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.264,"smiles":null,"spectrum_id":"CCMSLIB00017249585","spectrum_index":21710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 190.0927 Da; putative annotation: N/A; putative formula: C3H10N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.134,"smiles":null,"spectrum_id":"CCMSLIB00017249587","spectrum_index":21711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .omega.-3 Arachidonic acid from NIST14 (delta mass: 19.014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.262,"smiles":null,"spectrum_id":"CCMSLIB00017249589","spectrum_index":21712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Ethoxy-2-(ethylthio)-1H-benzimidazole (delta mass: 95.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.133,"smiles":null,"spectrum_id":"CCMSLIB00017249592","spectrum_index":21713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dipalmitoleoyl-sn-glycero-3-phosphoethanolamine (delta mass: 78.0467 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.538,"smiles":null,"spectrum_id":"CCMSLIB00017249593","spectrum_index":21714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 540.3459 Da; putative annotation: N/A; putative formula: C34H52OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.432,"smiles":null,"spectrum_id":"CCMSLIB00017249596","spectrum_index":21715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 272.9411 Da; putative annotation: N/A; putative formula: C5H3N7O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.038,"smiles":null,"spectrum_id":"CCMSLIB00017249599","spectrum_index":21716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 55.9901 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.05,"smiles":null,"spectrum_id":"CCMSLIB00017249601","spectrum_index":21717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 35.0743 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.26,"smiles":null,"spectrum_id":"CCMSLIB00017249603","spectrum_index":21718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 54.047 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.102,"smiles":null,"spectrum_id":"CCMSLIB00017249605","spectrum_index":21719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzoic acid (delta mass: 46.0318 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.071,"smiles":null,"spectrum_id":"CCMSLIB00017249608","spectrum_index":21720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-3-azabicyclo[3.1.0]hexane (delta mass: 30.9943 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.106,"smiles":null,"spectrum_id":"CCMSLIB00017249610","spectrum_index":21721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxybenzoic acid (delta mass: 32.0161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.071,"smiles":null,"spectrum_id":"CCMSLIB00017249612","spectrum_index":21722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2_hydroxyphenyl_acetic_acid (delta mass: 70.0784 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017249615","spectrum_index":21723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 149.0144 Da; putative annotation: N/A; putative formula: C6H4N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.079,"smiles":null,"spectrum_id":"CCMSLIB00017249617","spectrum_index":21724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1-octanamine (delta mass: 328.2971 Da; putative annotation: N/A; putative formula: C20H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.519,"smiles":null,"spectrum_id":"CCMSLIB00017249620","spectrum_index":21725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,13-Dihydrolactucin (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.133,"smiles":null,"spectrum_id":"CCMSLIB00017249622","spectrum_index":21726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 74.056 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.151,"smiles":null,"spectrum_id":"CCMSLIB00017249625","spectrum_index":21727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Acetylamino)-2-hydroxybenzoic acid (delta mass: 101.0473 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.108,"smiles":null,"spectrum_id":"CCMSLIB00017249627","spectrum_index":21728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aspochalasin T (delta mass: 156.0933 Da; putative annotation: N/A; putative formula: C6H13N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.352,"smiles":null,"spectrum_id":"CCMSLIB00017249629","spectrum_index":21729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ornithine-C18:0 (delta mass: 15.9952 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.353,"smiles":null,"spectrum_id":"CCMSLIB00017249631","spectrum_index":21730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 12.0151 Da; putative annotation: N/A; putative formula: N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.118,"smiles":null,"spectrum_id":"CCMSLIB00017249633","spectrum_index":21731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 38.9104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.997,"smiles":null,"spectrum_id":"CCMSLIB00017249636","spectrum_index":21732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethylbenzoic acid (delta mass: 40.0454 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.121,"smiles":null,"spectrum_id":"CCMSLIB00017249638","spectrum_index":21733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 25.0225 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.073,"smiles":null,"spectrum_id":"CCMSLIB00017249640","spectrum_index":21734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nervobscurine (delta mass: 30.0184 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.215,"smiles":null,"spectrum_id":"CCMSLIB00017249643","spectrum_index":21735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 191.0473 Da; putative annotation: N/A; putative formula: C4H9N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.134,"smiles":null,"spectrum_id":"CCMSLIB00017249644","spectrum_index":21736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,8-Dihydroxy-1,5,8-trimethyl-4,5a,6,7,8a,9-hexahydro-3aH-azuleno[6,5-b]furan-2-one (delta mass: 272.8511 Da; putative annotation: N/A; putative formula: C7H-1NOS5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.01,"smiles":null,"spectrum_id":"CCMSLIB00017249647","spectrum_index":21737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 103.0256 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.106,"smiles":null,"spectrum_id":"CCMSLIB00017249649","spectrum_index":21738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 144.9385 Da; putative annotation: N/A; putative formula: C3NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.165,"smiles":null,"spectrum_id":"CCMSLIB00017249651","spectrum_index":21739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetic acid methyl ester (delta mass: 98.0518 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.414,"smiles":null,"spectrum_id":"CCMSLIB00017249654","spectrum_index":21740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 294.256 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.432,"smiles":null,"spectrum_id":"CCMSLIB00017249655","spectrum_index":21741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 84.0577 Da; putative annotation: N/A; putative formula: C5H8O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.123,"smiles":null,"spectrum_id":"CCMSLIB00017249658","spectrum_index":21742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid propyl ester (delta mass: 40.0313 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017249660","spectrum_index":21743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dulcitol (delta mass: 18.9829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.069,"smiles":null,"spectrum_id":"CCMSLIB00017249662","spectrum_index":21744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19(20)-Epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 37.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.294,"smiles":null,"spectrum_id":"CCMSLIB00017249665","spectrum_index":21745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 210.1984 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.295,"smiles":null,"spectrum_id":"CCMSLIB00017249666","spectrum_index":21746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethoxybenzoic acid (delta mass: 63.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.128,"smiles":null,"spectrum_id":"CCMSLIB00017249669","spectrum_index":21747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 240.1995 Da; putative annotation: N/A; putative formula: C17H24N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.247,"smiles":null,"spectrum_id":"CCMSLIB00017249670","spectrum_index":21748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 51.0722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.169,"smiles":null,"spectrum_id":"CCMSLIB00017249673","spectrum_index":21749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 31.9224 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.956,"smiles":null,"spectrum_id":"CCMSLIB00017249675","spectrum_index":21750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 97.0047 Da; putative annotation: N/A; putative formula: C6H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.047,"smiles":null,"spectrum_id":"CCMSLIB00017249677","spectrum_index":21751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 294.2566 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.38,"smiles":null,"spectrum_id":"CCMSLIB00017249680","spectrum_index":21752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 72.0573 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017249681","spectrum_index":21753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 54.9943 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.081,"smiles":null,"spectrum_id":"CCMSLIB00017249684","spectrum_index":21754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 125.0733 Da; putative annotation: N/A; putative formula: C7H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017249685","spectrum_index":21755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylethcathinone (delta mass: 104.0424 Da; putative annotation: N/A; putative formula: C3H8N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.181,"smiles":null,"spectrum_id":"CCMSLIB00017249688","spectrum_index":21756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6.alpha.,11.beta.)-11-hydroxy-6-methylpregn-4-ene-3,20-dione (delta mass: 90.0842 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.327,"smiles":null,"spectrum_id":"CCMSLIB00017249689","spectrum_index":21757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexanone, 2-(ethylamino)-2-phenyl- (delta mass: 138.0893 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.243,"smiles":null,"spectrum_id":"CCMSLIB00017249692","spectrum_index":21758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 371.2597 Da; putative annotation: N/A; putative formula: C21H34N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.528,"smiles":null,"spectrum_id":"CCMSLIB00017249693","spectrum_index":21759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.107,"smiles":null,"spectrum_id":"CCMSLIB00017249696","spectrum_index":21760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 56.0238 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.09,"smiles":null,"spectrum_id":"CCMSLIB00017249697","spectrum_index":21761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Met-C5:0 (delta mass: 47.9993 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.115,"smiles":null,"spectrum_id":"CCMSLIB00017249700","spectrum_index":21762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 114.0739 Da; putative annotation: N/A; putative formula: CH6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.303,"smiles":null,"spectrum_id":"CCMSLIB00017249701","spectrum_index":21763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 381.3254 Da; putative annotation: N/A; putative formula: C24H39N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.542,"smiles":null,"spectrum_id":"CCMSLIB00017249704","spectrum_index":21764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 154.0623 Da; putative annotation: N/A; putative formula: C8H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.164,"smiles":null,"spectrum_id":"CCMSLIB00017249705","spectrum_index":21765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl gallate (delta mass: 259.2881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.348,"smiles":null,"spectrum_id":"CCMSLIB00017249708","spectrum_index":21766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .DELTA.2-Androstene-1.alpha.,17.beta.-diol acetate (delta mass: 104.0627 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.305,"smiles":null,"spectrum_id":"CCMSLIB00017249709","spectrum_index":21767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 119.0434 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.13,"smiles":null,"spectrum_id":"CCMSLIB00017249712","spectrum_index":21768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE (delta mass: 100.0162 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017249713","spectrum_index":21769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 152.0038 Da; putative annotation: N/A; putative formula: C6H4N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.142,"smiles":null,"spectrum_id":"CCMSLIB00017249716","spectrum_index":21770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ELAIDIC ACID (delta mass: 181.1303 Da; putative annotation: N/A; putative formula: C11H19NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.393,"smiles":null,"spectrum_id":"CCMSLIB00017249717","spectrum_index":21771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 149.0452 Da; putative annotation: N/A; putative formula: C4H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.116,"smiles":null,"spectrum_id":"CCMSLIB00017249720","spectrum_index":21772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cresotinic acid (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017249721","spectrum_index":21773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-tridecylpiperidine (delta mass: 394.3833 Da; putative annotation: N/A; putative formula: C26H50O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.699,"smiles":null,"spectrum_id":"CCMSLIB00017249724","spectrum_index":21774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 338.1364 Da; putative annotation: N/A; putative formula: C17H22O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.197,"smiles":null,"spectrum_id":"CCMSLIB00017249725","spectrum_index":21775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 118.1024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.257,"smiles":null,"spectrum_id":"CCMSLIB00017249728","spectrum_index":21776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 130.0416 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017249729","spectrum_index":21777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.358,"smiles":null,"spectrum_id":"CCMSLIB00017249732","spectrum_index":21778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 41.0377 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.145,"smiles":null,"spectrum_id":"CCMSLIB00017249733","spectrum_index":21779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ugandensolide (delta mass: 66.0462 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.216,"smiles":null,"spectrum_id":"CCMSLIB00017249736","spectrum_index":21780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleic acid (delta mass: 17.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.289,"smiles":null,"spectrum_id":"CCMSLIB00017249737","spectrum_index":21781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 143.1721 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.368,"smiles":null,"spectrum_id":"CCMSLIB00017249740","spectrum_index":21782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 268.1099 Da; putative annotation: N/A; putative formula: C17H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.186,"smiles":null,"spectrum_id":"CCMSLIB00017249741","spectrum_index":21783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Arg-Ile from NIST14 (delta mass: 113.0847 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.288,"smiles":null,"spectrum_id":"CCMSLIB00017249744","spectrum_index":21784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 823.4386 Da; putative annotation: N/A; putative formula: C41H66N3O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1004.51,"smiles":null,"spectrum_id":"CCMSLIB00017249745","spectrum_index":21785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 642.3463 Da; putative annotation: N/A; putative formula: C29H54O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.418,"smiles":null,"spectrum_id":"CCMSLIB00017249748","spectrum_index":21786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl]-3-methylidene-7-oxabicyclo[4.1.0]heptane-2,4,5-triol (delta mass: 82.0415 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.289,"smiles":null,"spectrum_id":"CCMSLIB00017249749","spectrum_index":21787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxypropyl octadecanoate (delta mass: 193.0576 Da; putative annotation: N/A; putative formula: C10H13NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.373,"smiles":null,"spectrum_id":"CCMSLIB00017249752","spectrum_index":21788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 621.4247 Da; putative annotation: N/A; putative formula: C18H43N27O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.495,"smiles":null,"spectrum_id":"CCMSLIB00017249753","spectrum_index":21789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 70.0782 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017249756","spectrum_index":21790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-hydroxybenzoic acid CollisionEnergy:102040 (delta mass: 87.0337 Da; putative annotation: N/A; putative formula: C2H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.084,"smiles":null,"spectrum_id":"CCMSLIB00017249757","spectrum_index":21791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 543.5481 Da; putative annotation: N/A; putative formula: C36H69N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.656,"smiles":null,"spectrum_id":"CCMSLIB00017249760","spectrum_index":21792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-Butaprost (delta mass: 144.0935 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.388,"smiles":null,"spectrum_id":"CCMSLIB00017249761","spectrum_index":21793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Acetyl-7-hydroxy-4-methylcoumarin (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017249764","spectrum_index":21794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 293.1819 Da; putative annotation: N/A; putative formula: C17H27NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.277,"smiles":null,"spectrum_id":"CCMSLIB00017249765","spectrum_index":21795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aleuretic Acid (delta mass: 136.0877 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.32,"smiles":null,"spectrum_id":"CCMSLIB00017249768","spectrum_index":21796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3-Hydroxycapric acid from NIST14 (delta mass: 38.0153 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.164,"smiles":null,"spectrum_id":"CCMSLIB00017249770","spectrum_index":21797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 76.0673 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.263,"smiles":null,"spectrum_id":"CCMSLIB00017249773","spectrum_index":21798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 230.0791 Da; putative annotation: N/A; putative formula: C10H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.16,"smiles":null,"spectrum_id":"CCMSLIB00017249775","spectrum_index":21799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chaulmoogric Acid (delta mass: 50.0009 Da; putative annotation: N/A; putative formula: CH-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.248,"smiles":null,"spectrum_id":"CCMSLIB00017249777","spectrum_index":21800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arthrobactin (delta mass: 396.202 Da; putative annotation: N/A; putative formula: C19H24N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":873.458,"smiles":null,"spectrum_id":"CCMSLIB00017249779","spectrum_index":21801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 54.0307 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.263,"smiles":null,"spectrum_id":"CCMSLIB00017249782","spectrum_index":21802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 119.0371 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017249784","spectrum_index":21803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2S,8aR)-1-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol (delta mass: 61.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.332,"smiles":null,"spectrum_id":"CCMSLIB00017249787","spectrum_index":21804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 291.2929 Da; putative annotation: N/A; putative formula: C20H37N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.525,"smiles":null,"spectrum_id":"CCMSLIB00017249789","spectrum_index":21805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AC1LCPS5 CollisionEnergy:102040 (delta mass: 19.0135 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.11,"smiles":null,"spectrum_id":"CCMSLIB00017249791","spectrum_index":21806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026602 5?-CHOLANIC ACID-3?-OL-7_12-DIONE|3-Hydroxy-7,12-diketocholanoic acid|(4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydro-1H-cyclopenta[a (delta mass: 23.0158 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.279,"smiles":null,"spectrum_id":"CCMSLIB00017249794","spectrum_index":21807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 102.0795 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.181,"smiles":null,"spectrum_id":"CCMSLIB00017249795","spectrum_index":21808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 149.0834 Da; putative annotation: N/A; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.362,"smiles":null,"spectrum_id":"CCMSLIB00017249798","spectrum_index":21809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 461.2622 Da; putative annotation: N/A; putative formula: C22H39NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.38,"smiles":null,"spectrum_id":"CCMSLIB00017249800","spectrum_index":21810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 84.0343 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.11,"smiles":null,"spectrum_id":"CCMSLIB00017249802","spectrum_index":21811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 160.0296 Da; putative annotation: N/A; putative formula: C6H9O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.11,"smiles":null,"spectrum_id":"CCMSLIB00017249805","spectrum_index":21812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-p-Menthan-7-oic acid (delta mass: 63.9959 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.134,"smiles":null,"spectrum_id":"CCMSLIB00017249808","spectrum_index":21813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310824 N-Fructosyl isoleucine (delta mass: 549.2845 Da; putative annotation: N/A; putative formula: C24H39N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.439,"smiles":null,"spectrum_id":"CCMSLIB00017249809","spectrum_index":21814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 132.0936 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.461,"smiles":null,"spectrum_id":"CCMSLIB00017249812","spectrum_index":21815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(4-Methoxyphenyl)ethyl]-4-piperidinamine (delta mass: 60.0458 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.226,"smiles":null,"spectrum_id":"CCMSLIB00017249813","spectrum_index":21816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 923.843 Da; putative annotation: N/A; putative formula: C60H105N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1591.07,"smiles":null,"spectrum_id":"CCMSLIB00017249816","spectrum_index":21817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufalin (delta mass: 68.0255 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.279,"smiles":null,"spectrum_id":"CCMSLIB00017249817","spectrum_index":21818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 122.109 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.242,"smiles":null,"spectrum_id":"CCMSLIB00017249820","spectrum_index":21819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 17.07 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.197,"smiles":null,"spectrum_id":"CCMSLIB00017249823","spectrum_index":21820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 417.2851 Da; putative annotation: N/A; putative formula: C21H35N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.434,"smiles":null,"spectrum_id":"CCMSLIB00017249824","spectrum_index":21821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,5R,9S,13R)-14-formyl-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadec-14-ene-5-carboxylic acid (delta mass: 179.1534 Da; putative annotation: N/A; putative formula: C9H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.365,"smiles":null,"spectrum_id":"CCMSLIB00017249826","spectrum_index":21822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 97.0 Da; putative annotation: N/A; putative formula: C4H3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.972,"smiles":null,"spectrum_id":"CCMSLIB00017249828","spectrum_index":21823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 59.1098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.196,"smiles":null,"spectrum_id":"CCMSLIB00017249831","spectrum_index":21824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 351.2409 Da; putative annotation: N/A; putative formula: C20H33NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.452,"smiles":null,"spectrum_id":"CCMSLIB00017249832","spectrum_index":21825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 136.0677 Da; putative annotation: N/A; putative formula: C12H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.143,"smiles":null,"spectrum_id":"CCMSLIB00017249835","spectrum_index":21826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 128.1412 Da; putative annotation: N/A; putative formula: C6H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.248,"smiles":null,"spectrum_id":"CCMSLIB00017249836","spectrum_index":21827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 86.0003 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.081,"smiles":null,"spectrum_id":"CCMSLIB00017249839","spectrum_index":21828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lotusine (delta mass: 129.0351 Da; putative annotation: N/A; putative formula: C5H8NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.21,"smiles":null,"spectrum_id":"CCMSLIB00017249841","spectrum_index":21829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 81.9429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.112,"smiles":null,"spectrum_id":"CCMSLIB00017249843","spectrum_index":21830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 42.992 Da; putative annotation: N/A; putative formula: CHNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.094,"smiles":null,"spectrum_id":"CCMSLIB00017249846","spectrum_index":21831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 325.1499 Da; putative annotation: N/A; putative formula: C12H19N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.21,"smiles":null,"spectrum_id":"CCMSLIB00017249847","spectrum_index":21832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Colubrinic acid (delta mass: 60.0219 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.369,"smiles":null,"spectrum_id":"CCMSLIB00017249850","spectrum_index":21833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)cyclohexanol (delta mass: 227.1596 Da; putative annotation: N/A; putative formula: C10H21N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.34,"smiles":null,"spectrum_id":"CCMSLIB00017249851","spectrum_index":21834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 249.1577 Da; putative annotation: N/A; putative formula: C11H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.218,"smiles":null,"spectrum_id":"CCMSLIB00017249854","spectrum_index":21835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 68.0409 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.111,"smiles":null,"spectrum_id":"CCMSLIB00017249856","spectrum_index":21836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 39.9628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.122,"smiles":null,"spectrum_id":"CCMSLIB00017249858","spectrum_index":21837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 94.0414 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.101,"smiles":null,"spectrum_id":"CCMSLIB00017249861","spectrum_index":21838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-benzimidazol-4-amine (delta mass: 39.0112 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.098,"smiles":null,"spectrum_id":"CCMSLIB00017249862","spectrum_index":21839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 187.0805 Da; putative annotation: N/A; putative formula: C4H9N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.14,"smiles":null,"spectrum_id":"CCMSLIB00017249865","spectrum_index":21840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloropropyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 383.1401 Da; putative annotation: N/A; putative formula: C18H25NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.203,"smiles":null,"spectrum_id":"CCMSLIB00017249867","spectrum_index":21841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxyphenylacetic acid (delta mass: 70.0416 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017249869","spectrum_index":21842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal (delta mass: 63.0357 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.085,"smiles":null,"spectrum_id":"CCMSLIB00017249872","spectrum_index":21843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 196.183 Da; putative annotation: N/A; putative formula: C13H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.269,"smiles":null,"spectrum_id":"CCMSLIB00017249873","spectrum_index":21844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 208.8971 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.957,"smiles":null,"spectrum_id":"CCMSLIB00017249876","spectrum_index":21845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 184.0732 Da; putative annotation: N/A; putative formula: C9H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.144,"smiles":null,"spectrum_id":"CCMSLIB00017249878","spectrum_index":21846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 74.0732 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.165,"smiles":null,"spectrum_id":"CCMSLIB00017249880","spectrum_index":21847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 92.047 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.149,"smiles":null,"spectrum_id":"CCMSLIB00017249883","spectrum_index":21848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.238,"smiles":null,"spectrum_id":"CCMSLIB00017249885","spectrum_index":21849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 4-ethyl-2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 90.0536 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.26,"smiles":null,"spectrum_id":"CCMSLIB00017249887","spectrum_index":21850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,17-diol (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017249890","spectrum_index":21851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 43.0065 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.156,"smiles":null,"spectrum_id":"CCMSLIB00017249891","spectrum_index":21852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 43.0062 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.103,"smiles":null,"spectrum_id":"CCMSLIB00017249894","spectrum_index":21853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 57.0564 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.106,"smiles":null,"spectrum_id":"CCMSLIB00017249897","spectrum_index":21854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,6'-Dihydroxy-5,5'-dimethoxybiphenyl-3,3'-dicarboxylic acid (delta mass: 907.67 Da; putative annotation: N/A; putative formula: C44H85N13O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1242.75,"smiles":null,"spectrum_id":"CCMSLIB00017249898","spectrum_index":21855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Deoxy-11-methyleneprostaglandin D2 (delta mass: 435.2612 Da; putative annotation: N/A; putative formula: C28H39NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.514,"smiles":null,"spectrum_id":"CCMSLIB00017249901","spectrum_index":21856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 16.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.15,"smiles":null,"spectrum_id":"CCMSLIB00017249902","spectrum_index":21857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 55.0673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.154,"smiles":null,"spectrum_id":"CCMSLIB00017249905","spectrum_index":21858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 234.095 Da; putative annotation: N/A; putative formula: C4H6N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.348,"smiles":null,"spectrum_id":"CCMSLIB00017249907","spectrum_index":21859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU275701 Labetalol|2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide (delta mass: 205.1415 Da; putative annotation: N/A; putative formula: C8H19N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.328,"smiles":null,"spectrum_id":"CCMSLIB00017249909","spectrum_index":21860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 189.0428 Da; putative annotation: N/A; putative formula: C10H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.14,"smiles":null,"spectrum_id":"CCMSLIB00017249912","spectrum_index":21861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 74.0537 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.14,"smiles":null,"spectrum_id":"CCMSLIB00017249914","spectrum_index":21862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 25.9105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":125.986,"smiles":null,"spectrum_id":"CCMSLIB00017249916","spectrum_index":21863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-C22:6 (delta mass: 154.0036 Da; putative annotation: N/A; putative formula: C3H7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.283,"smiles":null,"spectrum_id":"CCMSLIB00017249919","spectrum_index":21864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 14.0164 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.092,"smiles":null,"spectrum_id":"CCMSLIB00017249922","spectrum_index":21865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Dehydrocorticosterone (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.201,"smiles":null,"spectrum_id":"CCMSLIB00017249924","spectrum_index":21866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dihydroxy-5Z,8Z,11Z-eicosatrienoic acid (delta mass: 124.089 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.342,"smiles":null,"spectrum_id":"CCMSLIB00017249926","spectrum_index":21867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11-Eicosatrienoic acid (delta mass: 124.0738 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.337,"smiles":null,"spectrum_id":"CCMSLIB00017249929","spectrum_index":21868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 274.2495 Da; putative annotation: N/A; putative formula: C12H30N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.289,"smiles":null,"spectrum_id":"CCMSLIB00017249931","spectrum_index":21869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 358.2706 Da; putative annotation: N/A; putative formula: C17H30N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.308,"smiles":null,"spectrum_id":"CCMSLIB00017249933","spectrum_index":21870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.Xi.)-3,19-Dihydroxyurs-12-ene-24,28-dioic acid (delta mass: 130.0758 Da; putative annotation: N/A; putative formula: C4H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.412,"smiles":null,"spectrum_id":"CCMSLIB00017249936","spectrum_index":21871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 27.0466 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.242,"smiles":null,"spectrum_id":"CCMSLIB00017249938","spectrum_index":21872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 122.0366 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.196,"smiles":null,"spectrum_id":"CCMSLIB00017249941","spectrum_index":21873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU406506 3,6,9,12-Tetraoxatetracosan-1-ol|Tetraethylene glycol monododecyl ether|2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethanol (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.373,"smiles":null,"spectrum_id":"CCMSLIB00017249942","spectrum_index":21874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Nitroso-8-quinolinol (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.061,"smiles":null,"spectrum_id":"CCMSLIB00017249945","spectrum_index":21875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 44.021 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.145,"smiles":null,"spectrum_id":"CCMSLIB00017249948","spectrum_index":21876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-oleoyl-sn-glycerol (delta mass: 589.2864 Da; putative annotation: N/A; putative formula: C35H43NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1184.82,"smiles":null,"spectrum_id":"CCMSLIB00017249949","spectrum_index":21877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxydodecanoic acid (delta mass: 68.0633 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.243,"smiles":null,"spectrum_id":"CCMSLIB00017249952","spectrum_index":21878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 174.0638 Da; putative annotation: N/A; putative formula: C6H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.134,"smiles":null,"spectrum_id":"CCMSLIB00017249954","spectrum_index":21879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Syringaldehyde from NIST14 (delta mass: 18.0448 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.11,"smiles":null,"spectrum_id":"CCMSLIB00017249956","spectrum_index":21880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 29.019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.086,"smiles":null,"spectrum_id":"CCMSLIB00017249959","spectrum_index":21881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E)-11,11-Dimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene-4-carboxylic acid (delta mass: 186.1773 Da; putative annotation: N/A; putative formula: C15H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.347,"smiles":null,"spectrum_id":"CCMSLIB00017249960","spectrum_index":21882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Methyl-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 114.0837 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.331,"smiles":null,"spectrum_id":"CCMSLIB00017249963","spectrum_index":21883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU043703 Monomethyl phthalate|2-(Methoxycarbonyl)benzoic acid|2-methoxycarbonylbenzoic acid (delta mass: 98.0703 Da; putative annotation: N/A; putative formula: C2H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.12,"smiles":null,"spectrum_id":"CCMSLIB00017249966","spectrum_index":21884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyquinuclidine-3-carbonitrile (delta mass: 26.0045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.107,"smiles":null,"spectrum_id":"CCMSLIB00017249967","spectrum_index":21885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 299.2044 Da; putative annotation: N/A; putative formula: C23H25NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.28,"smiles":null,"spectrum_id":"CCMSLIB00017249970","spectrum_index":21886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy-4(15),11(13)-eudesmadien-12,6-olide (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.169,"smiles":null,"spectrum_id":"CCMSLIB00017249971","spectrum_index":21887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4,6-dihydroxy-2,3-dimethylbenzoate (delta mass: 118.078 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.159,"smiles":null,"spectrum_id":"CCMSLIB00017249974","spectrum_index":21888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 132.0419 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.211,"smiles":null,"spectrum_id":"CCMSLIB00017249977","spectrum_index":21889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 237.137 Da; putative annotation: N/A; putative formula: C13H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.218,"smiles":null,"spectrum_id":"CCMSLIB00017249979","spectrum_index":21890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Methoxy-2,2-dimethyl-2,6-dihydro-pyrano[3,2-c]quinolin-5-one (delta mass: 62.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.149,"smiles":null,"spectrum_id":"CCMSLIB00017249981","spectrum_index":21891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin D1 alcohol (delta mass: 124.0523 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.321,"smiles":null,"spectrum_id":"CCMSLIB00017249984","spectrum_index":21892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 299.2102 Da; putative annotation: N/A; putative formula: C17H33NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.281,"smiles":null,"spectrum_id":"CCMSLIB00017249985","spectrum_index":21893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 45.9846 Da; putative annotation: N/A; putative formula: C4H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.118,"smiles":null,"spectrum_id":"CCMSLIB00017249988","spectrum_index":21894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 203.1751 Da; putative annotation: N/A; putative formula: C8H21N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.36,"smiles":null,"spectrum_id":"CCMSLIB00017249991","spectrum_index":21895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-[(2,5,5,8a-Tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol (delta mass: 52.0686 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.322,"smiles":null,"spectrum_id":"CCMSLIB00017249992","spectrum_index":21896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-.beta.,2,5,5,8a-pentamethyl-3-oxo-, (8aS)- (delta mass: 106.0787 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017249995","spectrum_index":21897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 246.1492 Da; putative annotation: N/A; putative formula: C11H23N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.365,"smiles":null,"spectrum_id":"CCMSLIB00017249997","spectrum_index":21898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 76.0312 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017249999","spectrum_index":21899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,2,3,4-Tetrahydro-9H-carbazol-9-yl)propanohydrazide (delta mass: 103.0727 Da; putative annotation: N/A; putative formula: C3H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.233,"smiles":null,"spectrum_id":"CCMSLIB00017250002","spectrum_index":21900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 173.1047 Da; putative annotation: N/A; putative formula: C8H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.191,"smiles":null,"spectrum_id":"CCMSLIB00017250004","spectrum_index":21901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 87.0679 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.149,"smiles":null,"spectrum_id":"CCMSLIB00017250007","spectrum_index":21902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclovirobuxine D (delta mass: 86.0433 Da; putative annotation: N/A; putative formula: C3H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.412,"smiles":null,"spectrum_id":"CCMSLIB00017250009","spectrum_index":21903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP030402 ?-linolenic acid|linolenic acid|(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid (delta mass: 19.014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.246,"smiles":null,"spectrum_id":"CCMSLIB00017250011","spectrum_index":21904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-(1H-indol-3-yl)-3-oxopropanoate (delta mass: 62.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.134,"smiles":null,"spectrum_id":"CCMSLIB00017250014","spectrum_index":21905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 313.308 Da; putative annotation: N/A; putative formula: C14H35N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.379,"smiles":null,"spectrum_id":"CCMSLIB00017250015","spectrum_index":21906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 110.0624 Da; putative annotation: N/A; putative formula: C7H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.181,"smiles":null,"spectrum_id":"CCMSLIB00017250018","spectrum_index":21907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3aR,6aR,8R,9S,10S,10aR,11R)-2,8,10-Trihydroxy-3a-methyl-12-methylenedodecahydro-1H,7H-5,7,10b-(epimethanetriyl)-6a,9-ethanodibenzo[cd,f]indole (delta mass: 72.0361 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.242,"smiles":null,"spectrum_id":"CCMSLIB00017250021","spectrum_index":21908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12(13)-Epoxy-9Z-octadecenoic acid from NIST14 (delta mass: 27.0198 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.262,"smiles":null,"spectrum_id":"CCMSLIB00017250022","spectrum_index":21909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bergenin (delta mass: 140.0474 Da; putative annotation: N/A; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.134,"smiles":null,"spectrum_id":"CCMSLIB00017250025","spectrum_index":21910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvaol (delta mass: 42.0119 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.4,"smiles":null,"spectrum_id":"CCMSLIB00017250027","spectrum_index":21911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 185.0857 Da; putative annotation: N/A; putative formula: C5H11N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.177,"smiles":null,"spectrum_id":"CCMSLIB00017250029","spectrum_index":21912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 633.3358 Da; putative annotation: N/A; putative formula: C28H47N11O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":986.604,"smiles":null,"spectrum_id":"CCMSLIB00017250032","spectrum_index":21913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.Xi.,9.Xi.,18.Xi.)-3-Oxolup-20(29)-ene-27,28-dioic acid (delta mass: 132.0936 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.42,"smiles":null,"spectrum_id":"CCMSLIB00017250033","spectrum_index":21914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 27.9999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.045,"smiles":null,"spectrum_id":"CCMSLIB00017250036","spectrum_index":21915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 243.1473 Da; putative annotation: N/A; putative formula: C12H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.218,"smiles":null,"spectrum_id":"CCMSLIB00017250039","spectrum_index":21916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 112.0613 Da; putative annotation: N/A; putative formula: CH4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.552,"smiles":null,"spectrum_id":"CCMSLIB00017250041","spectrum_index":21917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 118.042 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.134,"smiles":null,"spectrum_id":"CCMSLIB00017250043","spectrum_index":21918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 41.1568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.237,"smiles":null,"spectrum_id":"CCMSLIB00017250045","spectrum_index":21919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369606 Salicylic acid|2-hydroxybenzoic acid (delta mass: 331.1638 Da; putative annotation: N/A; putative formula: C16H29NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.203,"smiles":null,"spectrum_id":"CCMSLIB00017250048","spectrum_index":21920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 33.046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017250050","spectrum_index":21921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 369.1069 Da; putative annotation: N/A; putative formula: C17H23NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.188,"smiles":null,"spectrum_id":"CCMSLIB00017250052","spectrum_index":21922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140301 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 32.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.122,"smiles":null,"spectrum_id":"CCMSLIB00017250055","spectrum_index":21923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Arachidonyl glycerol ether (delta mass: 134.1095 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.414,"smiles":null,"spectrum_id":"CCMSLIB00017250057","spectrum_index":21924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 301.2417 Da; putative annotation: N/A; putative formula: C20H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.495,"smiles":null,"spectrum_id":"CCMSLIB00017250059","spectrum_index":21925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16.alpha.-Hydroxypregnenolone (delta mass: 50.0151 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.258,"smiles":null,"spectrum_id":"CCMSLIB00017250062","spectrum_index":21926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chorismic acid (delta mass: 98.943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.998,"smiles":null,"spectrum_id":"CCMSLIB00017250064","spectrum_index":21927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 150.2134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.3,"smiles":null,"spectrum_id":"CCMSLIB00017250066","spectrum_index":21928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 189.119 Da; putative annotation: N/A; putative formula: C9H19NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.225,"smiles":null,"spectrum_id":"CCMSLIB00017250069","spectrum_index":21929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 143.1594 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.255,"smiles":null,"spectrum_id":"CCMSLIB00017250071","spectrum_index":21930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 349.1739 Da; putative annotation: N/A; putative formula: C15H27NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.255,"smiles":null,"spectrum_id":"CCMSLIB00017250073","spectrum_index":21931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4a-Dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.232,"smiles":null,"spectrum_id":"CCMSLIB00017250075","spectrum_index":21932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 23.0127 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.141,"smiles":null,"spectrum_id":"CCMSLIB00017250078","spectrum_index":21933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 16.9896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.076,"smiles":null,"spectrum_id":"CCMSLIB00017250081","spectrum_index":21934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,11.beta.,21-triol-20-one (delta mass: 88.0669 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.32,"smiles":null,"spectrum_id":"CCMSLIB00017250082","spectrum_index":21935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 125.1694 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.236,"smiles":null,"spectrum_id":"CCMSLIB00017250085","spectrum_index":21936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 159.0899 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.14,"smiles":null,"spectrum_id":"CCMSLIB00017250087","spectrum_index":21937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-Hydroxy-6'-methoxyacetophenone (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017250090","spectrum_index":21938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Testosterone (delta mass: 171.1066 Da; putative annotation: N/A; putative formula: C9H17NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.323,"smiles":null,"spectrum_id":"CCMSLIB00017250092","spectrum_index":21939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,9-Dihydroxy-5Z,11Z,14Z-eicosatrienoic acid (delta mass: 94.0788 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017250094","spectrum_index":21940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-hydroxypropanoate (delta mass: 28.9954 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.05,"smiles":null,"spectrum_id":"CCMSLIB00017250097","spectrum_index":21941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 64.0681 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.374,"smiles":null,"spectrum_id":"CCMSLIB00017250100","spectrum_index":21942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Hydroxytestosterone (delta mass: 62.0517 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.263,"smiles":null,"spectrum_id":"CCMSLIB00017250101","spectrum_index":21943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 78.0466 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.128,"smiles":null,"spectrum_id":"CCMSLIB00017250104","spectrum_index":21944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 217.0778 Da; putative annotation: N/A; putative formula: C9H15NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.123,"smiles":null,"spectrum_id":"CCMSLIB00017250106","spectrum_index":21945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 88.9934 Da; putative annotation: N/A; putative formula: C2H3NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.059,"smiles":null,"spectrum_id":"CCMSLIB00017250108","spectrum_index":21946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocorticosterone (delta mass: 733.5093 Da; putative annotation: N/A; putative formula: C37H71N3O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1084.76,"smiles":null,"spectrum_id":"CCMSLIB00017250111","spectrum_index":21947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpent-2-enoic acid (delta mass: 40.0303 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.106,"smiles":null,"spectrum_id":"CCMSLIB00017250114","spectrum_index":21948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 184.0713 Da; putative annotation: N/A; putative formula: C13H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.121,"smiles":null,"spectrum_id":"CCMSLIB00017250116","spectrum_index":21949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl syringate (delta mass: 178.0386 Da; putative annotation: N/A; putative formula: C9H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.13,"smiles":null,"spectrum_id":"CCMSLIB00017250118","spectrum_index":21950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 319.3218 Da; putative annotation: N/A; putative formula: C22H41N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.455,"smiles":null,"spectrum_id":"CCMSLIB00017250121","spectrum_index":21951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 80.986 Da; putative annotation: N/A; putative formula: C3H-1NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.208,"smiles":null,"spectrum_id":"CCMSLIB00017250123","spectrum_index":21952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Oxohexanoic acid (delta mass: 56.0256 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017250126","spectrum_index":21953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Ile (delta mass: 113.084 Da; putative annotation: 2-Amino-2-ethylbutanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017250128","spectrum_index":21954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000104 5-hydroxyculmorin|(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol (delta mass: 262.228 Da; putative annotation: Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.424,"smiles":null,"spectrum_id":"CCMSLIB00017250131","spectrum_index":21955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 262.2297 Da; putative annotation: Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.472,"smiles":null,"spectrum_id":"CCMSLIB00017250134","spectrum_index":21956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S,4aR)-4-(Hydroxymethyl)-3,4a,8,8-tetramethyl-4a,5,6,7,8,8a-hexahydronaphthalen-1(4H)-one (delta mass: 190.1721 Da; putative annotation: 1-Ethynylcyclododecanol; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.357,"smiles":null,"spectrum_id":"CCMSLIB00017250135","spectrum_index":21957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinoleoyl-rac-glycerol (delta mass: 148.126 Da; putative annotation: (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.41,"smiles":null,"spectrum_id":"CCMSLIB00017250138","spectrum_index":21958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 116.0471 Da; putative annotation: 2-Deoxy-D-ribose; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017250141","spectrum_index":21959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 243.1474 Da; putative annotation: (2R)-3-Hydroxyisovaleroylcarnitine; putative formula: C12H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.218,"smiles":null,"spectrum_id":"CCMSLIB00017250143","spectrum_index":21960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000103 5-hydroxyculmorin|(1S,3R,3aS,4R,6R,8aR,9R)-Decahydro-1,5,5,8a-tetramethyl-1,4-methanoazulene-3,6,9-triol (delta mass: 280.2391 Da; putative annotation: 8-(3-Octyl-2-oxiranyl)octanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.435,"smiles":null,"spectrum_id":"CCMSLIB00017250145","spectrum_index":21961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,5.Xi.,9.Xi.,18.alpha.)-3-Hydroxy-11-oxoolean-12-en-30-oic acid (delta mass: 132.0949 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.442,"smiles":null,"spectrum_id":"CCMSLIB00017250148","spectrum_index":21962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 699.5232 Da; putative annotation: 1-Palmitoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine; putative formula: C39H74NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":994.75,"smiles":null,"spectrum_id":"CCMSLIB00017250149","spectrum_index":21963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 236.1424 Da; putative annotation: 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel-; putative formula: C14H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.359,"smiles":null,"spectrum_id":"CCMSLIB00017250152","spectrum_index":21964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 358.2508 Da; putative annotation: Mevastatin; putative formula: C23H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.467,"smiles":null,"spectrum_id":"CCMSLIB00017250155","spectrum_index":21965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 280.1845 Da; putative annotation: Massbank:UF415001 Norethisterone / norethindrone|Norethindrone|(8R,9S,10R,13S,14S,17R)-17-Ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one; putative formula: C20H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.416,"smiles":null,"spectrum_id":"CCMSLIB00017250158","spectrum_index":21966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 116.0475 Da; putative annotation: 2-Deoxy-D-ribose; putative formula: C5H8O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.118,"smiles":null,"spectrum_id":"CCMSLIB00017250159","spectrum_index":21967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 317.2365 Da; putative annotation: Gly-C18:3; putative formula: C20H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.474,"smiles":null,"spectrum_id":"CCMSLIB00017250162","spectrum_index":21968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 265.2034 Da; putative annotation: Gly-C14:1; putative formula: C16H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.383,"smiles":null,"spectrum_id":"CCMSLIB00017250165","spectrum_index":21969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Bis(3,4-dihydroxyphenyl)-4-(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl)-3,4-dihydro-2H,14H-8,14-methanochromeno[7,8-d][1,3]benzodioxocine-3,5,11,13,15-pentol (delta mass: 286.0442 Da; putative annotation: Taxifolin; putative formula: C15H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1151.24,"smiles":null,"spectrum_id":"CCMSLIB00017250168","spectrum_index":21970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylvanillin (delta mass: 100.0503 Da; putative annotation: N/A; putative formula: CH4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.121,"smiles":null,"spectrum_id":"CCMSLIB00017250169","spectrum_index":21971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 458.2855 Da; putative annotation: N/A; putative formula: C28H42O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.565,"smiles":null,"spectrum_id":"CCMSLIB00017250172","spectrum_index":21972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyalthic acid (delta mass: 78.0832 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.294,"smiles":null,"spectrum_id":"CCMSLIB00017250175","spectrum_index":21973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Gln-Arg (delta mass: 128.0576 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.278,"smiles":null,"spectrum_id":"CCMSLIB00017250176","spectrum_index":21974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 144.1129 Da; putative annotation: N/A; putative formula: C4H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.267,"smiles":null,"spectrum_id":"CCMSLIB00017250179","spectrum_index":21975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 369.162 Da; putative annotation: N/A; putative formula: C19H31NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.286,"smiles":null,"spectrum_id":"CCMSLIB00017250182","spectrum_index":21976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 30.0109 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.098,"smiles":null,"spectrum_id":"CCMSLIB00017250183","spectrum_index":21977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 92.0033 Da; putative annotation: N/A; putative formula: C2H5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.241,"smiles":null,"spectrum_id":"CCMSLIB00017250186","spectrum_index":21978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzocain (delta mass: 111.0179 Da; putative annotation: N/A; putative formula: C2HN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.104,"smiles":null,"spectrum_id":"CCMSLIB00017250189","spectrum_index":21979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 102.0819 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.153,"smiles":null,"spectrum_id":"CCMSLIB00017250190","spectrum_index":21980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Fluorobenzyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 118.0353 Da; putative annotation: N/A; putative formula: C8H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.128,"smiles":null,"spectrum_id":"CCMSLIB00017250193","spectrum_index":21981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 70.0053 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.06,"smiles":null,"spectrum_id":"CCMSLIB00017250194","spectrum_index":21982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E,8E)-9-[3a-hydroxy-6,7-dimethyl-1-(2-methylpropyl)-3-oxo-2,4,7,7a-tetrahydro-1H-isoindol-4-yl]-4,5-dihydroxy-8-methylnona-2,8-dienoate (delta mass: 48.0367 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.322,"smiles":null,"spectrum_id":"CCMSLIB00017250197","spectrum_index":21983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1.alpha.,2.alpha.,3.beta.,5.Xi.,9.Xi.,13.Xi.,14.Xi.,18.Xi.)-1,2,3,22,23,29-Hexahydroxy-13,27-cycloolean-11-en-28-oic acid (delta mass: 124.0596 Da; putative annotation: N/A; putative formula: C2H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.386,"smiles":null,"spectrum_id":"CCMSLIB00017250198","spectrum_index":21984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyphenylacetic acid (delta mass: 519.32 Da; putative annotation: N/A; putative formula: C29H45NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.375,"smiles":null,"spectrum_id":"CCMSLIB00017250201","spectrum_index":21985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 139.063 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.159,"smiles":null,"spectrum_id":"CCMSLIB00017250204","spectrum_index":21986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 39.8034 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.885,"smiles":null,"spectrum_id":"CCMSLIB00017250205","spectrum_index":21987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 101.0806 Da; putative annotation: N/A; putative formula: CH7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.16,"smiles":null,"spectrum_id":"CCMSLIB00017250208","spectrum_index":21988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 137.9412 Da; putative annotation: N/A; putative formula: C5OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.006,"smiles":null,"spectrum_id":"CCMSLIB00017250209","spectrum_index":21989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 53.0754 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.13,"smiles":null,"spectrum_id":"CCMSLIB00017250212","spectrum_index":21990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 601.2381 Da; putative annotation: N/A; putative formula: C38H36NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.387,"smiles":null,"spectrum_id":"CCMSLIB00017250214","spectrum_index":21991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 61.017 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.093,"smiles":null,"spectrum_id":"CCMSLIB00017250216","spectrum_index":21992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,7,10,13,16,19-Docosahexaenoic acid (delta mass: 42.0469 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.294,"smiles":null,"spectrum_id":"CCMSLIB00017250219","spectrum_index":21993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347828-02_C24H37NO5_(7E)-11,12,13-Trihydroxy-3-isobutyl-4,5,8-trimethyl-3,3a,4,6a,9,10,11,12,13,14-decahydro-1H-cycloundeca[d]isoindole-1,15(2H)-dione (delta mass: 419.2634 Da; putative annotation: N/A; putative formula: C19H37N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":839.538,"smiles":null,"spectrum_id":"CCMSLIB00017250222","spectrum_index":21994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,,3S,5Z)-3-hydroxy-1,5-octadien-1-yl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5Z)- (delta mass: 22.0191 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.256,"smiles":null,"spectrum_id":"CCMSLIB00017250224","spectrum_index":21995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 135.0453 Da; putative annotation: N/A; putative formula: C4H10NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.105,"smiles":null,"spectrum_id":"CCMSLIB00017250226","spectrum_index":21996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 128.0968 Da; putative annotation: N/A; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.36,"smiles":null,"spectrum_id":"CCMSLIB00017250229","spectrum_index":21997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 71.0731 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.164,"smiles":null,"spectrum_id":"CCMSLIB00017250231","spectrum_index":21998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 343.3132 Da; putative annotation: N/A; putative formula: C19H42N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.529,"smiles":null,"spectrum_id":"CCMSLIB00017250233","spectrum_index":21999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 63.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.311,"smiles":null,"spectrum_id":"CCMSLIB00017250236","spectrum_index":22000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 114.0328 Da; putative annotation: N/A; putative formula: C6H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.156,"smiles":null,"spectrum_id":"CCMSLIB00017250238","spectrum_index":22001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 211.1218 Da; putative annotation: N/A; putative formula: C12H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.208,"smiles":null,"spectrum_id":"CCMSLIB00017250240","spectrum_index":22002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 8.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.107,"smiles":null,"spectrum_id":"CCMSLIB00017250243","spectrum_index":22003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 140.024 Da; putative annotation: N/A; putative formula: C6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.084,"smiles":null,"spectrum_id":"CCMSLIB00017250246","spectrum_index":22004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 201.0429 Da; putative annotation: N/A; putative formula: C11H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.108,"smiles":null,"spectrum_id":"CCMSLIB00017250249","spectrum_index":22005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cinnamylpiperazine (delta mass: 96.0322 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.186,"smiles":null,"spectrum_id":"CCMSLIB00017250252","spectrum_index":22006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 30.9996 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.169,"smiles":null,"spectrum_id":"CCMSLIB00017250253","spectrum_index":22007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 240.1879 Da; putative annotation: N/A; putative formula: C18H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.311,"smiles":null,"spectrum_id":"CCMSLIB00017250256","spectrum_index":22008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxocativic acid (delta mass: 102.0827 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.325,"smiles":null,"spectrum_id":"CCMSLIB00017250258","spectrum_index":22009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 81.0577 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017250261","spectrum_index":22010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidinol (delta mass: 472.2566 Da; putative annotation: N/A; putative formula: C28H41O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.437,"smiles":null,"spectrum_id":"CCMSLIB00017250263","spectrum_index":22011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 41.0816 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.235,"smiles":null,"spectrum_id":"CCMSLIB00017250265","spectrum_index":22012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Dropropizine (delta mass: 26.0163 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.176,"smiles":null,"spectrum_id":"CCMSLIB00017250267","spectrum_index":22013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 122.2346 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.341,"smiles":null,"spectrum_id":"CCMSLIB00017250270","spectrum_index":22014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 35.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.263,"smiles":null,"spectrum_id":"CCMSLIB00017250272","spectrum_index":22015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of acetaminophen_BTP_M5 (delta mass: 41.0262 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.048,"smiles":null,"spectrum_id":"CCMSLIB00017250274","spectrum_index":22016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 466.454 Da; putative annotation: N/A; putative formula: C34H58)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.597,"smiles":null,"spectrum_id":"CCMSLIB00017250277","spectrum_index":22017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 17.0234 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.071,"smiles":null,"spectrum_id":"CCMSLIB00017250280","spectrum_index":22018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole oxide (delta mass: 142.1127 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.371,"smiles":null,"spectrum_id":"CCMSLIB00017250282","spectrum_index":22019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.beta.-Glycyrrhetic acid methyl ester (delta mass: 47.0075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.37,"smiles":null,"spectrum_id":"CCMSLIB00017250284","spectrum_index":22020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholestenoic acid (delta mass: 27.9937 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.33,"smiles":null,"spectrum_id":"CCMSLIB00017250287","spectrum_index":22021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D3 (delta mass: 96.0935 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.435,"smiles":null,"spectrum_id":"CCMSLIB00017250288","spectrum_index":22022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 37.0243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.173,"smiles":null,"spectrum_id":"CCMSLIB00017250291","spectrum_index":22023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 137.1091 Da; putative annotation: N/A; putative formula: C6H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.185,"smiles":null,"spectrum_id":"CCMSLIB00017250294","spectrum_index":22024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(R)-4-((3R,5R,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-6-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid\"\" (delta mass: 180.0652 Da; putative annotation: N/A; putative formula: C7H8N4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.349,"smiles":null,"spectrum_id":"CCMSLIB00017250295","spectrum_index":22025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sebacic acid monomethyl ester from NIST14 (delta mass: 13.831 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.974,"smiles":null,"spectrum_id":"CCMSLIB00017250298","spectrum_index":22026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 77.0553 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.153,"smiles":null,"spectrum_id":"CCMSLIB00017250301","spectrum_index":22027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Hydroxy-7-oxo-5.beta.-cholanic acid (delta mass: 19.0132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.297,"smiles":null,"spectrum_id":"CCMSLIB00017250304","spectrum_index":22028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 158.0757 Da; putative annotation: N/A; putative formula: C11H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.146,"smiles":null,"spectrum_id":"CCMSLIB00017250305","spectrum_index":22029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 79.9393 Da; putative annotation: N/A; putative formula: OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.01,"smiles":null,"spectrum_id":"CCMSLIB00017250308","spectrum_index":22030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylic acid (delta mass: 254.0948 Da; putative annotation: N/A; putative formula: C8H20N2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.134,"smiles":null,"spectrum_id":"CCMSLIB00017250310","spectrum_index":22031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 48.037 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.092,"smiles":null,"spectrum_id":"CCMSLIB00017250312","spectrum_index":22032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 46.1213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.165,"smiles":null,"spectrum_id":"CCMSLIB00017250315","spectrum_index":22033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Putative (3-hydroxyhexadecanoyl)glycine (aka Commendamide) (delta mass: 236.2211 Da; putative annotation: N/A; putative formula: C15H28N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.485,"smiles":null,"spectrum_id":"CCMSLIB00017250318","spectrum_index":22034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 224.0855 Da; putative annotation: N/A; putative formula: C6H17N4OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.234,"smiles":null,"spectrum_id":"CCMSLIB00017250319","spectrum_index":22035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 591.5596 Da; putative annotation: N/A; putative formula: C38H73NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.786,"smiles":null,"spectrum_id":"CCMSLIB00017250322","spectrum_index":22036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 488.2131 Da; putative annotation: N/A; putative formula: C21H28N8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.254,"smiles":null,"spectrum_id":"CCMSLIB00017250323","spectrum_index":22037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,2-Dihydroxy-2-phenylethyl)-3-hydroxy-2,3-dihydropyran-6-one (delta mass: 23.9995 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017250326","spectrum_index":22038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 284.271 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.409,"smiles":null,"spectrum_id":"CCMSLIB00017250328","spectrum_index":22039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 9.9842 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.216,"smiles":null,"spectrum_id":"CCMSLIB00017250330","spectrum_index":22040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 385.1748 Da; putative annotation: N/A; putative formula: C19H31NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.454,"smiles":null,"spectrum_id":"CCMSLIB00017250333","spectrum_index":22041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 97.9999 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.091,"smiles":null,"spectrum_id":"CCMSLIB00017250335","spectrum_index":22042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 87.0523 Da; putative annotation: N/A; putative formula: C4H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.144,"smiles":null,"spectrum_id":"CCMSLIB00017250337","spectrum_index":22043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 76.0313 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.269,"smiles":null,"spectrum_id":"CCMSLIB00017250340","spectrum_index":22044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Allyl 3-amino-1-piperidinecarboxylate (delta mass: 9.8715 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017250341","spectrum_index":22045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 625.2021 Da; putative annotation: N/A; putative formula: C29H31N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.262,"smiles":null,"spectrum_id":"CCMSLIB00017250344","spectrum_index":22046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-cis-Retinol (delta mass: 181.1531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.39,"smiles":null,"spectrum_id":"CCMSLIB00017250346","spectrum_index":22047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Calcitriol (delta mass: 48.0346 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.371,"smiles":null,"spectrum_id":"CCMSLIB00017250348","spectrum_index":22048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 17.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.263,"smiles":null,"spectrum_id":"CCMSLIB00017250351","spectrum_index":22049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethylene glycol 2-ethylhexyl ether (delta mass: 96.9828 Da; putative annotation: N/A; putative formula: C2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.178,"smiles":null,"spectrum_id":"CCMSLIB00017250353","spectrum_index":22050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380116-01!2-hexyl-3-hydroxypentanedioic acid (delta mass: 231.1497 Da; putative annotation: N/A; putative formula: C10H22N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.288,"smiles":null,"spectrum_id":"CCMSLIB00017250355","spectrum_index":22051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381159-01!2-[[3,21-dihydroxy-20-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydocosan-2-yl]amino]acetic acid (delta mass: 593.4035 Da; putative annotation: N/A; putative formula: C34H60NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1187.82,"smiles":null,"spectrum_id":"CCMSLIB00017250358","spectrum_index":22052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 202.1699 Da; putative annotation: N/A; putative formula: C9H23N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.229,"smiles":null,"spectrum_id":"CCMSLIB00017250360","spectrum_index":22053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 233.142 Da; putative annotation: N/A; putative formula: C14H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.192,"smiles":null,"spectrum_id":"CCMSLIB00017250362","spectrum_index":22054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 115.0639 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.233,"smiles":null,"spectrum_id":"CCMSLIB00017250365","spectrum_index":22055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)benzoic acid (delta mass: 98.0733 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017250367","spectrum_index":22056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01043 Hexahydrocurcumin (delta mass: 112.0308 Da; putative annotation: N/A; putative formula: C9H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.211,"smiles":null,"spectrum_id":"CCMSLIB00017250369","spectrum_index":22057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 215.2257 Da; putative annotation: N/A; putative formula: C9H25N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.479,"smiles":null,"spectrum_id":"CCMSLIB00017250372","spectrum_index":22058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 79.9669 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.236,"smiles":null,"spectrum_id":"CCMSLIB00017250374","spectrum_index":22059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-naphthol (delta mass: 17.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.101,"smiles":null,"spectrum_id":"CCMSLIB00017250376","spectrum_index":22060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .omega.-3 Arachidonic acid (delta mass: 68.0629 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017250379","spectrum_index":22061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 160.1818 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.362,"smiles":null,"spectrum_id":"CCMSLIB00017250381","spectrum_index":22062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 391.2002 Da; putative annotation: N/A; putative formula: C22H33NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.271,"smiles":null,"spectrum_id":"CCMSLIB00017250384","spectrum_index":22063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 952.6681 Da; putative annotation: N/A; putative formula: C47H88N10O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1133.74,"smiles":null,"spectrum_id":"CCMSLIB00017250386","spectrum_index":22064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methoxmetamine (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.16,"smiles":null,"spectrum_id":"CCMSLIB00017250388","spectrum_index":22065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Picrinine (delta mass: 230.2245 Da; putative annotation: N/A; putative formula: C10H26N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.395,"smiles":null,"spectrum_id":"CCMSLIB00017250391","spectrum_index":22066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 375.1163 Da; putative annotation: N/A; putative formula: C13H17N11O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.176,"smiles":null,"spectrum_id":"CCMSLIB00017250393","spectrum_index":22067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(5-fluoropentyl)- (delta mass: 150.1795 Da; putative annotation: N/A; putative formula: C12H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.303,"smiles":null,"spectrum_id":"CCMSLIB00017250395","spectrum_index":22068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Ethyl-17-ethynyl-17-hydroxy-6,7,8,9,10,11,12,13,14,17-decahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (delta mass: 110.0575 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.258,"smiles":null,"spectrum_id":"CCMSLIB00017250398","spectrum_index":22069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 262.1437 Da; putative annotation: N/A; putative formula: C13H18N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.349,"smiles":null,"spectrum_id":"CCMSLIB00017250400","spectrum_index":22070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 90.0852 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.338,"smiles":null,"spectrum_id":"CCMSLIB00017250402","spectrum_index":22071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 300.2653 Da; putative annotation: N/A; putative formula: C18H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.352,"smiles":null,"spectrum_id":"CCMSLIB00017250405","spectrum_index":22072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 261.1361 Da; putative annotation: N/A; putative formula: C15H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.217,"smiles":null,"spectrum_id":"CCMSLIB00017250406","spectrum_index":22073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 231.0099 Da; putative annotation: N/A; putative formula: C10H5N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.07,"smiles":null,"spectrum_id":"CCMSLIB00017250409","spectrum_index":22074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 158.0693 Da; putative annotation: N/A; putative formula: C6H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.182,"smiles":null,"spectrum_id":"CCMSLIB00017250412","spectrum_index":22075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclopropyl-3-pyridinemethanol (delta mass: 6.9915 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.083,"smiles":null,"spectrum_id":"CCMSLIB00017250413","spectrum_index":22076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3S)-1-Azabicyclo[2.2.2]octan-3-amine (delta mass: 55.9907 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.114,"smiles":null,"spectrum_id":"CCMSLIB00017250416","spectrum_index":22077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 491.3481 Da; putative annotation: N/A; putative formula: C27H41N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.419,"smiles":null,"spectrum_id":"CCMSLIB00017250418","spectrum_index":22078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Myristoleic acid from NIST14 (delta mass: 75.0394 Da; putative annotation: N/A; putative formula: CH5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.24,"smiles":null,"spectrum_id":"CCMSLIB00017250420","spectrum_index":22079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.107,"smiles":null,"spectrum_id":"CCMSLIB00017250423","spectrum_index":22080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 160.1099 Da; putative annotation: N/A; putative formula: C8H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.368,"smiles":null,"spectrum_id":"CCMSLIB00017250424","spectrum_index":22081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 86.0162 Da; putative annotation: N/A; putative formula: C7H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.14,"smiles":null,"spectrum_id":"CCMSLIB00017250427","spectrum_index":22082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 108.0423 Da; putative annotation: N/A; putative formula: C4H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017250430","spectrum_index":22083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 171.9413 Da; putative annotation: N/A; putative formula: C2H5O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.976,"smiles":null,"spectrum_id":"CCMSLIB00017250431","spectrum_index":22084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentedrone (delta mass: 40.9591 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.097,"smiles":null,"spectrum_id":"CCMSLIB00017250434","spectrum_index":22085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 117.9875 Da; putative annotation: N/A; putative formula: C7H2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.068,"smiles":null,"spectrum_id":"CCMSLIB00017250435","spectrum_index":22086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bacchabolivic acid (delta mass: 120.0935 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.305,"smiles":null,"spectrum_id":"CCMSLIB00017250438","spectrum_index":22087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 222.0737 Da; putative annotation: N/A; putative formula: C8H14O7)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.144,"smiles":null,"spectrum_id":"CCMSLIB00017250441","spectrum_index":22088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 255.1419 Da; putative annotation: N/A; putative formula: C12H23N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.656,"smiles":null,"spectrum_id":"CCMSLIB00017250442","spectrum_index":22089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 220.1813 Da; putative annotation: N/A; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.222,"smiles":null,"spectrum_id":"CCMSLIB00017250445","spectrum_index":22090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 647.4392 Da; putative annotation: N/A; putative formula: C37H61NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.51,"smiles":null,"spectrum_id":"CCMSLIB00017250447","spectrum_index":22091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 507.2505 Da; putative annotation: N/A; putative formula: C23H41NO9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.321,"smiles":null,"spectrum_id":"CCMSLIB00017250449","spectrum_index":22092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 508.1385 Da; putative annotation: N/A; putative formula: C21H28N6O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1337.42,"smiles":null,"spectrum_id":"CCMSLIB00017250452","spectrum_index":22093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 1060.4069 Da; putative annotation: N/A; putative formula: C84H52)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1444.56,"smiles":null,"spectrum_id":"CCMSLIB00017250453","spectrum_index":22094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avermitilol (delta mass: 255.2545 Da; putative annotation: N/A; putative formula: C12H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.46,"smiles":null,"spectrum_id":"CCMSLIB00017250456","spectrum_index":22095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylpiperazine (delta mass: 43.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.154,"smiles":null,"spectrum_id":"CCMSLIB00017250459","spectrum_index":22096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 491.1437 Da; putative annotation: N/A; putative formula: C24H29NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.204,"smiles":null,"spectrum_id":"CCMSLIB00017250460","spectrum_index":22097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norgestrel (delta mass: 106.0779 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.294,"smiles":null,"spectrum_id":"CCMSLIB00017250463","spectrum_index":22098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Formoterol (delta mass: 72.0096 Da; putative annotation: N/A; putative formula: C5N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.19,"smiles":null,"spectrum_id":"CCMSLIB00017250464","spectrum_index":22099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 359.1425 Da; putative annotation: N/A; putative formula: C25H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.359,"smiles":null,"spectrum_id":"CCMSLIB00017250467","spectrum_index":22100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.185,"smiles":null,"spectrum_id":"CCMSLIB00017250468","spectrum_index":22101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 41.0267 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.118,"smiles":null,"spectrum_id":"CCMSLIB00017250471","spectrum_index":22102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 535.1827 Da; putative annotation: N/A; putative formula: C26H21N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":742.253,"smiles":null,"spectrum_id":"CCMSLIB00017250472","spectrum_index":22103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 519.1921 Da; putative annotation: N/A; putative formula: C31H21N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.252,"smiles":null,"spectrum_id":"CCMSLIB00017250475","spectrum_index":22104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 82.0309 Da; putative annotation: N/A; putative formula: C5H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.149,"smiles":null,"spectrum_id":"CCMSLIB00017250476","spectrum_index":22105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy-4(15),11(13)-eudesmadien-12,6-olide (delta mass: 74.0005 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.149,"smiles":null,"spectrum_id":"CCMSLIB00017250479","spectrum_index":22106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 282.1824 Da; putative annotation: N/A; putative formula: C16H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.242,"smiles":null,"spectrum_id":"CCMSLIB00017250481","spectrum_index":22107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-1-piperazinyl)acetic acid (delta mass: 47.0172 Da; putative annotation: N/A; putative formula: C4HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.13,"smiles":null,"spectrum_id":"CCMSLIB00017250483","spectrum_index":22108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 78.0321 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.087,"smiles":null,"spectrum_id":"CCMSLIB00017250486","spectrum_index":22109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrosappanone A Trimethyl Ether (delta mass: 371.1429 Da; putative annotation: N/A; putative formula: C13H25NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.297,"smiles":null,"spectrum_id":"CCMSLIB00017250487","spectrum_index":22110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 143.1423 Da; putative annotation: N/A; putative formula: C7H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.192,"smiles":null,"spectrum_id":"CCMSLIB00017250490","spectrum_index":22111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 236.2145 Da; putative annotation: N/A; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.494,"smiles":null,"spectrum_id":"CCMSLIB00017250491","spectrum_index":22112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 306.2076 Da; putative annotation: N/A; putative formula: C14H31N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.382,"smiles":null,"spectrum_id":"CCMSLIB00017250494","spectrum_index":22113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)cyclohexanol (delta mass: 118.0285 Da; putative annotation: N/A; putative formula: C5H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.209,"smiles":null,"spectrum_id":"CCMSLIB00017250497","spectrum_index":22114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinine di-N-oxide (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.192,"smiles":null,"spectrum_id":"CCMSLIB00017250499","spectrum_index":22115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxybenzene-1,3-dicarboxylic acid (delta mass: 6.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.039,"smiles":null,"spectrum_id":"CCMSLIB00017250501","spectrum_index":22116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxy-2-decenoic acid (delta mass: 31.0426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.176,"smiles":null,"spectrum_id":"CCMSLIB00017250503","spectrum_index":22117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 109.9607 Da; putative annotation: N/A; putative formula: H2N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.177,"smiles":null,"spectrum_id":"CCMSLIB00017250505","spectrum_index":22118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,6-Tetrahydrobenzylalcohol (delta mass: 14.0163 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.112,"smiles":null,"spectrum_id":"CCMSLIB00017250508","spectrum_index":22119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 144.2135 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.3,"smiles":null,"spectrum_id":"CCMSLIB00017250510","spectrum_index":22120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.196,"smiles":null,"spectrum_id":"CCMSLIB00017250512","spectrum_index":22121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 32.0022 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.114,"smiles":null,"spectrum_id":"CCMSLIB00017250515","spectrum_index":22122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2R,9R,10S,12S)-12-hydroxy-7,15-diazatetracyclo[7.7.1.0^{2,7}.0^{10,15}]heptadecan-6-one (delta mass: 227.1268 Da; putative annotation: N/A; putative formula: C10H17N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.318,"smiles":null,"spectrum_id":"CCMSLIB00017250518","spectrum_index":22123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 429.2513 Da; putative annotation: N/A; putative formula: C25H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.406,"smiles":null,"spectrum_id":"CCMSLIB00017250519","spectrum_index":22124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 120.0786 Da; putative annotation: N/A; putative formula: C6H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017250522","spectrum_index":22125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 252.2458 Da; putative annotation: N/A; putative formula: C17H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.405,"smiles":null,"spectrum_id":"CCMSLIB00017250525","spectrum_index":22126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 113.0475 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.249,"smiles":null,"spectrum_id":"CCMSLIB00017250527","spectrum_index":22127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 262.0831 Da; putative annotation: N/A; putative formula: C8H15N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.143,"smiles":null,"spectrum_id":"CCMSLIB00017250529","spectrum_index":22128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.176,"smiles":null,"spectrum_id":"CCMSLIB00017250532","spectrum_index":22129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxybenzoic acid (delta mass: 58.0786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017250534","spectrum_index":22130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 71.9849 Da; putative annotation: N/A; putative formula: C2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.045,"smiles":null,"spectrum_id":"CCMSLIB00017250536","spectrum_index":22131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 17.0256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.063,"smiles":null,"spectrum_id":"CCMSLIB00017250539","spectrum_index":22132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 41.0127 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.083,"smiles":null,"spectrum_id":"CCMSLIB00017250540","spectrum_index":22133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 575.4526 Da; putative annotation: N/A; putative formula: C39H61NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.705,"smiles":null,"spectrum_id":"CCMSLIB00017250543","spectrum_index":22134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 138.0765 Da; putative annotation: N/A; putative formula: C3H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.152,"smiles":null,"spectrum_id":"CCMSLIB00017250546","spectrum_index":22135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 44.0497 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.116,"smiles":null,"spectrum_id":"CCMSLIB00017250547","spectrum_index":22136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 66.0254 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.211,"smiles":null,"spectrum_id":"CCMSLIB00017250550","spectrum_index":22137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Ketodeoxycholic acid (delta mass: 178.114 Da; putative annotation: N/A; putative formula: C15H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.398,"smiles":null,"spectrum_id":"CCMSLIB00017250553","spectrum_index":22138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 340.1916 Da; putative annotation: N/A; putative formula: C17H29N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.309,"smiles":null,"spectrum_id":"CCMSLIB00017250554","spectrum_index":22139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 27.9519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.08,"smiles":null,"spectrum_id":"CCMSLIB00017250557","spectrum_index":22140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 82.0417 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.248,"smiles":null,"spectrum_id":"CCMSLIB00017250560","spectrum_index":22141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylimbricatolic acid (delta mass: 86.0522 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.321,"smiles":null,"spectrum_id":"CCMSLIB00017250561","spectrum_index":22142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 264.0854 Da; putative annotation: N/A; putative formula: C11H20O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.15,"smiles":null,"spectrum_id":"CCMSLIB00017250564","spectrum_index":22143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 148.0848 Da; putative annotation: N/A; putative formula: C5H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.421,"smiles":null,"spectrum_id":"CCMSLIB00017250567","spectrum_index":22144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17.alpha.-Methyltestosterone (delta mass: 74.0353 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.267,"smiles":null,"spectrum_id":"CCMSLIB00017250568","spectrum_index":22145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 83.062 Da; putative annotation: N/A; putative formula: C2H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.169,"smiles":null,"spectrum_id":"CCMSLIB00017250571","spectrum_index":22146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid (delta mass: 118.0796 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.317,"smiles":null,"spectrum_id":"CCMSLIB00017250574","spectrum_index":22147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 386.0605 Da; putative annotation: N/A; putative formula: C15H18N2O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.121,"smiles":null,"spectrum_id":"CCMSLIB00017250575","spectrum_index":22148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 50.0517 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.32,"smiles":null,"spectrum_id":"CCMSLIB00017250578","spectrum_index":22149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 735.5497 Da; putative annotation: N/A; putative formula: C39H77NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.61,"smiles":null,"spectrum_id":"CCMSLIB00017250581","spectrum_index":22150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 36.0356 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.22,"smiles":null,"spectrum_id":"CCMSLIB00017250583","spectrum_index":22151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 100.0635 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.243,"smiles":null,"spectrum_id":"CCMSLIB00017250585","spectrum_index":22152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid (delta mass: 260.2047 Da; putative annotation: N/A; putative formula: C18H29O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.447,"smiles":null,"spectrum_id":"CCMSLIB00017250588","spectrum_index":22153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 111.0294 Da; putative annotation: N/A; putative formula: CHN7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.1,"smiles":null,"spectrum_id":"CCMSLIB00017250589","spectrum_index":22154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxydodecanoic acid (delta mass: 48.0374 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.217,"smiles":null,"spectrum_id":"CCMSLIB00017250592","spectrum_index":22155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 159.0906 Da; putative annotation: N/A; putative formula: C8H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.156,"smiles":null,"spectrum_id":"CCMSLIB00017250595","spectrum_index":22156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitoleoyl ethanolamide (delta mass: 41.0161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.29,"smiles":null,"spectrum_id":"CCMSLIB00017250596","spectrum_index":22157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385919-01_C20H34O_2-Penten-1-ol, 5-[(1S,4aS,8aS)-decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]-3-methyl-, (2E)- (delta mass: 176.1571 Da; putative annotation: N/A; putative formula: C13H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.425,"smiles":null,"spectrum_id":"CCMSLIB00017250599","spectrum_index":22158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-4-piperidinylamine (delta mass: 367.106 Da; putative annotation: N/A; putative formula: C13H25N3O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.245,"smiles":null,"spectrum_id":"CCMSLIB00017250602","spectrum_index":22159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 247.2606 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.363,"smiles":null,"spectrum_id":"CCMSLIB00017250605","spectrum_index":22160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dihydroxy-8(17),13-labdadien-18-oic acid (delta mass: 92.0626 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.3,"smiles":null,"spectrum_id":"CCMSLIB00017250606","spectrum_index":22161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYBENZOIC ACID (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.065,"smiles":null,"spectrum_id":"CCMSLIB00017250609","spectrum_index":22162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-piperidinecarboxylate (delta mass: 97.053 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.171,"smiles":null,"spectrum_id":"CCMSLIB00017250612","spectrum_index":22163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic JBIR 27 (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017250615","spectrum_index":22164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 148.0779 Da; putative annotation: N/A; putative formula: C4H12N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.201,"smiles":null,"spectrum_id":"CCMSLIB00017250616","spectrum_index":22165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 70.0415 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.258,"smiles":null,"spectrum_id":"CCMSLIB00017250619","spectrum_index":22166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 116.0509 Da; putative annotation: N/A; putative formula: C4H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.138,"smiles":null,"spectrum_id":"CCMSLIB00017250622","spectrum_index":22167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Hydroperoxy-10E,12Z,15Z-octadecatrienoic acid (delta mass: 92.0837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.305,"smiles":null,"spectrum_id":"CCMSLIB00017250624","spectrum_index":22168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 50.0157 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.076,"smiles":null,"spectrum_id":"CCMSLIB00017250626","spectrum_index":22169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 93.0578 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.144,"smiles":null,"spectrum_id":"CCMSLIB00017250629","spectrum_index":22170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 242.0101 Da; putative annotation: N/A; putative formula: C9H11N2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.138,"smiles":null,"spectrum_id":"CCMSLIB00017250631","spectrum_index":22171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 87.0321 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.097,"smiles":null,"spectrum_id":"CCMSLIB00017250633","spectrum_index":22172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 130.0417 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.201,"smiles":null,"spectrum_id":"CCMSLIB00017250636","spectrum_index":22173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 46.0059 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017250637","spectrum_index":22174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Hydroxyperhexiline (delta mass: 63.979 Da; putative annotation: N/A; putative formula: O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.258,"smiles":null,"spectrum_id":"CCMSLIB00017250640","spectrum_index":22175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 80.0263 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.274,"smiles":null,"spectrum_id":"CCMSLIB00017250641","spectrum_index":22176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 114.0102 Da; putative annotation: N/A; putative formula: C8H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.174,"smiles":null,"spectrum_id":"CCMSLIB00017250644","spectrum_index":22177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 86.0522 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.284,"smiles":null,"spectrum_id":"CCMSLIB00017250648","spectrum_index":22178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin A3 (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.221,"smiles":null,"spectrum_id":"CCMSLIB00017250650","spectrum_index":22179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nandrolone (delta mass: 74.0394 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.24,"smiles":null,"spectrum_id":"CCMSLIB00017250653","spectrum_index":22180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.186,"smiles":null,"spectrum_id":"CCMSLIB00017250656","spectrum_index":22181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 35.0736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017250658","spectrum_index":22182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 169.0738 Da; putative annotation: N/A; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.181,"smiles":null,"spectrum_id":"CCMSLIB00017250660","spectrum_index":22183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 11.5046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.58,"smiles":null,"spectrum_id":"CCMSLIB00017250663","spectrum_index":22184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 129.0579 Da; putative annotation: N/A; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.102,"smiles":null,"spectrum_id":"CCMSLIB00017250664","spectrum_index":22185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aristolactam (delta mass: 16.0315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.108,"smiles":null,"spectrum_id":"CCMSLIB00017250667","spectrum_index":22186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 619.3093 Da; putative annotation: N/A; putative formula: C36H41N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":977.511,"smiles":null,"spectrum_id":"CCMSLIB00017250670","spectrum_index":22187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 45.0501 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.199,"smiles":null,"spectrum_id":"CCMSLIB00017250673","spectrum_index":22188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 116.9923 Da; putative annotation: N/A; putative formula: H-1N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.057,"smiles":null,"spectrum_id":"CCMSLIB00017250674","spectrum_index":22189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 47.0092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.09,"smiles":null,"spectrum_id":"CCMSLIB00017250677","spectrum_index":22190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homogentisic acid (delta mass: 88.031 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.081,"smiles":null,"spectrum_id":"CCMSLIB00017250680","spectrum_index":22191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Valerenic acid (delta mass: 138.068 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.237,"smiles":null,"spectrum_id":"CCMSLIB00017250682","spectrum_index":22192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.227,"smiles":null,"spectrum_id":"CCMSLIB00017250684","spectrum_index":22193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dimethoxyphenol (delta mass: 138.0319 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.102,"smiles":null,"spectrum_id":"CCMSLIB00017250687","spectrum_index":22194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 114.084 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.311,"smiles":null,"spectrum_id":"CCMSLIB00017250690","spectrum_index":22195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 105.04 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.1,"smiles":null,"spectrum_id":"CCMSLIB00017250691","spectrum_index":22196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 301.1199 Da; putative annotation: N/A; putative formula: C12H20N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.18,"smiles":null,"spectrum_id":"CCMSLIB00017250694","spectrum_index":22197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 28.024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017250697","spectrum_index":22198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palitantin (delta mass: 118.0417 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.201,"smiles":null,"spectrum_id":"CCMSLIB00017250700","spectrum_index":22199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Acetyloxy)-3-methylbenzoic acid (delta mass: 55.0206 Da; putative annotation: N/A; putative formula: CHN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.086,"smiles":null,"spectrum_id":"CCMSLIB00017250703","spectrum_index":22200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 104.0445 Da; putative annotation: N/A; putative formula: H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.157,"smiles":null,"spectrum_id":"CCMSLIB00017250705","spectrum_index":22201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 87.057 Da; putative annotation: N/A; putative formula: CH5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017250708","spectrum_index":22202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 261.1001 Da; putative annotation: N/A; putative formula: C14H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.197,"smiles":null,"spectrum_id":"CCMSLIB00017250711","spectrum_index":22203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 35.9769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.188,"smiles":null,"spectrum_id":"CCMSLIB00017250713","spectrum_index":22204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 318.2407 Da; putative annotation: N/A; putative formula: C17H34O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.307,"smiles":null,"spectrum_id":"CCMSLIB00017250716","spectrum_index":22205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ketocholanic Acid (delta mass: 135.0895 Da; putative annotation: N/A; putative formula: C6H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.379,"smiles":null,"spectrum_id":"CCMSLIB00017250719","spectrum_index":22206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 817.1763 Da; putative annotation: N/A; putative formula: C42H31N3O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1484.41,"smiles":null,"spectrum_id":"CCMSLIB00017250720","spectrum_index":22207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthro[3,2-b]furan-9(1H)-one, 2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro-6,10a-dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl- (delta mass: 132.0938 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.31,"smiles":null,"spectrum_id":"CCMSLIB00017250723","spectrum_index":22208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of flavanthrin (delta mass: 2.3198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.5,"smiles":null,"spectrum_id":"CCMSLIB00017250724","spectrum_index":22209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 18.0062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.16,"smiles":null,"spectrum_id":"CCMSLIB00017250728","spectrum_index":22210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 211.0796 Da; putative annotation: N/A; putative formula: C9H15N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.181,"smiles":null,"spectrum_id":"CCMSLIB00017250730","spectrum_index":22211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 180.0534 Da; putative annotation: N/A; putative formula: C8H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.14,"smiles":null,"spectrum_id":"CCMSLIB00017250733","spectrum_index":22212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 132.0786 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.118,"smiles":null,"spectrum_id":"CCMSLIB00017250734","spectrum_index":22213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Adamantyl)pyrrolidine (delta mass: 60.029 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.219,"smiles":null,"spectrum_id":"CCMSLIB00017250737","spectrum_index":22214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 575.3806 Da; putative annotation: N/A; putative formula: C30H45N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.451,"smiles":null,"spectrum_id":"CCMSLIB00017250739","spectrum_index":22215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE (delta mass: 80.063 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.269,"smiles":null,"spectrum_id":"CCMSLIB00017250741","spectrum_index":22216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.alpha.,17.alpha.-Dimethyl-5.beta.-androstane-3.alpha.,17.beta.-diol (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.331,"smiles":null,"spectrum_id":"CCMSLIB00017250744","spectrum_index":22217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-5-phenyl-3-furonitrile (delta mass: 60.0203 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.091,"smiles":null,"spectrum_id":"CCMSLIB00017250746","spectrum_index":22218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Icaridin (delta mass: 392.2257 Da; putative annotation: N/A; putative formula: C20H42O-1P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.401,"smiles":null,"spectrum_id":"CCMSLIB00017250749","spectrum_index":22219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isotretinoin CollisionEnergy:102040 (delta mass: 389.2771 Da; putative annotation: N/A; putative formula: C24H41NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.493,"smiles":null,"spectrum_id":"CCMSLIB00017250750","spectrum_index":22220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isotretinoin CollisionEnergy:102040 (delta mass: 419.2877 Da; putative annotation: N/A; putative formula: C21H41NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":720.504,"smiles":null,"spectrum_id":"CCMSLIB00017250753","spectrum_index":22221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 146.1307 Da; putative annotation: N/A; putative formula: C4H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.227,"smiles":null,"spectrum_id":"CCMSLIB00017250755","spectrum_index":22222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-hydroxybut-3-en-2-yl)-3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran-4,5-diol (delta mass: 162.147 Da; putative annotation: N/A; putative formula: C2H14N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.4,"smiles":null,"spectrum_id":"CCMSLIB00017250757","spectrum_index":22223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 129.0788 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.15,"smiles":null,"spectrum_id":"CCMSLIB00017250760","spectrum_index":22224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Di(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine (delta mass: 110.0282 Da; putative annotation: N/A; putative formula: C6H7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.551,"smiles":null,"spectrum_id":"CCMSLIB00017250762","spectrum_index":22225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 22.0208 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017250765","spectrum_index":22226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 326.2439 Da; putative annotation: N/A; putative formula: C19H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.497,"smiles":null,"spectrum_id":"CCMSLIB00017250767","spectrum_index":22227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 32.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.118,"smiles":null,"spectrum_id":"CCMSLIB00017250770","spectrum_index":22228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 173.0783 Da; putative annotation: N/A; putative formula: C8H16NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.119,"smiles":null,"spectrum_id":"CCMSLIB00017250773","spectrum_index":22229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 51.0473 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.118,"smiles":null,"spectrum_id":"CCMSLIB00017250775","spectrum_index":22230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 124.1256 Da; putative annotation: N/A; putative formula: C9H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.17,"smiles":null,"spectrum_id":"CCMSLIB00017250777","spectrum_index":22231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoerucin (delta mass: 66.0463 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.409,"smiles":null,"spectrum_id":"CCMSLIB00017250780","spectrum_index":22232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palmitic acid alkyne (delta mass: 249.2303 Da; putative annotation: N/A; putative formula: C14H27N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.447,"smiles":null,"spectrum_id":"CCMSLIB00017250781","spectrum_index":22233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 441.3097 Da; putative annotation: N/A; putative formula: C25H47NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.38,"smiles":null,"spectrum_id":"CCMSLIB00017250784","spectrum_index":22234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169964-06!4-[2-(3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl]piperidine-2,6-dione [IIN-based: Match] (delta mass: 98.0372 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.207,"smiles":null,"spectrum_id":"CCMSLIB00017250786","spectrum_index":22235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 67.0422 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.128,"smiles":null,"spectrum_id":"CCMSLIB00017250788","spectrum_index":22236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 66.0464 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.242,"smiles":null,"spectrum_id":"CCMSLIB00017250791","spectrum_index":22237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 304.234 Da; putative annotation: N/A; putative formula: C19H32N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.51,"smiles":null,"spectrum_id":"CCMSLIB00017250794","spectrum_index":22238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linezolid (Zyvox) (delta mass: 18.0709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.222,"smiles":null,"spectrum_id":"CCMSLIB00017250795","spectrum_index":22239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 68.0628 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.274,"smiles":null,"spectrum_id":"CCMSLIB00017250798","spectrum_index":22240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-indole-3-carbaldehyde (delta mass: 26.9996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.075,"smiles":null,"spectrum_id":"CCMSLIB00017250799","spectrum_index":22241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 17.9901 Da; putative annotation: N/A; putative formula: C3H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.061,"smiles":null,"spectrum_id":"CCMSLIB00017250802","spectrum_index":22242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 214.8867 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017250805","spectrum_index":22243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tibolone (delta mass: 435.7536 Da; putative annotation: N/A; putative formula: C6H8O-1P12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.97,"smiles":null,"spectrum_id":"CCMSLIB00017250806","spectrum_index":22244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 695.9773 Da; putative annotation: N/A; putative formula: C30H32O-1S10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":918.075,"smiles":null,"spectrum_id":"CCMSLIB00017250809","spectrum_index":22245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 211.0851 Da; putative annotation: N/A; putative formula: C11H17NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.151,"smiles":null,"spectrum_id":"CCMSLIB00017250812","spectrum_index":22246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 194.057 Da; putative annotation: N/A; putative formula: C4H11N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.169,"smiles":null,"spectrum_id":"CCMSLIB00017250813","spectrum_index":22247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thiodiglycol (delta mass: 146.034 Da; putative annotation: N/A; putative formula: C5H2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.081,"smiles":null,"spectrum_id":"CCMSLIB00017250816","spectrum_index":22248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Hydroxytestosterone (delta mass: 144.096 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.307,"smiles":null,"spectrum_id":"CCMSLIB00017250819","spectrum_index":22249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linolenic acid (delta mass: 49.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.284,"smiles":null,"spectrum_id":"CCMSLIB00017250820","spectrum_index":22250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 87.0507 Da; putative annotation: N/A; putative formula: C4H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.174,"smiles":null,"spectrum_id":"CCMSLIB00017250823","spectrum_index":22251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Palmitelaidic acid from NIST14 (delta mass: 300.0513 Da; putative annotation: N/A; putative formula: C9H16O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.283,"smiles":null,"spectrum_id":"CCMSLIB00017250825","spectrum_index":22252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 354.1734 Da; putative annotation: N/A; putative formula: C24H22N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.27,"smiles":null,"spectrum_id":"CCMSLIB00017250827","spectrum_index":22253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 207.1012 Da; putative annotation: N/A; putative formula: C10H13N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.187,"smiles":null,"spectrum_id":"CCMSLIB00017250830","spectrum_index":22254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Polyporusterone A (delta mass: 120.093 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.43,"smiles":null,"spectrum_id":"CCMSLIB00017250831","spectrum_index":22255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 258.11 Da; putative annotation: N/A; putative formula: C12H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.185,"smiles":null,"spectrum_id":"CCMSLIB00017250834","spectrum_index":22256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 161.1421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.369,"smiles":null,"spectrum_id":"CCMSLIB00017250837","spectrum_index":22257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1,2,3,4-tetrahydroquinoline (delta mass: 89.012 Da; putative annotation: N/A; putative formula: C3H-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.124,"smiles":null,"spectrum_id":"CCMSLIB00017250838","spectrum_index":22258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 113.0629 Da; putative annotation: N/A; putative formula: C9H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.16,"smiles":null,"spectrum_id":"CCMSLIB00017250841","spectrum_index":22259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine, 6-sulfate (delta mass: 172.0137 Da; putative annotation: N/A; putative formula: C6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.057,"smiles":null,"spectrum_id":"CCMSLIB00017250844","spectrum_index":22260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Abietic acid (delta mass: 74.0572 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.289,"smiles":null,"spectrum_id":"CCMSLIB00017250846","spectrum_index":22261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 227.1522 Da; putative annotation: N/A; putative formula: C12H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.212,"smiles":null,"spectrum_id":"CCMSLIB00017250848","spectrum_index":22262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Choldienic acid putative (delta mass: 291.2771 Da; putative annotation: N/A; putative formula: C17H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.551,"smiles":null,"spectrum_id":"CCMSLIB00017250851","spectrum_index":22263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Decanoyl-2-hydroxy-sn-glycero-3-phosphocholine (delta mass: 70.0741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.32,"smiles":null,"spectrum_id":"CCMSLIB00017250853","spectrum_index":22264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dodecanoic acid (delta mass: 52.0664 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.251,"smiles":null,"spectrum_id":"CCMSLIB00017250855","spectrum_index":22265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of E-9-5-1 (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.055,"smiles":null,"spectrum_id":"CCMSLIB00017250858","spectrum_index":22266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 17.0001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.112,"smiles":null,"spectrum_id":"CCMSLIB00017250860","spectrum_index":22267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYBENZOATE (delta mass: 69.058 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.097,"smiles":null,"spectrum_id":"CCMSLIB00017250862","spectrum_index":22268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-amino-4-methylbenzoate (delta mass: 61.0174 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.104,"smiles":null,"spectrum_id":"CCMSLIB00017250865","spectrum_index":22269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-amino-4-methylbenzoate (delta mass: 49.0171 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.103,"smiles":null,"spectrum_id":"CCMSLIB00017250867","spectrum_index":22270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 317.3147 Da; putative annotation: N/A; putative formula: C21H39N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.379,"smiles":null,"spectrum_id":"CCMSLIB00017250870","spectrum_index":22271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 141.0535 Da; putative annotation: N/A; putative formula: C5H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.15,"smiles":null,"spectrum_id":"CCMSLIB00017250871","spectrum_index":22272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 102.0834 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.31,"smiles":null,"spectrum_id":"CCMSLIB00017250874","spectrum_index":22273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aS,5R,6R)-6-Hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 74.0522 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017250877","spectrum_index":22274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 129.1756 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.278,"smiles":null,"spectrum_id":"CCMSLIB00017250878","spectrum_index":22275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kelampayoside A (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.202,"smiles":null,"spectrum_id":"CCMSLIB00017250881","spectrum_index":22276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 575.276 Da; putative annotation: N/A; putative formula: C29H42N3O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.508,"smiles":null,"spectrum_id":"CCMSLIB00017250883","spectrum_index":22277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 114.1065 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.171,"smiles":null,"spectrum_id":"CCMSLIB00017250886","spectrum_index":22278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-carboxypropyl)-3,7-dimethylxanthine (delta mass: 113.0849 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.194,"smiles":null,"spectrum_id":"CCMSLIB00017250888","spectrum_index":22279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirubactin (delta mass: 442.242 Da; putative annotation: N/A; putative formula: C22H39N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1047.46,"smiles":null,"spectrum_id":"CCMSLIB00017250890","spectrum_index":22280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 17.1048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.206,"smiles":null,"spectrum_id":"CCMSLIB00017250893","spectrum_index":22281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pregabalin (delta mass: 9.9842 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.117,"smiles":null,"spectrum_id":"CCMSLIB00017250895","spectrum_index":22282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8,12.alpha.-Epidioxy-13(14)-abieten-18-oic acid (delta mass: 48.0362 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.258,"smiles":null,"spectrum_id":"CCMSLIB00017250897","spectrum_index":22283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 127.0631 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.144,"smiles":null,"spectrum_id":"CCMSLIB00017250900","spectrum_index":22284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 364.0997 Da; putative annotation: N/A; putative formula: C19H16N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.16,"smiles":null,"spectrum_id":"CCMSLIB00017250901","spectrum_index":22285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 283.1183 Da; putative annotation: N/A; putative formula: C10H22NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.166,"smiles":null,"spectrum_id":"CCMSLIB00017250904","spectrum_index":22286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 293.2721 Da; putative annotation: N/A; putative formula: C19H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.509,"smiles":null,"spectrum_id":"CCMSLIB00017250907","spectrum_index":22287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 150.0682 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.165,"smiles":null,"spectrum_id":"CCMSLIB00017250909","spectrum_index":22288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 188.1049 Da; putative annotation: N/A; putative formula: C9H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.201,"smiles":null,"spectrum_id":"CCMSLIB00017250911","spectrum_index":22289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Fluorobenzene-1,3-dicarboxylic acid (delta mass: 43.9786 Da; putative annotation: N/A; putative formula: CHP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.003,"smiles":null,"spectrum_id":"CCMSLIB00017250914","spectrum_index":22290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 168.1837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.285,"smiles":null,"spectrum_id":"CCMSLIB00017250916","spectrum_index":22291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 20.428 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017250918","spectrum_index":22292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aureonitol (delta mass: 95.0576 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.196,"smiles":null,"spectrum_id":"CCMSLIB00017250921","spectrum_index":22293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicyclic acid (delta mass: 82.114 Da; putative annotation: N/A; putative formula: C7H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017250923","spectrum_index":22294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 122.114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.32,"smiles":null,"spectrum_id":"CCMSLIB00017250926","spectrum_index":22295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 99.0474 Da; putative annotation: N/A; putative formula: C8H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.15,"smiles":null,"spectrum_id":"CCMSLIB00017250928","spectrum_index":22296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 316.1088 Da; putative annotation: N/A; putative formula: C15H17N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.189,"smiles":null,"spectrum_id":"CCMSLIB00017250930","spectrum_index":22297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tibolone (delta mass: 103.04 Da; putative annotation: N/A; putative formula: C2H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.256,"smiles":null,"spectrum_id":"CCMSLIB00017250933","spectrum_index":22298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 128.8879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.0,"smiles":null,"spectrum_id":"CCMSLIB00017250935","spectrum_index":22299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1350.7478 Da; putative annotation: N/A; putative formula: C56H98N22O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1572.84,"smiles":null,"spectrum_id":"CCMSLIB00017250938","spectrum_index":22300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 49.0533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.421,"smiles":null,"spectrum_id":"CCMSLIB00017250940","spectrum_index":22301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 392.1936 Da; putative annotation: N/A; putative formula: C24H30N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":859.401,"smiles":null,"spectrum_id":"CCMSLIB00017250943","spectrum_index":22302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 151.0656 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.13,"smiles":null,"spectrum_id":"CCMSLIB00017250945","spectrum_index":22303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-Pinonic acid (delta mass: 211.0728 Da; putative annotation: N/A; putative formula: C5H14N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.19,"smiles":null,"spectrum_id":"CCMSLIB00017250947","spectrum_index":22304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 68.0628 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.305,"smiles":null,"spectrum_id":"CCMSLIB00017250950","spectrum_index":22305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 874.6496 Da; putative annotation: N/A; putative formula: C48H94N2O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1259.82,"smiles":null,"spectrum_id":"CCMSLIB00017250951","spectrum_index":22306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 467.3257 Da; putative annotation: N/A; putative formula: C27H41N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.61,"smiles":null,"spectrum_id":"CCMSLIB00017250954","spectrum_index":22307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Abietic acid CollisionEnergy:205060 (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.242,"smiles":null,"spectrum_id":"CCMSLIB00017250956","spectrum_index":22308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aS,5R,8aS)-5-(5-Hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 108.0953 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.353,"smiles":null,"spectrum_id":"CCMSLIB00017250958","spectrum_index":22309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 84.0193 Da; putative annotation: N/A; putative formula: N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.111,"smiles":null,"spectrum_id":"CCMSLIB00017250961","spectrum_index":22310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxybenzoic acid (delta mass: 42.0946 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.128,"smiles":null,"spectrum_id":"CCMSLIB00017250963","spectrum_index":22311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Diphenyl-1H-indole-7-carboxylic acid (delta mass: 128.0336 Da; putative annotation: N/A; putative formula: C3H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.151,"smiles":null,"spectrum_id":"CCMSLIB00017250966","spectrum_index":22312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 201.0633 Da; putative annotation: N/A; putative formula: C8H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.16,"smiles":null,"spectrum_id":"CCMSLIB00017250968","spectrum_index":22313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 159.0312 Da; putative annotation: N/A; putative formula: C3H6N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.133,"smiles":null,"spectrum_id":"CCMSLIB00017250971","spectrum_index":22314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 145.0529 Da; putative annotation: N/A; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.17,"smiles":null,"spectrum_id":"CCMSLIB00017250973","spectrum_index":22315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380204-01_C26H38O6_Androsta-11,15-diene-14-carboxylic acid, 3,15,19-trihydroxy-4,4,8,12,16-pentamethyl-17-oxo-, methyl ester (delta mass: 42.0059 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.28,"smiles":null,"spectrum_id":"CCMSLIB00017250976","spectrum_index":22316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 47.0043 Da; putative annotation: N/A; putative formula: HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.075,"smiles":null,"spectrum_id":"CCMSLIB00017250978","spectrum_index":22317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 333.2869 Da; putative annotation: N/A; putative formula: C22H39NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.519,"smiles":null,"spectrum_id":"CCMSLIB00017250980","spectrum_index":22318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 18.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.144,"smiles":null,"spectrum_id":"CCMSLIB00017250983","spectrum_index":22319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-hydroxybutyl)-3,5,5-trimethylcyclohex-3-en-1-ol (delta mass: 194.0432 Da; putative annotation: N/A; putative formula: C9H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.228,"smiles":null,"spectrum_id":"CCMSLIB00017250985","spectrum_index":22320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 148.0526 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.107,"smiles":null,"spectrum_id":"CCMSLIB00017250987","spectrum_index":22321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 419.4676 Da; putative annotation: N/A; putative formula: C28H57N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.512,"smiles":null,"spectrum_id":"CCMSLIB00017250990","spectrum_index":22322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 174.0891 Da; putative annotation: N/A; putative formula: C8H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.239,"smiles":null,"spectrum_id":"CCMSLIB00017250992","spectrum_index":22323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Octadecenamide, (Z)- from NIST14 (delta mass: 281.1257 Da; putative annotation: N/A; putative formula: C14H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.405,"smiles":null,"spectrum_id":"CCMSLIB00017250994","spectrum_index":22324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 126.0819 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.34,"smiles":null,"spectrum_id":"CCMSLIB00017250997","spectrum_index":22325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9-Oxo-10E,12Z-octadecadienoic acid from NIST14 (delta mass: 118.0632 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.29,"smiles":null,"spectrum_id":"CCMSLIB00017250998","spectrum_index":22326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 179.0793 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.447,"smiles":null,"spectrum_id":"CCMSLIB00017251001","spectrum_index":22327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 53.0634 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.113,"smiles":null,"spectrum_id":"CCMSLIB00017251004","spectrum_index":22328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.221,"smiles":null,"spectrum_id":"CCMSLIB00017251006","spectrum_index":22329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 360.1266 Da; putative annotation: N/A; putative formula: C12H24O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.192,"smiles":null,"spectrum_id":"CCMSLIB00017251008","spectrum_index":22330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-hydroxybenzaldehyde CollisionEnergy:205060 (delta mass: 155.0141 Da; putative annotation: N/A; putative formula: C6H6NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.058,"smiles":null,"spectrum_id":"CCMSLIB00017251010","spectrum_index":22331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 435.217 Da; putative annotation: N/A; putative formula: C26H25N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.303,"smiles":null,"spectrum_id":"CCMSLIB00017251013","spectrum_index":22332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzaldehyde - 40.0 eV (delta mass: 126.1043 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017251016","spectrum_index":22333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyphenethyl alcohol (delta mass: 39.9727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.048,"smiles":null,"spectrum_id":"CCMSLIB00017251017","spectrum_index":22334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 56.026 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.076,"smiles":null,"spectrum_id":"CCMSLIB00017251020","spectrum_index":22335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 117.0759 Da; putative annotation: N/A; putative formula: CH7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.132,"smiles":null,"spectrum_id":"CCMSLIB00017251022","spectrum_index":22336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 192.0992 Da; putative annotation: N/A; putative formula: C8H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.19,"smiles":null,"spectrum_id":"CCMSLIB00017251024","spectrum_index":22337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 101.0468 Da; putative annotation: L-Threonine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.175,"smiles":null,"spectrum_id":"CCMSLIB00017251027","spectrum_index":22338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Leu (delta mass: 113.0851 Da; putative annotation: Massbank:PR311150 Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.246,"smiles":null,"spectrum_id":"CCMSLIB00017251029","spectrum_index":22339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLPUTRESCINE - 60.0 eV (delta mass: 99.0692 Da; putative annotation: Isovaline; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.187,"smiles":null,"spectrum_id":"CCMSLIB00017251031","spectrum_index":22340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380641-01!5-[[4-[5-[[4-[5-[acetyl(hydroxy)amino]pentylamino]-4-oxobutanoyl]-hydroxyamino]pentylamino]-4-oxobutanoyl]-hydroxyamino]pentanoic acid (delta mass: 442.2425 Da; putative annotation: 4-[5-[[4-[5-[acetyl(hydroxy)amino]pentylamino]-4-oxobutanoyl]-hydroxyamino]pentylamino]-4-oxobutanoic acid; putative formula: C20H34N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1018.57,"smiles":null,"spectrum_id":"CCMSLIB00017251034","spectrum_index":22341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 279.2572 Da; putative annotation: Palmitoleoyl ethanolamide; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.479,"smiles":null,"spectrum_id":"CCMSLIB00017251036","spectrum_index":22342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 648.2146 Da; putative annotation: Maltotetraose; putative formula: C24H40O20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1315.44,"smiles":null,"spectrum_id":"CCMSLIB00017251039","spectrum_index":22343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 115.0634 Da; putative annotation: N-Methyl-L-threonine; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.207,"smiles":null,"spectrum_id":"CCMSLIB00017251041","spectrum_index":22344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-palmitoyl-rac-glycerol (delta mass: 260.2122 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":855.742,"smiles":null,"spectrum_id":"CCMSLIB00017251043","spectrum_index":22345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monoelaidin (delta mass: 303.256 Da; putative annotation: .alpha.-Linolenoyl ethanolamide; putative formula: C20H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.556,"smiles":null,"spectrum_id":"CCMSLIB00017251046","spectrum_index":22346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10(E),12(E)-octadecadienoic acid (delta mass: 332.1981 Da; putative annotation: 14-Deoxy-12-hydroxyandrographolide; putative formula: C20H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.425,"smiles":null,"spectrum_id":"CCMSLIB00017251048","spectrum_index":22347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 310.2138 Da; putative annotation: (10E,15E)-9,12,13-trihydroxyoctadeca-10,15-dienoic acid; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.435,"smiles":null,"spectrum_id":"CCMSLIB00017251050","spectrum_index":22348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 189.0636 Da; putative annotation: 3-(6-Amino-9H-purin-9-yl)propanoic acid; putative formula: C8H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.145,"smiles":null,"spectrum_id":"CCMSLIB00017251053","spectrum_index":22349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Oxopimara-9(11),15-dien-18-oic acid (delta mass: 132.0936 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.305,"smiles":null,"spectrum_id":"CCMSLIB00017251055","spectrum_index":22350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 13-Keto-9Z,11E-octadecadienoic acid from NIST14 (delta mass: 278.2254 Da; putative annotation: (9E,11Z)-8-Hydroxyoctadeca-9,11-dienoic acid; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.452,"smiles":null,"spectrum_id":"CCMSLIB00017251057","spectrum_index":22351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331602 Linoleic acid|(9Z,12Z)-octadeca-9,12-dienoic acid (delta mass: 298.2497 Da; putative annotation: NCGC00347859-02!2,3-dihydroxypropyl 13-methyltetradecanoate; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.497,"smiles":null,"spectrum_id":"CCMSLIB00017251059","spectrum_index":22352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 369.1056 Da; putative annotation: HDMBOA + O-Hex; putative formula: C16H19NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.166,"smiles":null,"spectrum_id":"CCMSLIB00017251062","spectrum_index":22353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatetraenoyl ethanolamide (delta mass: 650.5225 Da; putative annotation: 1-Stearoyl-2-docosahexaenoyl-sn-glycerol; putative formula: C43H70O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1026.84,"smiles":null,"spectrum_id":"CCMSLIB00017251064","spectrum_index":22354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 190.0633 Da; putative annotation: 6-Hydroxy-8-methoxy-3-methyl-3,4-dihydroisochromen-1-one; putative formula: C11H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.128,"smiles":null,"spectrum_id":"CCMSLIB00017251066","spectrum_index":22355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 197.0895 Da; putative annotation: (+)-Camphorsultam; putative formula: C10H15NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.259,"smiles":null,"spectrum_id":"CCMSLIB00017251069","spectrum_index":22356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 210.1257 Da; putative annotation: \"\"6,11-dioxododecanoic acid CollisionEnergy:205060\"\"; putative formula: C12H18O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017251072","spectrum_index":22357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 86.0366 Da; putative annotation: 1,4-Anhydroerythritol; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017251073","spectrum_index":22358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-6-5 (delta mass: 307.2885 Da; putative annotation: MLS002153155-01!N-Oleoylethanolamine111-58-0; putative formula: C20H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.547,"smiles":null,"spectrum_id":"CCMSLIB00017251076","spectrum_index":22359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-9-Hexadecenoic acid from NIST14 (delta mass: 435.275 Da; putative annotation: 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine; putative formula: C21H42NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.507,"smiles":null,"spectrum_id":"CCMSLIB00017251078","spectrum_index":22360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 107.0485 Da; putative annotation: 4-Hydrazinylpyridin-2(1H)-one; putative formula: C5H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.109,"smiles":null,"spectrum_id":"CCMSLIB00017251080","spectrum_index":22361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 179.079 Da; putative annotation: 4-Amino-3-(4-fluorophenyl)butanoic acid; putative formula: C10H10FNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.15,"smiles":null,"spectrum_id":"CCMSLIB00017251083","spectrum_index":22362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 16.9981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.23,"smiles":null,"spectrum_id":"CCMSLIB00017251084","spectrum_index":22363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorobenzyl)piperidine (delta mass: 52.0359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017251087","spectrum_index":22364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Lys (delta mass: 128.0938 Da; putative annotation: N/A; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.275,"smiles":null,"spectrum_id":"CCMSLIB00017251090","spectrum_index":22365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 145.1351 Da; putative annotation: N/A; putative formula: C5H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017251091","spectrum_index":22366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-HYDROXYDECANOIC ACID (delta mass: 52.0674 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.216,"smiles":null,"spectrum_id":"CCMSLIB00017251094","spectrum_index":22367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 74.0725 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.211,"smiles":null,"spectrum_id":"CCMSLIB00017251097","spectrum_index":22368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 451.2416 Da; putative annotation: N/A; putative formula: C18H25N15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.296,"smiles":null,"spectrum_id":"CCMSLIB00017251099","spectrum_index":22369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 80.0717 Da; putative annotation: N/A; putative formula: C5H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.563,"smiles":null,"spectrum_id":"CCMSLIB00017251101","spectrum_index":22370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethcathinone (delta mass: 120.0425 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.165,"smiles":null,"spectrum_id":"CCMSLIB00017251104","spectrum_index":22371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 77.0843 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.295,"smiles":null,"spectrum_id":"CCMSLIB00017251106","spectrum_index":22372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 241.1314 Da; putative annotation: N/A; putative formula: C12H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.243,"smiles":null,"spectrum_id":"CCMSLIB00017251108","spectrum_index":22373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 133.0529 Da; putative annotation: N/A; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.165,"smiles":null,"spectrum_id":"CCMSLIB00017251110","spectrum_index":22374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 51.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.4,"smiles":null,"spectrum_id":"CCMSLIB00017251113","spectrum_index":22375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Diethyl L-tartrate (delta mass: 18.0237 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.11,"smiles":null,"spectrum_id":"CCMSLIB00017251116","spectrum_index":22376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 74.0715 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.152,"smiles":null,"spectrum_id":"CCMSLIB00017251117","spectrum_index":22377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 246.1466 Da; putative annotation: N/A; putative formula: C12H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.264,"smiles":null,"spectrum_id":"CCMSLIB00017251120","spectrum_index":22378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 20.0977 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.132,"smiles":null,"spectrum_id":"CCMSLIB00017251123","spectrum_index":22379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-aminovaleric acid betaine (delta mass: 51.0099 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.143,"smiles":null,"spectrum_id":"CCMSLIB00017251124","spectrum_index":22380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PM018176 Spermidine-di-p-coumaroyl (delta mass: 145.1304 Da; putative annotation: N/A; putative formula: C5H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.369,"smiles":null,"spectrum_id":"CCMSLIB00017251127","spectrum_index":22381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinolenic acid (delta mass: 46.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.274,"smiles":null,"spectrum_id":"CCMSLIB00017251129","spectrum_index":22382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 120.0943 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.326,"smiles":null,"spectrum_id":"CCMSLIB00017251131","spectrum_index":22383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azaspiro[4.5]decane-7,9-dione (delta mass: 131.0949 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.197,"smiles":null,"spectrum_id":"CCMSLIB00017251134","spectrum_index":22384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethoxy)benzaldehyde (delta mass: 44.0242 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.094,"smiles":null,"spectrum_id":"CCMSLIB00017251136","spectrum_index":22385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 172.0443 Da; putative annotation: N/A; putative formula: C11H9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.146,"smiles":null,"spectrum_id":"CCMSLIB00017251139","spectrum_index":22386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.196,"smiles":null,"spectrum_id":"CCMSLIB00017251141","spectrum_index":22387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-hydroxybenzoic acid CollisionEnergy:102040 (delta mass: 78.032 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.082,"smiles":null,"spectrum_id":"CCMSLIB00017251143","spectrum_index":22388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 121.0375 Da; putative annotation: N/A; putative formula: C3H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017251146","spectrum_index":22389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dehydrocoelenterazine (delta mass: 306.1001 Da; putative annotation: N/A; putative formula: C10H18N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.25,"smiles":null,"spectrum_id":"CCMSLIB00017251149","spectrum_index":22390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Chloro-9H-carbazole (delta mass: 188.1869 Da; putative annotation: N/A; putative formula: C6H20N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.229,"smiles":null,"spectrum_id":"CCMSLIB00017251150","spectrum_index":22391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 113.0001 Da; putative annotation: N/A; putative formula: N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017251153","spectrum_index":22392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sebacic acid (delta mass: 36.0365 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017251156","spectrum_index":22393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Skatole - 40.0 eV (delta mass: 73.9592 Da; putative annotation: N/A; putative formula: N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017251157","spectrum_index":22394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.316,"smiles":null,"spectrum_id":"CCMSLIB00017251160","spectrum_index":22395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.243,"smiles":null,"spectrum_id":"CCMSLIB00017251163","spectrum_index":22396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 679.5038 Da; putative annotation: N/A; putative formula: C40H65N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.731,"smiles":null,"spectrum_id":"CCMSLIB00017251165","spectrum_index":22397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 26.052 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.127,"smiles":null,"spectrum_id":"CCMSLIB00017251167","spectrum_index":22398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 90.0461 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.325,"smiles":null,"spectrum_id":"CCMSLIB00017251170","spectrum_index":22399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Talatisamine (delta mass: 74.0517 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.342,"smiles":null,"spectrum_id":"CCMSLIB00017251171","spectrum_index":22400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 44.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.123,"smiles":null,"spectrum_id":"CCMSLIB00017251174","spectrum_index":22401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 38.9383 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.993,"smiles":null,"spectrum_id":"CCMSLIB00017251177","spectrum_index":22402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one (delta mass: 78.047 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017251179","spectrum_index":22403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 123.0795 Da; putative annotation: N/A; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.166,"smiles":null,"spectrum_id":"CCMSLIB00017251181","spectrum_index":22404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 94.0417 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017251184","spectrum_index":22405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 115.0607 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.174,"smiles":null,"spectrum_id":"CCMSLIB00017251185","spectrum_index":22406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 360.103 Da; putative annotation: N/A; putative formula: C19H20O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.319,"smiles":null,"spectrum_id":"CCMSLIB00017251188","spectrum_index":22407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 266.0999 Da; putative annotation: N/A; putative formula: C10H18O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.165,"smiles":null,"spectrum_id":"CCMSLIB00017251191","spectrum_index":22408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU117301 Aminoglutethimide|3-(4-aminophenyl)-3-ethylpiperidine-2,6-dione (delta mass: 129.043 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.172,"smiles":null,"spectrum_id":"CCMSLIB00017251193","spectrum_index":22409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 465.4411 Da; putative annotation: N/A; putative formula: C27H55N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.584,"smiles":null,"spectrum_id":"CCMSLIB00017251195","spectrum_index":22410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anabasine (delta mass: 176.0317 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.155,"smiles":null,"spectrum_id":"CCMSLIB00017251198","spectrum_index":22411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-3-ylmethanamine (delta mass: 43.0423 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.129,"smiles":null,"spectrum_id":"CCMSLIB00017251199","spectrum_index":22412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnan-3.alpha.-ol-11,20-dione (delta mass: 130.115 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.357,"smiles":null,"spectrum_id":"CCMSLIB00017251202","spectrum_index":22413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 244.1313 Da; putative annotation: N/A; putative formula: C12H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.347,"smiles":null,"spectrum_id":"CCMSLIB00017251205","spectrum_index":22414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 97.0518 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.133,"smiles":null,"spectrum_id":"CCMSLIB00017251206","spectrum_index":22415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxyandrosta-5,15-dien-17-one (delta mass: 159.0891 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.29,"smiles":null,"spectrum_id":"CCMSLIB00017251209","spectrum_index":22416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 707.4599 Da; putative annotation: N/A; putative formula: C44H61N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.52,"smiles":null,"spectrum_id":"CCMSLIB00017251211","spectrum_index":22417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 46.0784 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.144,"smiles":null,"spectrum_id":"CCMSLIB00017251213","spectrum_index":22418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 25.0291 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.136,"smiles":null,"spectrum_id":"CCMSLIB00017251216","spectrum_index":22419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3,4-Dimethylbenzoic acid from NIST14 (delta mass: 5.9729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.048,"smiles":null,"spectrum_id":"CCMSLIB00017251217","spectrum_index":22420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C15:1 (delta mass: 242.225 Da; putative annotation: N/A; putative formula: C15H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.463,"smiles":null,"spectrum_id":"CCMSLIB00017251220","spectrum_index":22421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 273.25 Da; putative annotation: N/A; putative formula: C13H31N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.526,"smiles":null,"spectrum_id":"CCMSLIB00017251223","spectrum_index":22422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 64.0303 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.142,"smiles":null,"spectrum_id":"CCMSLIB00017251224","spectrum_index":22423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 92.0111 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.092,"smiles":null,"spectrum_id":"CCMSLIB00017251227","spectrum_index":22424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 126.0319 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.113,"smiles":null,"spectrum_id":"CCMSLIB00017251230","spectrum_index":22425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371603 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.081,"smiles":null,"spectrum_id":"CCMSLIB00017251231","spectrum_index":22426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Dihydroxy-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one (delta mass: 74.0366 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.117,"smiles":null,"spectrum_id":"CCMSLIB00017251234","spectrum_index":22427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369605 Salicylic acid|2-hydroxybenzoic acid (delta mass: 184.0522 Da; putative annotation: N/A; putative formula: C12H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.091,"smiles":null,"spectrum_id":"CCMSLIB00017251236","spectrum_index":22428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 132.0464 Da; putative annotation: N/A; putative formula: C3H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.143,"smiles":null,"spectrum_id":"CCMSLIB00017251238","spectrum_index":22429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 170.1306 Da; putative annotation: N/A; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.248,"smiles":null,"spectrum_id":"CCMSLIB00017251241","spectrum_index":22430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine (delta mass: 59.0264 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.134,"smiles":null,"spectrum_id":"CCMSLIB00017251244","spectrum_index":22431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 439.7151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.786,"smiles":null,"spectrum_id":"CCMSLIB00017251245","spectrum_index":22432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 60.0315 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.155,"smiles":null,"spectrum_id":"CCMSLIB00017251248","spectrum_index":22433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-hydroxy-6-methylhept-5-en-2-yl)-7-(3-methylbut-2-enyl)-2,3-dihydro-1-benzofuran-5-carboxylic acid (delta mass: 375.238 Da; putative annotation: N/A; putative formula: C18H37N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":734.46,"smiles":null,"spectrum_id":"CCMSLIB00017251250","spectrum_index":22434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 179.1506 Da; putative annotation: N/A; putative formula: C9H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.19,"smiles":null,"spectrum_id":"CCMSLIB00017251252","spectrum_index":22435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 192.0649 Da; putative annotation: N/A; putative formula: C8H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.141,"smiles":null,"spectrum_id":"CCMSLIB00017251255","spectrum_index":22436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyl-1-piperidineethanol (delta mass: 73.0048 Da; putative annotation: N/A; putative formula: C4H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.143,"smiles":null,"spectrum_id":"CCMSLIB00017251256","spectrum_index":22437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CORTISOL (delta mass: 45.061 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.278,"smiles":null,"spectrum_id":"CCMSLIB00017251259","spectrum_index":22438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 27.9941 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.097,"smiles":null,"spectrum_id":"CCMSLIB00017251262","spectrum_index":22439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DIHYDROURACIL - 40.0 eV (delta mass: 82.0426 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.093,"smiles":null,"spectrum_id":"CCMSLIB00017251263","spectrum_index":22440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Benzoxepin-5-ol, 2,3,4,5-tetrahydro-3-(methylamino)-, (3R,5S)-rel- (delta mass: 30.9944 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017251266","spectrum_index":22441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 242.1266 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.228,"smiles":null,"spectrum_id":"CCMSLIB00017251269","spectrum_index":22442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.221,"smiles":null,"spectrum_id":"CCMSLIB00017251271","spectrum_index":22443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 327.3144 Da; putative annotation: N/A; putative formula: C20H41NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.573,"smiles":null,"spectrum_id":"CCMSLIB00017251273","spectrum_index":22444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazole (delta mass: 43.0056 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":112.05,"smiles":null,"spectrum_id":"CCMSLIB00017251276","spectrum_index":22445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 104.0106 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.107,"smiles":null,"spectrum_id":"CCMSLIB00017251278","spectrum_index":22446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-N-(2-pyridinylmethyl)-1H-indole-3-carboxamide (delta mass: 159.0886 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.217,"smiles":null,"spectrum_id":"CCMSLIB00017251280","spectrum_index":22447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Arachidonoyltaurine (delta mass: 66.0114 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.263,"smiles":null,"spectrum_id":"CCMSLIB00017251283","spectrum_index":22448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lupinine (delta mass: 130.0629 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.217,"smiles":null,"spectrum_id":"CCMSLIB00017251285","spectrum_index":22449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 152.1561 Da; putative annotation: N/A; putative formula: C11H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.274,"smiles":null,"spectrum_id":"CCMSLIB00017251287","spectrum_index":22450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 260.1255 Da; putative annotation: N/A; putative formula: C12H20O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.238,"smiles":null,"spectrum_id":"CCMSLIB00017251290","spectrum_index":22451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11(12)-Epoxy-5Z,8Z,14Z,17Z- eicosatetraenoic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.237,"smiles":null,"spectrum_id":"CCMSLIB00017251292","spectrum_index":22452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 1.9588 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":102.035,"smiles":null,"spectrum_id":"CCMSLIB00017251295","spectrum_index":22453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU109202 2,2-Dimethyl-2,3-dihydro-1-benzofuran-7-amine|2,2-dimethyl-3H-1-benzofuran-7-amine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.118,"smiles":null,"spectrum_id":"CCMSLIB00017251297","spectrum_index":22454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 15.9925 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.105,"smiles":null,"spectrum_id":"CCMSLIB00017251300","spectrum_index":22455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 62.0854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.317,"smiles":null,"spectrum_id":"CCMSLIB00017251302","spectrum_index":22456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 332.2556 Da; putative annotation: N/A; putative formula: C15H28N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.493,"smiles":null,"spectrum_id":"CCMSLIB00017251305","spectrum_index":22457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOSE (delta mass: 223.9802 Da; putative annotation: N/A; putative formula: C5H4O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.104,"smiles":null,"spectrum_id":"CCMSLIB00017251307","spectrum_index":22458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jervine (delta mass: 114.0884 Da; putative annotation: N/A; putative formula: C7H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.389,"smiles":null,"spectrum_id":"CCMSLIB00017251309","spectrum_index":22459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinolcarboxylic acid (delta mass: 108.0211 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.05,"smiles":null,"spectrum_id":"CCMSLIB00017251312","spectrum_index":22460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinostilbene (delta mass: 15.0184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.12,"smiles":null,"spectrum_id":"CCMSLIB00017251315","spectrum_index":22461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Androstane-3,6,17-triol (delta mass: 132.094 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017251316","spectrum_index":22462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 163.0393 Da; putative annotation: N/A; putative formula: C5H10NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.101,"smiles":null,"spectrum_id":"CCMSLIB00017251319","spectrum_index":22463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 56.0258 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.149,"smiles":null,"spectrum_id":"CCMSLIB00017251322","spectrum_index":22464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(4-Methylpiperazin-1-yl)methyl]benzoic acid (delta mass: 17.0169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.161,"smiles":null,"spectrum_id":"CCMSLIB00017251324","spectrum_index":22465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 17(18)-EpETE from NIST14 (delta mass: 144.9383 Da; putative annotation: N/A; putative formula: C3NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.165,"smiles":null,"spectrum_id":"CCMSLIB00017251326","spectrum_index":22466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Nonaethylene glycol from NIST14 (delta mass: 212.7218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.976,"smiles":null,"spectrum_id":"CCMSLIB00017251329","spectrum_index":22467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,8E)-7-hydroxy-10-(hydroxymethyl)-4,8,11,15-tetramethylbicyclo[11.2.0]pentadeca-4,8,14-trien-6-one (delta mass: 63.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.296,"smiles":null,"spectrum_id":"CCMSLIB00017251331","spectrum_index":22468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00168836-03_C20H30O4_6,18,19-Trihydroxytrachyloban-2-one (delta mass: 15.0189 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.241,"smiles":null,"spectrum_id":"CCMSLIB00017251333","spectrum_index":22469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 382.1716 Da; putative annotation: N/A; putative formula: C15H34N4O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.212,"smiles":null,"spectrum_id":"CCMSLIB00017251336","spectrum_index":22470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 13.9884 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.096,"smiles":null,"spectrum_id":"CCMSLIB00017251337","spectrum_index":22471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eicosapentaenoyl ethanolamide (delta mass: 694.4926 Da; putative annotation: N/A; putative formula: C42H66N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1040.77,"smiles":null,"spectrum_id":"CCMSLIB00017251340","spectrum_index":22472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 78.0325 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.171,"smiles":null,"spectrum_id":"CCMSLIB00017251341","spectrum_index":22473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 167.0509 Da; putative annotation: N/A; putative formula: C7H9N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.21,"smiles":null,"spectrum_id":"CCMSLIB00017251344","spectrum_index":22474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 693.394 Da; putative annotation: N/A; putative formula: C47H47N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":970.61,"smiles":null,"spectrum_id":"CCMSLIB00017251347","spectrum_index":22475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palitantin (delta mass: 134.0368 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.196,"smiles":null,"spectrum_id":"CCMSLIB00017251348","spectrum_index":22476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP030402 ?-linolenic acid|linolenic acid|(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid (delta mass: 329.2585 Da; putative annotation: N/A; putative formula: C19H31N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.49,"smiles":null,"spectrum_id":"CCMSLIB00017251351","spectrum_index":22477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 3-amino-4-methoxyindole-2-carboxylate CollisionEnergy:102040 (delta mass: 138.0313 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.123,"smiles":null,"spectrum_id":"CCMSLIB00017251354","spectrum_index":22478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 61.0827 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.174,"smiles":null,"spectrum_id":"CCMSLIB00017251355","spectrum_index":22479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 103.0616 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.169,"smiles":null,"spectrum_id":"CCMSLIB00017251358","spectrum_index":22480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304315 Soyasaponin Ba (delta mass: 126.0294 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1085.55,"smiles":null,"spectrum_id":"CCMSLIB00017251361","spectrum_index":22481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 738.4208 Da; putative annotation: N/A; putative formula: C35H55N12O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.481,"smiles":null,"spectrum_id":"CCMSLIB00017251362","spectrum_index":22482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:102040 (delta mass: 227.2241 Da; putative annotation: N/A; putative formula: C14H29NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.492,"smiles":null,"spectrum_id":"CCMSLIB00017251365","spectrum_index":22483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-6-methoxy-2-methylspiro[3,4-dihydroisoquinoline-1,7'-6H-cyclopenta[g][1,3]benzodioxole]-8'-one (delta mass: 18.9583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.092,"smiles":null,"spectrum_id":"CCMSLIB00017251366","spectrum_index":22484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uvaol (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.398,"smiles":null,"spectrum_id":"CCMSLIB00017251369","spectrum_index":22485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 531.2116 Da; putative annotation: N/A; putative formula: C38H30NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.282,"smiles":null,"spectrum_id":"CCMSLIB00017251372","spectrum_index":22486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 84.0378 Da; putative annotation: N/A; putative formula: C8H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.171,"smiles":null,"spectrum_id":"CCMSLIB00017251373","spectrum_index":22487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU080706 Azacyclotridecan-2-one (delta mass: 45.0193 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.204,"smiles":null,"spectrum_id":"CCMSLIB00017251376","spectrum_index":22488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of rac-all-trans-4-Hydroxyretinal (delta mass: 62.0521 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.268,"smiles":null,"spectrum_id":"CCMSLIB00017251379","spectrum_index":22489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 333.3041 Da; putative annotation: N/A; putative formula: C22H39NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.787,"smiles":null,"spectrum_id":"CCMSLIB00017251380","spectrum_index":22490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYPHENYLACETIC ACID (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017251383","spectrum_index":22491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:102040 (delta mass: 234.2693 Da; putative annotation: N/A; putative formula: C18H34O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.512,"smiles":null,"spectrum_id":"CCMSLIB00017251384","spectrum_index":22492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 89.9773 Da; putative annotation: N/A; putative formula: C4H-1N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.167,"smiles":null,"spectrum_id":"CCMSLIB00017251387","spectrum_index":22493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 264.1003 Da; putative annotation: N/A; putative formula: C15H20S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.38,"smiles":null,"spectrum_id":"CCMSLIB00017251388","spectrum_index":22494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LPC(16:0) (delta mass: 609.3617 Da; putative annotation: N/A; putative formula: C33H56NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1105.7,"smiles":null,"spectrum_id":"CCMSLIB00017251391","spectrum_index":22495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 178.0805 Da; putative annotation: N/A; putative formula: C11H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.13,"smiles":null,"spectrum_id":"CCMSLIB00017251394","spectrum_index":22496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 349.2825 Da; putative annotation: N/A; putative formula: C15H31N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.343,"smiles":null,"spectrum_id":"CCMSLIB00017251395","spectrum_index":22497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Taxifolin (delta mass: 304.0574 Da; putative annotation: N/A; putative formula: C9H13N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.123,"smiles":null,"spectrum_id":"CCMSLIB00017251398","spectrum_index":22498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 134.0547 Da; putative annotation: N/A; putative formula: CH6N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.181,"smiles":null,"spectrum_id":"CCMSLIB00017251399","spectrum_index":22499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 163.0653 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.154,"smiles":null,"spectrum_id":"CCMSLIB00017251402","spectrum_index":22500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Dehydroperuvinine (delta mass: 205.0953 Da; putative annotation: N/A; putative formula: C8H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.223,"smiles":null,"spectrum_id":"CCMSLIB00017251404","spectrum_index":22501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-cyclohexanecarboxylic acid (delta mass: 325.1529 Da; putative annotation: N/A; putative formula: C16H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.26,"smiles":null,"spectrum_id":"CCMSLIB00017251406","spectrum_index":22502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Virginiaebutanolide C (delta mass: 74.0566 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.2,"smiles":null,"spectrum_id":"CCMSLIB00017251409","spectrum_index":22503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 69.0593 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.13,"smiles":null,"spectrum_id":"CCMSLIB00017251410","spectrum_index":22504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTOSE (delta mass: 596.478 Da; putative annotation: N/A; putative formula: C43H64O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":939.602,"smiles":null,"spectrum_id":"CCMSLIB00017251413","spectrum_index":22505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl hydrogen azelate (delta mass: 74.0391 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.167,"smiles":null,"spectrum_id":"CCMSLIB00017251416","spectrum_index":22506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19,20-Dihydroxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 100.0676 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.321,"smiles":null,"spectrum_id":"CCMSLIB00017251418","spectrum_index":22507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cresotinic acid (delta mass: 26.9454 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017251420","spectrum_index":22508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptoline (delta mass: 14.9527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.06,"smiles":null,"spectrum_id":"CCMSLIB00017251423","spectrum_index":22509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methylbenzoic acid (delta mass: 80.0627 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017251426","spectrum_index":22510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 45.9352 Da; putative annotation: N/A; putative formula: H-2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.0,"smiles":null,"spectrum_id":"CCMSLIB00017251427","spectrum_index":22511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOIC ACID (delta mass: 46.0239 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.079,"smiles":null,"spectrum_id":"CCMSLIB00017251430","spectrum_index":22512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 52.0674 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.237,"smiles":null,"spectrum_id":"CCMSLIB00017251432","spectrum_index":22513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301004 Aristolochic acid B (delta mass: 32.0329 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.083,"smiles":null,"spectrum_id":"CCMSLIB00017251434","spectrum_index":22514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 35.8676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.115,"smiles":null,"spectrum_id":"CCMSLIB00017251437","spectrum_index":22515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-Hydroxy-4,6-dimethoxyacetophenone\"\" (delta mass: 120.0237 Da; putative annotation: N/A; putative formula: C6H5N2O-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.104,"smiles":null,"spectrum_id":"CCMSLIB00017251438","spectrum_index":22516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 188.2135 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.263,"smiles":null,"spectrum_id":"CCMSLIB00017251441","spectrum_index":22517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid (delta mass: 108.0209 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.065,"smiles":null,"spectrum_id":"CCMSLIB00017251444","spectrum_index":22518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 44.026 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017251446","spectrum_index":22519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine (delta mass: 40.017 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":112.098,"smiles":null,"spectrum_id":"CCMSLIB00017251448","spectrum_index":22520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 52.0307 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.08,"smiles":null,"spectrum_id":"CCMSLIB00017251451","spectrum_index":22521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Murrayafoline A (delta mass: 2.0724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.179,"smiles":null,"spectrum_id":"CCMSLIB00017251453","spectrum_index":22522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 111.0321 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017251455","spectrum_index":22523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 30.0838 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.143,"smiles":null,"spectrum_id":"CCMSLIB00017251458","spectrum_index":22524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 256.2909 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.33,"smiles":null,"spectrum_id":"CCMSLIB00017251460","spectrum_index":22525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ascochlorin (delta mass: 17.1277 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.31,"smiles":null,"spectrum_id":"CCMSLIB00017251462","spectrum_index":22526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 463.3499 Da; putative annotation: N/A; putative formula: C28H51NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.41,"smiles":null,"spectrum_id":"CCMSLIB00017251465","spectrum_index":22527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7,10-Tetraazacyclododecane (delta mass: 212.9639 Da; putative annotation: N/A; putative formula: C7H4NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.14,"smiles":null,"spectrum_id":"CCMSLIB00017251466","spectrum_index":22528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 36.0362 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.263,"smiles":null,"spectrum_id":"CCMSLIB00017251469","spectrum_index":22529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 383.7278 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.799,"smiles":null,"spectrum_id":"CCMSLIB00017251472","spectrum_index":22530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 307.3588 Da; putative annotation: N/A; putative formula: C22H45NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.471,"smiles":null,"spectrum_id":"CCMSLIB00017251474","spectrum_index":22531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 47.0614 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.116,"smiles":null,"spectrum_id":"CCMSLIB00017251476","spectrum_index":22532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 58.0762 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.136,"smiles":null,"spectrum_id":"CCMSLIB00017251479","spectrum_index":22533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 71.078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.089,"smiles":null,"spectrum_id":"CCMSLIB00017251481","spectrum_index":22534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid (delta mass: 19.0055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.129,"smiles":null,"spectrum_id":"CCMSLIB00017251483","spectrum_index":22535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haloperidol (delta mass: 7.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.169,"smiles":null,"spectrum_id":"CCMSLIB00017251486","spectrum_index":22536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385600-01_C13H22O3_2-Cyclohexen-1-one, 4-hydroxy-4-(3-hydroxybutyl)-3,5,5-trimethyl- (delta mass: 78.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.181,"smiles":null,"spectrum_id":"CCMSLIB00017251489","spectrum_index":22537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 113.0114 Da; putative annotation: N/A; putative formula: C4H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.087,"smiles":null,"spectrum_id":"CCMSLIB00017251491","spectrum_index":22538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 428.175 Da; putative annotation: N/A; putative formula: C27H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.224,"smiles":null,"spectrum_id":"CCMSLIB00017251493","spectrum_index":22539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 40.038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.229,"smiles":null,"spectrum_id":"CCMSLIB00017251496","spectrum_index":22540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,5R,9S,13R)-14-formyl-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadec-14-ene-5-carboxylic acid (delta mass: 63.9595 Da; putative annotation: N/A; putative formula: O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.171,"smiles":null,"spectrum_id":"CCMSLIB00017251497","spectrum_index":22541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU059904 2,6-Dimethoxybenzoic acid (delta mass: 43.9897 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.055,"smiles":null,"spectrum_id":"CCMSLIB00017251500","spectrum_index":22542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 9.9846 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.087,"smiles":null,"spectrum_id":"CCMSLIB00017251503","spectrum_index":22543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 43.0481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.087,"smiles":null,"spectrum_id":"CCMSLIB00017251505","spectrum_index":22544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-hydroxypropanoate (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":115.039,"smiles":null,"spectrum_id":"CCMSLIB00017251507","spectrum_index":22545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 308.1737 Da; putative annotation: N/A; putative formula: C16H24N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.266,"smiles":null,"spectrum_id":"CCMSLIB00017251510","spectrum_index":22546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 231.1283 Da; putative annotation: N/A; putative formula: C13H18N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.21,"smiles":null,"spectrum_id":"CCMSLIB00017251512","spectrum_index":22547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7.beta.,17.alpha.-Dimethyl-5.beta.-androstane-3.alpha.,17.beta.-diol (delta mass: 74.0551 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.334,"smiles":null,"spectrum_id":"CCMSLIB00017251514","spectrum_index":22548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Quinazolinylamino)ethanol (delta mass: 53.015 Da; putative annotation: N/A; putative formula: H-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.113,"smiles":null,"spectrum_id":"CCMSLIB00017251517","spectrum_index":22549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 91.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.326,"smiles":null,"spectrum_id":"CCMSLIB00017251518","spectrum_index":22550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylic acid (delta mass: 17.015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.128,"smiles":null,"spectrum_id":"CCMSLIB00017251521","spectrum_index":22551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Trp (delta mass: 186.0799 Da; putative annotation: N/A; putative formula: C11H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.198,"smiles":null,"spectrum_id":"CCMSLIB00017251524","spectrum_index":22552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 74.0371 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.15,"smiles":null,"spectrum_id":"CCMSLIB00017251525","spectrum_index":22553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 154.0257 Da; putative annotation: N/A; putative formula: CH7N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.085,"smiles":null,"spectrum_id":"CCMSLIB00017251528","spectrum_index":22554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 176.1414 Da; putative annotation: N/A; putative formula: C10H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.301,"smiles":null,"spectrum_id":"CCMSLIB00017251530","spectrum_index":22555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4aR)-6-Hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid (delta mass: 56.0269 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.254,"smiles":null,"spectrum_id":"CCMSLIB00017251533","spectrum_index":22556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jaeskeanadiol (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.227,"smiles":null,"spectrum_id":"CCMSLIB00017251535","spectrum_index":22557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 45.9997 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.118,"smiles":null,"spectrum_id":"CCMSLIB00017251538","spectrum_index":22558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-2-piperazinone (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.16,"smiles":null,"spectrum_id":"CCMSLIB00017251541","spectrum_index":22559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromomoric acid B (delta mass: 84.0934 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017251542","spectrum_index":22560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzaldehyde (delta mass: 42.0581 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.102,"smiles":null,"spectrum_id":"CCMSLIB00017251545","spectrum_index":22561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipalmitolein (9c) (delta mass: 86.0513 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.534,"smiles":null,"spectrum_id":"CCMSLIB00017251547","spectrum_index":22562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 131.0359 Da; putative annotation: N/A; putative formula: C2H6N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.133,"smiles":null,"spectrum_id":"CCMSLIB00017251549","spectrum_index":22563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Minoxidil (delta mass: 132.0426 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.177,"smiles":null,"spectrum_id":"CCMSLIB00017251552","spectrum_index":22564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentisic acid (delta mass: 96.9945 Da; putative annotation: N/A; putative formula: CN5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.028,"smiles":null,"spectrum_id":"CCMSLIB00017251553","spectrum_index":22565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillin (delta mass: 140.0816 Da; putative annotation: N/A; putative formula: C4H8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.136,"smiles":null,"spectrum_id":"CCMSLIB00017251556","spectrum_index":22566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Acetaminobenzoic acid (delta mass: 12.0001 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.066,"smiles":null,"spectrum_id":"CCMSLIB00017251557","spectrum_index":22567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (delta mass: 176.9404 Da; putative annotation: N/A; putative formula: C2H2N3OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.084,"smiles":null,"spectrum_id":"CCMSLIB00017251560","spectrum_index":22568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 460.2202 Da; putative annotation: N/A; putative formula: C26H37O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.312,"smiles":null,"spectrum_id":"CCMSLIB00017251561","spectrum_index":22569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kainic Acid (delta mass: 127.0494 Da; putative annotation: N/A; putative formula: C3H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.157,"smiles":null,"spectrum_id":"CCMSLIB00017251564","spectrum_index":22570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 69.0136 Da; putative annotation: N/A; putative formula: C3H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.079,"smiles":null,"spectrum_id":"CCMSLIB00017251565","spectrum_index":22571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5.xi.,9.xi.,18.xi.)-6-Hydroxy-3-oxolup-20(29)-en-28-oic acid (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.368,"smiles":null,"spectrum_id":"CCMSLIB00017251568","spectrum_index":22572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Picrinine (delta mass: 188.1778 Da; putative annotation: N/A; putative formula: C7H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.348,"smiles":null,"spectrum_id":"CCMSLIB00017251569","spectrum_index":22573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 358.1054 Da; putative annotation: N/A; putative formula: C19H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.166,"smiles":null,"spectrum_id":"CCMSLIB00017251572","spectrum_index":22574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 268.0744 Da; putative annotation: N/A; putative formula: C17H16O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.171,"smiles":null,"spectrum_id":"CCMSLIB00017251574","spectrum_index":22575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371603 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 28.0289 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.099,"smiles":null,"spectrum_id":"CCMSLIB00017251576","spectrum_index":22576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 401.2051 Da; putative annotation: N/A; putative formula: C19H31NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.276,"smiles":null,"spectrum_id":"CCMSLIB00017251579","spectrum_index":22577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoleic acid (delta mass: 59.0723 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.273,"smiles":null,"spectrum_id":"CCMSLIB00017251580","spectrum_index":22578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 66.0477 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.182,"smiles":null,"spectrum_id":"CCMSLIB00017251583","spectrum_index":22579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 46.8754 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.982,"smiles":null,"spectrum_id":"CCMSLIB00017251586","spectrum_index":22580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.127,"smiles":null,"spectrum_id":"CCMSLIB00017251587","spectrum_index":22581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3.beta.,9.beta.,10.alpha.)-3-Hydroxypregna-5,7-dien-20-one (delta mass: 212.0531 Da; putative annotation: N/A; putative formula: C6H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.285,"smiles":null,"spectrum_id":"CCMSLIB00017251590","spectrum_index":22582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 971.51 Da; putative annotation: N/A; putative formula: C62H65N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1152.58,"smiles":null,"spectrum_id":"CCMSLIB00017251592","spectrum_index":22583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 809.4566 Da; putative annotation: N/A; putative formula: C56H55N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.527,"smiles":null,"spectrum_id":"CCMSLIB00017251594","spectrum_index":22584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 885.4725 Da; putative annotation: N/A; putative formula: C39H68N9O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1048.53,"smiles":null,"spectrum_id":"CCMSLIB00017251597","spectrum_index":22585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 658.4076 Da; putative annotation: N/A; putative formula: C38H58O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":821.468,"smiles":null,"spectrum_id":"CCMSLIB00017251598","spectrum_index":22586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 122.093 Da; putative annotation: N/A; putative formula: C6H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.377,"smiles":null,"spectrum_id":"CCMSLIB00017251601","spectrum_index":22587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-9-2a (delta mass: 158.0214 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.264,"smiles":null,"spectrum_id":"CCMSLIB00017251602","spectrum_index":22588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 679.2486 Da; putative annotation: N/A; putative formula: C43H38NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.319,"smiles":null,"spectrum_id":"CCMSLIB00017251605","spectrum_index":22589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Threonine methyl ester (delta mass: 210.1979 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.279,"smiles":null,"spectrum_id":"CCMSLIB00017251607","spectrum_index":22590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 126.1044 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.217,"smiles":null,"spectrum_id":"CCMSLIB00017251609","spectrum_index":22591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 175.0527 Da; putative annotation: N/A; putative formula: C4H9N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.09,"smiles":null,"spectrum_id":"CCMSLIB00017251612","spectrum_index":22592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM825501 4-Aminophenol (delta mass: 71.0007 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.061,"smiles":null,"spectrum_id":"CCMSLIB00017251613","spectrum_index":22593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 174.0678 Da; putative annotation: N/A; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.289,"smiles":null,"spectrum_id":"CCMSLIB00017251616","spectrum_index":22594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxybenzoate (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017251618","spectrum_index":22595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087703 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 215.0428 Da; putative annotation: N/A; putative formula: C8H9NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.108,"smiles":null,"spectrum_id":"CCMSLIB00017251620","spectrum_index":22596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 82.0782 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.331,"smiles":null,"spectrum_id":"CCMSLIB00017251623","spectrum_index":22597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 52.0412 Da; putative annotation: N/A; putative formula: C3H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017251624","spectrum_index":22598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 35.0796 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.175,"smiles":null,"spectrum_id":"CCMSLIB00017251627","spectrum_index":22599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,10-Dihydroxy-12Z-octadecenoic acid from NIST14 (delta mass: 118.0786 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017251630","spectrum_index":22600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 84.0579 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.16,"smiles":null,"spectrum_id":"CCMSLIB00017251631","spectrum_index":22601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Vaccenic acid (delta mass: 50.0523 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.315,"smiles":null,"spectrum_id":"CCMSLIB00017251634","spectrum_index":22602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7-Triazacyclononane (delta mass: 22.9937 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.128,"smiles":null,"spectrum_id":"CCMSLIB00017251635","spectrum_index":22603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 76.8864 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.957,"smiles":null,"spectrum_id":"CCMSLIB00017251638","spectrum_index":22604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 44.9441 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.046,"smiles":null,"spectrum_id":"CCMSLIB00017251640","spectrum_index":22605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Phenylisoxazol-3-ol (delta mass: 88.0309 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.086,"smiles":null,"spectrum_id":"CCMSLIB00017251642","spectrum_index":22606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 334.2269 Da; putative annotation: N/A; putative formula: C20H26N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.313,"smiles":null,"spectrum_id":"CCMSLIB00017251645","spectrum_index":22607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-amino-4-methylbenzoate (delta mass: 173.047 Da; putative annotation: N/A; putative formula: C4H8N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.133,"smiles":null,"spectrum_id":"CCMSLIB00017251646","spectrum_index":22608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]- (delta mass: 41.0199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.212,"smiles":null,"spectrum_id":"CCMSLIB00017251649","spectrum_index":22609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 45.9143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.99,"smiles":null,"spectrum_id":"CCMSLIB00017251652","spectrum_index":22610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 255.2927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.561,"smiles":null,"spectrum_id":"CCMSLIB00017251653","spectrum_index":22611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxybenzene-1,2-dicarboxylic acid (delta mass: 60.0216 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.045,"smiles":null,"spectrum_id":"CCMSLIB00017251656","spectrum_index":22612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 11.9999 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.185,"smiles":null,"spectrum_id":"CCMSLIB00017251657","spectrum_index":22613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis-5,8,11,14-Eicosatetraenoic acid from NIST14 (delta mass: 19.0125 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.26,"smiles":null,"spectrum_id":"CCMSLIB00017251660","spectrum_index":22614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentisic acid (delta mass: 81.0432 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.077,"smiles":null,"spectrum_id":"CCMSLIB00017251663","spectrum_index":22615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methoxycarbonyl)but-3-enoic acid (delta mass: 112.1256 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.175,"smiles":null,"spectrum_id":"CCMSLIB00017251664","spectrum_index":22616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 157.9993 Da; putative annotation: N/A; putative formula: C3H3N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.081,"smiles":null,"spectrum_id":"CCMSLIB00017251667","spectrum_index":22617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 891.6295 Da; putative annotation: N/A; putative formula: C48H85N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1275.78,"smiles":null,"spectrum_id":"CCMSLIB00017251668","spectrum_index":22618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 202.1318 Da; putative annotation: N/A; putative formula: C9H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.192,"smiles":null,"spectrum_id":"CCMSLIB00017251671","spectrum_index":22619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 274.1528 Da; putative annotation: N/A; putative formula: C12H22N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.224,"smiles":null,"spectrum_id":"CCMSLIB00017251672","spectrum_index":22620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP008202 Glycohyodeoxycholic acid|SCHEMBL1654508|2-[4-(3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid (delta mass: 901.6397 Da; putative annotation: N/A; putative formula: C52H83N7O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1351.96,"smiles":null,"spectrum_id":"CCMSLIB00017251675","spectrum_index":22621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 85.0795 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.208,"smiles":null,"spectrum_id":"CCMSLIB00017251678","spectrum_index":22622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthalenepentanoic acid, 3,4,4a,5,6,7,8,8a-octahydro-.beta.,2,5,5,8a-pentamethyl-3-oxo-, (8aS)- (delta mass: 64.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.295,"smiles":null,"spectrum_id":"CCMSLIB00017251679","spectrum_index":22623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 226.116 Da; putative annotation: N/A; putative formula: C11H20N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.252,"smiles":null,"spectrum_id":"CCMSLIB00017251682","spectrum_index":22624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 492.2925 Da; putative annotation: N/A; putative formula: C29H40N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.331,"smiles":null,"spectrum_id":"CCMSLIB00017251683","spectrum_index":22625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C18:3 (delta mass: 556.4855 Da; putative annotation: N/A; putative formula: C37H64O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":892.739,"smiles":null,"spectrum_id":"CCMSLIB00017251686","spectrum_index":22626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 114.0568 Da; putative annotation: N/A; putative formula: C8H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.175,"smiles":null,"spectrum_id":"CCMSLIB00017251687","spectrum_index":22627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Piperidinyl)acetamide (delta mass: 10.932 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.05,"smiles":null,"spectrum_id":"CCMSLIB00017251690","spectrum_index":22628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 27-(Acetyloxy)-3-hydroxylup-20(29)-en-28-oic acid (delta mass: 122.1101 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.483,"smiles":null,"spectrum_id":"CCMSLIB00017251693","spectrum_index":22629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 264.2453 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.327,"smiles":null,"spectrum_id":"CCMSLIB00017251694","spectrum_index":22630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline [M+H-H2O]+; AIF; CE0; CorrDec (delta mass: 112.1015 Da; putative annotation: N/A; putative formula: C6H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.198,"smiles":null,"spectrum_id":"CCMSLIB00017251697","spectrum_index":22631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 158.042 Da; putative annotation: N/A; putative formula: C7H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.176,"smiles":null,"spectrum_id":"CCMSLIB00017251698","spectrum_index":22632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.3,"smiles":null,"spectrum_id":"CCMSLIB00017251701","spectrum_index":22633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Swainsonine (delta mass: 118.0266 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017251704","spectrum_index":22634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 210.1994 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.307,"smiles":null,"spectrum_id":"CCMSLIB00017251705","spectrum_index":22635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Steviol (delta mass: 78.0826 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.309,"smiles":null,"spectrum_id":"CCMSLIB00017251708","spectrum_index":22636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 359.2682 Da; putative annotation: N/A; putative formula: C20H41NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.505,"smiles":null,"spectrum_id":"CCMSLIB00017251709","spectrum_index":22637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Hydroxyhexadecanoic acid CollisionEnergy:205060 (delta mass: 54.0462 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.289,"smiles":null,"spectrum_id":"CCMSLIB00017251712","spectrum_index":22638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dilinolenoyl-sn-glycero-3-phosphoethanolamine (delta mass: 94.0698 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.561,"smiles":null,"spectrum_id":"CCMSLIB00017251715","spectrum_index":22639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylserotonin - 30.0 eV (delta mass: 120.0421 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.155,"smiles":null,"spectrum_id":"CCMSLIB00017251716","spectrum_index":22640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017251719","spectrum_index":22641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 502.1678 Da; putative annotation: N/A; putative formula: C20H34N6OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.239,"smiles":null,"spectrum_id":"CCMSLIB00017251720","spectrum_index":22642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-(3-methyl-2-butenyl)benzaldehyde (delta mass: 166.0264 Da; putative annotation: N/A; putative formula: C8H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017251723","spectrum_index":22643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rasfonin (delta mass: 66.0456 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.32,"smiles":null,"spectrum_id":"CCMSLIB00017251726","spectrum_index":22644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 207.1477 Da; putative annotation: N/A; putative formula: C10H17N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.369,"smiles":null,"spectrum_id":"CCMSLIB00017251727","spectrum_index":22645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 128.0473 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017251730","spectrum_index":22646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 15.0693 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.145,"smiles":null,"spectrum_id":"CCMSLIB00017251731","spectrum_index":22647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNITOL - 60.0 eV (delta mass: 40.0315 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.118,"smiles":null,"spectrum_id":"CCMSLIB00017251734","spectrum_index":22648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 162.0682 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.238,"smiles":null,"spectrum_id":"CCMSLIB00017251737","spectrum_index":22649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 272.2714 Da; putative annotation: N/A; putative formula: C13H32N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.347,"smiles":null,"spectrum_id":"CCMSLIB00017251738","spectrum_index":22650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 108.0388 Da; putative annotation: N/A; putative formula: C7H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017251741","spectrum_index":22651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyacetophenone (delta mass: 73.0505 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.11,"smiles":null,"spectrum_id":"CCMSLIB00017251742","spectrum_index":22652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-11-Methyl-2-dodecenoic acid (delta mass: 98.0722 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.257,"smiles":null,"spectrum_id":"CCMSLIB00017251745","spectrum_index":22653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 843.334 Da; putative annotation: N/A; putative formula: C44H45N9O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1065.43,"smiles":null,"spectrum_id":"CCMSLIB00017251748","spectrum_index":22654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 62.0523 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017251749","spectrum_index":22655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5S,6R)-2-[[(3S,6S,8R,10R,12R,13R,14R,17S)-3,12-dihydroxy-4,4,8,10,14-pentamethyl-17-[(2S)-6-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhept-5-en-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 120.0906 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":921.59,"smiles":null,"spectrum_id":"CCMSLIB00017251752","spectrum_index":22656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Di(2-naphthyl)amine (delta mass: 68.0562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.184,"smiles":null,"spectrum_id":"CCMSLIB00017251753","spectrum_index":22657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 163.1208 Da; putative annotation: N/A; putative formula: C8H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.196,"smiles":null,"spectrum_id":"CCMSLIB00017251756","spectrum_index":22658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Hydroxy-4Z,7Z,10Z,14E,16Z,19Z-docosahexaenoic acid (delta mass: 72.0355 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.278,"smiles":null,"spectrum_id":"CCMSLIB00017251757","spectrum_index":22659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 64.055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017251760","spectrum_index":22660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 19.0287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.167,"smiles":null,"spectrum_id":"CCMSLIB00017251761","spectrum_index":22661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tetradecanoylhomoserine (delta mass: 315.2417 Da; putative annotation: N/A; putative formula: C18H37NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.506,"smiles":null,"spectrum_id":"CCMSLIB00017251764","spectrum_index":22662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 724.575 Da; putative annotation: N/A; putative formula: C45H76N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.656,"smiles":null,"spectrum_id":"CCMSLIB00017251766","spectrum_index":22663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 134.06 Da; putative annotation: N/A; putative formula: C6H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.12,"smiles":null,"spectrum_id":"CCMSLIB00017251768","spectrum_index":22664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclopropylacetic acid (delta mass: 161.0686 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017251771","spectrum_index":22665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 14.04 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.111,"smiles":null,"spectrum_id":"CCMSLIB00017251772","spectrum_index":22666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 194.0688 Da; putative annotation: N/A; putative formula: C9H10N2O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.129,"smiles":null,"spectrum_id":"CCMSLIB00017251775","spectrum_index":22667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 477.205 Da; putative annotation: N/A; putative formula: C30H27N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.276,"smiles":null,"spectrum_id":"CCMSLIB00017251776","spectrum_index":22668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (cis+trans)-Nerodilol (delta mass: 62.0517 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.257,"smiles":null,"spectrum_id":"CCMSLIB00017251779","spectrum_index":22669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Diazaspiro[4.6]undecane-2,4-dione (delta mass: 86.0366 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.149,"smiles":null,"spectrum_id":"CCMSLIB00017251780","spectrum_index":22670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 147.0892 Da; putative annotation: N/A; putative formula: C6H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.165,"smiles":null,"spectrum_id":"CCMSLIB00017251783","spectrum_index":22671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 26,27-Dinorcholest-5-en-24-yne-3,20-diol, (3.beta.)- (delta mass: 48.037 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.332,"smiles":null,"spectrum_id":"CCMSLIB00017251785","spectrum_index":22672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 212.1677 Da; putative annotation: N/A; putative formula: C15H20N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.291,"smiles":null,"spectrum_id":"CCMSLIB00017251787","spectrum_index":22673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 44.043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.13,"smiles":null,"spectrum_id":"CCMSLIB00017251790","spectrum_index":22674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 9.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.138,"smiles":null,"spectrum_id":"CCMSLIB00017251791","spectrum_index":22675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 68.0259 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.221,"smiles":null,"spectrum_id":"CCMSLIB00017251794","spectrum_index":22676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 62.0523 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.321,"smiles":null,"spectrum_id":"CCMSLIB00017251795","spectrum_index":22677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 212.0335 Da; putative annotation: N/A; putative formula: C10H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.094,"smiles":null,"spectrum_id":"CCMSLIB00017251798","spectrum_index":22678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 133.1104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.358,"smiles":null,"spectrum_id":"CCMSLIB00017251800","spectrum_index":22679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-C18:3 (delta mass: 552.4541 Da; putative annotation: N/A; putative formula: C37H60O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.707,"smiles":null,"spectrum_id":"CCMSLIB00017251802","spectrum_index":22680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 88.0742 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.17,"smiles":null,"spectrum_id":"CCMSLIB00017251805","spectrum_index":22681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-hydroxybut-3-en-2-yl)-3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran-4,5-diol (delta mass: 102.0835 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017251808","spectrum_index":22682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 41.0482 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.113,"smiles":null,"spectrum_id":"CCMSLIB00017251809","spectrum_index":22683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 73.0202 Da; putative annotation: N/A; putative formula: CH4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.086,"smiles":null,"spectrum_id":"CCMSLIB00017251812","spectrum_index":22684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 59.0365 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017251813","spectrum_index":22685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 31.9211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.007,"smiles":null,"spectrum_id":"CCMSLIB00017251816","spectrum_index":22686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxybenzoic acid (delta mass: 192.042 Da; putative annotation: N/A; putative formula: C10H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.107,"smiles":null,"spectrum_id":"CCMSLIB00017251818","spectrum_index":22687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybenzoic acid (delta mass: 84.0212 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.06,"smiles":null,"spectrum_id":"CCMSLIB00017251820","spectrum_index":22688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 94.0417 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.112,"smiles":null,"spectrum_id":"CCMSLIB00017251823","spectrum_index":22689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 188.2827 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.353,"smiles":null,"spectrum_id":"CCMSLIB00017251824","spectrum_index":22690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 91.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.301,"smiles":null,"spectrum_id":"CCMSLIB00017251827","spectrum_index":22691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 52.0343 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.256,"smiles":null,"spectrum_id":"CCMSLIB00017251830","spectrum_index":22692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 322.0449 Da; putative annotation: N/A; putative formula: C14H6N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.126,"smiles":null,"spectrum_id":"CCMSLIB00017251831","spectrum_index":22693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19,20-Dihydroxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid (delta mass: 98.0742 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.327,"smiles":null,"spectrum_id":"CCMSLIB00017251834","spectrum_index":22694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 193.0687 Da; putative annotation: N/A; putative formula: C2H3N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.166,"smiles":null,"spectrum_id":"CCMSLIB00017251835","spectrum_index":22695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSAMINE (delta mass: 574.4713 Da; putative annotation: N/A; putative formula: C35H62N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.558,"smiles":null,"spectrum_id":"CCMSLIB00017251838","spectrum_index":22696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 110.1143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.196,"smiles":null,"spectrum_id":"CCMSLIB00017251839","spectrum_index":22697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Hydroxy-5-cholenoic acid (delta mass: 72.0407 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.33,"smiles":null,"spectrum_id":"CCMSLIB00017251842","spectrum_index":22698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 224.2519 Da; putative annotation: N/A; putative formula: C16H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.329,"smiles":null,"spectrum_id":"CCMSLIB00017251844","spectrum_index":22699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine (delta mass: 25.0035 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.106,"smiles":null,"spectrum_id":"CCMSLIB00017251846","spectrum_index":22700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis,cis-9,12-Octadecadien-1-ol (delta mass: 110.1093 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.378,"smiles":null,"spectrum_id":"CCMSLIB00017251849","spectrum_index":22701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[3-[3-Hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxyphenyl]-5-oxo-2H-furan-2-yl]acetic acid (delta mass: 206.0643 Da; putative annotation: N/A; putative formula: C7H15N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.172,"smiles":null,"spectrum_id":"CCMSLIB00017251850","spectrum_index":22702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzocain (delta mass: 130.063 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.149,"smiles":null,"spectrum_id":"CCMSLIB00017251853","spectrum_index":22703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 35.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.186,"smiles":null,"spectrum_id":"CCMSLIB00017251855","spectrum_index":22704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Morpholinyl)-1-phenylethanol (delta mass: 90.0469 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.18,"smiles":null,"spectrum_id":"CCMSLIB00017251857","spectrum_index":22705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 9.0206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.096,"smiles":null,"spectrum_id":"CCMSLIB00017251860","spectrum_index":22706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10-2 (delta mass: 77.0483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.296,"smiles":null,"spectrum_id":"CCMSLIB00017251862","spectrum_index":22707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopiperidine-2,6-dione (delta mass: 143.103 Da; putative annotation: N/A; putative formula: C2H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.169,"smiles":null,"spectrum_id":"CCMSLIB00017251864","spectrum_index":22708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 166.121 Da; putative annotation: N/A; putative formula: C8H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.176,"smiles":null,"spectrum_id":"CCMSLIB00017251866","spectrum_index":22709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5,8,11,14,17-Eicosapentaenoic acid (delta mass: 120.0426 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.275,"smiles":null,"spectrum_id":"CCMSLIB00017251868","spectrum_index":22710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 141.9952 Da; putative annotation: N/A; putative formula: C3H2N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.076,"smiles":null,"spectrum_id":"CCMSLIB00017251870","spectrum_index":22711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gibepyrone D (delta mass: 38.0522 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017251872","spectrum_index":22712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 136.1599 Da; putative annotation: N/A; putative formula: C11H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.225,"smiles":null,"spectrum_id":"CCMSLIB00017251875","spectrum_index":22713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 101.9482 Da; putative annotation: N/A; putative formula: H-2N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.125,"smiles":null,"spectrum_id":"CCMSLIB00017251876","spectrum_index":22714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 56.0075 Da; putative annotation: N/A; putative formula: C3H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.109,"smiles":null,"spectrum_id":"CCMSLIB00017251879","spectrum_index":22715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 102.0309 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.122,"smiles":null,"spectrum_id":"CCMSLIB00017251882","spectrum_index":22716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00179862-03_C20H32O2_1-Naphthalenecarboxaldehyde, decahydro-5-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-1,4a-dimethyl-6-methylene-, (1R,4aR,5S)- (delta mass: 139.0481 Da; putative annotation: N/A; putative formula: C4H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.296,"smiles":null,"spectrum_id":"CCMSLIB00017251883","spectrum_index":22717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 90.0092 Da; putative annotation: N/A; putative formula: H3N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.098,"smiles":null,"spectrum_id":"CCMSLIB00017251886","spectrum_index":22718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 221.0685 Da; putative annotation: N/A; putative formula: C11H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.15,"smiles":null,"spectrum_id":"CCMSLIB00017251887","spectrum_index":22719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 149.0477 Da; putative annotation: Pyridoxal [M+H-H2O]+; AIF; CE0; MS2Dec; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.139,"smiles":null,"spectrum_id":"CCMSLIB00017251890","spectrum_index":22720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Lys (delta mass: 128.0956 Da; putative annotation: Massbank:PR100167 L-Lysine|Lys|(S)-2,6-Diaminohexanoic acid|Lysine acid|L-(+)-Lysine; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.261,"smiles":null,"spectrum_id":"CCMSLIB00017251892","spectrum_index":22721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 184.1212 Da; putative annotation: .beta.-Alanylleucine; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.276,"smiles":null,"spectrum_id":"CCMSLIB00017251894","spectrum_index":22722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 242.1279 Da; putative annotation: Leu-Glu; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.272,"smiles":null,"spectrum_id":"CCMSLIB00017251897","spectrum_index":22723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 126.0458 Da; putative annotation: 2-Naphthol; putative formula: C10H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.163,"smiles":null,"spectrum_id":"CCMSLIB00017251898","spectrum_index":22724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 132.0421 Da; putative annotation: D-Ribose; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.102,"smiles":null,"spectrum_id":"CCMSLIB00017251901","spectrum_index":22725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Curcumol from NIST14 (delta mass: 204.1879 Da; putative annotation: Patchouli alcohol; putative formula: C15H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.373,"smiles":null,"spectrum_id":"CCMSLIB00017251903","spectrum_index":22726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 14(15)-EpETE from NIST14 (delta mass: 318.2194 Da; putative annotation: (Z)-5-[(1S,2R,4aR,8aR)-5-(hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-(hydroxymethyl)pent-2-enoic acid; putative formula: C20H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.446,"smiles":null,"spectrum_id":"CCMSLIB00017251905","spectrum_index":22727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 186.0887 Da; putative annotation: Pentanedioic acid, 2-hydroxy, 1,5-diethyl ester; putative formula: C9H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.164,"smiles":null,"spectrum_id":"CCMSLIB00017251908","spectrum_index":22728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 236.1791 Da; putative annotation: Uvidin C; putative formula: C15H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.437,"smiles":null,"spectrum_id":"CCMSLIB00017251909","spectrum_index":22729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brefeldin A (delta mass: 206.1306 Da; putative annotation: 4-Hydroxy-4-[(E)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-2-en-1-one; putative formula: C13H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.305,"smiles":null,"spectrum_id":"CCMSLIB00017251912","spectrum_index":22730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dilinolenin (9c,12c,15c) (delta mass: 302.2207 Da; putative annotation: (3S)-5-[(1S,8aR)-2,5,5,8a-tetramethyl-4-oxo-4a,6,7,8-tetrahydro-1H-naphthalen-1-yl]-3-methylpentanoic acid; putative formula: C20H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.703,"smiles":null,"spectrum_id":"CCMSLIB00017251914","spectrum_index":22731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 313.1676 Da; putative annotation: N-Acetylleucylalanylserine; putative formula: C14H23N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.343,"smiles":null,"spectrum_id":"CCMSLIB00017251916","spectrum_index":22732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 119.0372 Da; putative annotation: 2-AMINOBENZOIC ACID; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.161,"smiles":null,"spectrum_id":"CCMSLIB00017251919","spectrum_index":22733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 131.0938 Da; putative annotation: Triethanolamine; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.16,"smiles":null,"spectrum_id":"CCMSLIB00017251921","spectrum_index":22734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 162.0509 Da; putative annotation: MYO-INOSITOL; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.088,"smiles":null,"spectrum_id":"CCMSLIB00017251923","spectrum_index":22735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 910.4994 Da; putative annotation: Bacoside A3; putative formula: C47H74O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1091.57,"smiles":null,"spectrum_id":"CCMSLIB00017251926","spectrum_index":22736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 75.0473 Da; putative annotation: Aniline; AIF; CE30; CorrDec; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.149,"smiles":null,"spectrum_id":"CCMSLIB00017251928","spectrum_index":22737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 147.0684 Da; putative annotation: [4-(Methylamino)phenyl]acetic acid; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.149,"smiles":null,"spectrum_id":"CCMSLIB00017251930","spectrum_index":22738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 104.0263 Da; putative annotation: Benzoic acid; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.092,"smiles":null,"spectrum_id":"CCMSLIB00017251933","spectrum_index":22739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycerol (delta mass: 283.2847 Da; putative annotation: D-erythro-Sphinganine; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":904.83,"smiles":null,"spectrum_id":"CCMSLIB00017251934","spectrum_index":22740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 226.1206 Da; putative annotation: NCGC00381255-01!8-hydroxy-3-methoxycarbonyl-2-methylidenenonanoic acid; putative formula: C12H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017251937","spectrum_index":22741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 466.2769 Da; putative annotation: [(1S,9S,13R,14R)-14-hydroxy-9-(hydroxymethyl)-5,5-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecan-14-yl]methyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate; putative formula: C29H38O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.556,"smiles":null,"spectrum_id":"CCMSLIB00017251939","spectrum_index":22742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 180.1141 Da; putative annotation: N/A; putative formula: C11H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.195,"smiles":null,"spectrum_id":"CCMSLIB00017251941","spectrum_index":22743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gallic acid (delta mass: 106.0781 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017251944","spectrum_index":22744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 156.1091 Da; putative annotation: N/A; putative formula: C8H16N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.19,"smiles":null,"spectrum_id":"CCMSLIB00017251945","spectrum_index":22745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mer-N5075-A_35716_dereplictor_pv_5.17819e-12 (delta mass: 597.3339 Da; putative annotation: N/A; putative formula: C31H51NO8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1195.67,"smiles":null,"spectrum_id":"CCMSLIB00017251948","spectrum_index":22746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthro[3,2-b]furan-9(1H)-one, 2,3,4,4a,5,6,6a,7,10a,11,11a,11b-dodecahydro-6,10a-dihydroxy-4-(hydroxymethyl)-4,7,11b-trimethyl- (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.264,"smiles":null,"spectrum_id":"CCMSLIB00017251951","spectrum_index":22747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP026502 5?-CHOLANIC ACID-3?_ 12?-DIOL-7-ONE|7-Ketodeoxycholic acid|(4R)-4-[(3R,5S,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]ph (delta mass: 33.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.3,"smiles":null,"spectrum_id":"CCMSLIB00017251952","spectrum_index":22748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[(1E,3E)-Hepta-1,3-dienyl]pentanedioic acid (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.143,"smiles":null,"spectrum_id":"CCMSLIB00017251955","spectrum_index":22749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 117.0423 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.124,"smiles":null,"spectrum_id":"CCMSLIB00017251956","spectrum_index":22750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dimyristoyl-sn-glycero-3-phosphoethanolamine (delta mass: 80.062 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.522,"smiles":null,"spectrum_id":"CCMSLIB00017251959","spectrum_index":22751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Val (delta mass: 230.1618 Da; putative annotation: N/A; putative formula: C13H27O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.332,"smiles":null,"spectrum_id":"CCMSLIB00017251961","spectrum_index":22752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Hydroxyethyl)-4-(2-hydroxypropyl)-2H-furan-5-one (delta mass: 106.0635 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.16,"smiles":null,"spectrum_id":"CCMSLIB00017251963","spectrum_index":22753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15(R)-Methylprostaglandin A2 (delta mass: 123.0697 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.307,"smiles":null,"spectrum_id":"CCMSLIB00017251966","spectrum_index":22754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Ketodeoxycholic acid (delta mass: 191.1216 Da; putative annotation: N/A; putative formula: C12H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.406,"smiles":null,"spectrum_id":"CCMSLIB00017251969","spectrum_index":22755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU228201 10,11-Dihydro-10-Hydroxycarbazepine|Licarbazepine|5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 44.0085 Da; putative annotation: N/A; putative formula: C2H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.121,"smiles":null,"spectrum_id":"CCMSLIB00017251971","spectrum_index":22756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYBENZALDEHYDE (delta mass: 228.0428 Da; putative annotation: N/A; putative formula: C6H8N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.087,"smiles":null,"spectrum_id":"CCMSLIB00017251973","spectrum_index":22757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenol (delta mass: 190.1709 Da; putative annotation: N/A; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.241,"smiles":null,"spectrum_id":"CCMSLIB00017251976","spectrum_index":22758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 53.0471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017251978","spectrum_index":22759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-hydroxy-3,5-dimethoxybenzoate (delta mass: 93.0792 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.155,"smiles":null,"spectrum_id":"CCMSLIB00017251980","spectrum_index":22760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,7,10,13,16,19-Docosahexaenoic acid (delta mass: 671.3503 Da; putative annotation: N/A; putative formula: C30H45N11O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1000.6,"smiles":null,"spectrum_id":"CCMSLIB00017251983","spectrum_index":22761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ilicic acid (delta mass: 64.0702 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.25,"smiles":null,"spectrum_id":"CCMSLIB00017251985","spectrum_index":22762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxybenzoic acid (delta mass: 138.0679 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017251987","spectrum_index":22763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Adamantyl)pyrrolidine (delta mass: 62.0548 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.245,"smiles":null,"spectrum_id":"CCMSLIB00017251990","spectrum_index":22764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylene-5.alpha.-androstan-3.alpha.-ol-17-one (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.279,"smiles":null,"spectrum_id":"CCMSLIB00017251992","spectrum_index":22765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clusiacitran A (delta mass: 565.7329 Da; putative annotation: N/A; putative formula: C3H4O17P2S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.908,"smiles":null,"spectrum_id":"CCMSLIB00017251994","spectrum_index":22766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 87.001 Da; putative annotation: N/A; putative formula: HN5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.056,"smiles":null,"spectrum_id":"CCMSLIB00017251997","spectrum_index":22767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:102040 (delta mass: 144.0773 Da; putative annotation: N/A; putative formula: C3H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.158,"smiles":null,"spectrum_id":"CCMSLIB00017251998","spectrum_index":22768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,12-Tricosadiynoic acid (delta mass: 64.0502 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.345,"smiles":null,"spectrum_id":"CCMSLIB00017252001","spectrum_index":22769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 114.0319 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.124,"smiles":null,"spectrum_id":"CCMSLIB00017252003","spectrum_index":22770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5Z,8Z,14Z-Eicosatrienoic acid (delta mass: 297.271 Da; putative annotation: N/A; putative formula: C17H36N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.534,"smiles":null,"spectrum_id":"CCMSLIB00017252005","spectrum_index":22771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 88.0664 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.137,"smiles":null,"spectrum_id":"CCMSLIB00017252008","spectrum_index":22772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isomaltose (delta mass: 71.0741 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.198,"smiles":null,"spectrum_id":"CCMSLIB00017252009","spectrum_index":22773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 154.1204 Da; putative annotation: N/A; putative formula: C7H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.263,"smiles":null,"spectrum_id":"CCMSLIB00017252011","spectrum_index":22774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 418.1636 Da; putative annotation: N/A; putative formula: C23H30O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.25,"smiles":null,"spectrum_id":"CCMSLIB00017252013","spectrum_index":22775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 263.1738 Da; putative annotation: N/A; putative formula: C12H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.234,"smiles":null,"spectrum_id":"CCMSLIB00017252016","spectrum_index":22776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 86.0516 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.102,"smiles":null,"spectrum_id":"CCMSLIB00017252018","spectrum_index":22777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 104.0588 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.28,"smiles":null,"spectrum_id":"CCMSLIB00017252020","spectrum_index":22778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 162.1646 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.243,"smiles":null,"spectrum_id":"CCMSLIB00017252023","spectrum_index":22779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 472.3399 Da; putative annotation: N/A; putative formula: C26H48O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.411,"smiles":null,"spectrum_id":"CCMSLIB00017252025","spectrum_index":22780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 156.0779 Da; putative annotation: N/A; putative formula: C8H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.123,"smiles":null,"spectrum_id":"CCMSLIB00017252027","spectrum_index":22781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kahweol (delta mass: 111.068 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.263,"smiles":null,"spectrum_id":"CCMSLIB00017252030","spectrum_index":22782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10'-hydroxy-11'-methoxy-5'-methyl-5'-azaspiro[cyclohexane-1,2'-tricyclo[6.3.1.0?,]dodecane]-1'(12'),2,5,8',10'-pentaen-4-one (delta mass: 173.3562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.5,"smiles":null,"spectrum_id":"CCMSLIB00017252031","spectrum_index":22783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 82.0987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.185,"smiles":null,"spectrum_id":"CCMSLIB00017252034","spectrum_index":22784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9,12-Octadecadiynoic Acid from NIST14 (delta mass: 645.5392 Da; putative annotation: N/A; putative formula: C46H67N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.755,"smiles":null,"spectrum_id":"CCMSLIB00017252035","spectrum_index":22785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 67.0422 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.108,"smiles":null,"spectrum_id":"CCMSLIB00017252038","spectrum_index":22786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 94.0782 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017252039","spectrum_index":22787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9S,11R-Epidioxy-15S-hydroxy-13E-prostaenoic acid from NIST14 (delta mass: 124.7521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.0,"smiles":null,"spectrum_id":"CCMSLIB00017252042","spectrum_index":22788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethylhydroquinone (delta mass: 77.026 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.101,"smiles":null,"spectrum_id":"CCMSLIB00017252044","spectrum_index":22789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 311.1371 Da; putative annotation: N/A; putative formula: C15H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.234,"smiles":null,"spectrum_id":"CCMSLIB00017252046","spectrum_index":22790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxylanosta-8,24-dien-21-oic acid (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.42,"smiles":null,"spectrum_id":"CCMSLIB00017252049","spectrum_index":22791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 39.0553 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.12,"smiles":null,"spectrum_id":"CCMSLIB00017252051","spectrum_index":22792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pinanethromboxane A2 (delta mass: 88.0661 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.371,"smiles":null,"spectrum_id":"CCMSLIB00017252053","spectrum_index":22793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 280.1826 Da; putative annotation: N/A; putative formula: C20H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.378,"smiles":null,"spectrum_id":"CCMSLIB00017252056","spectrum_index":22794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 17.038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.089,"smiles":null,"spectrum_id":"CCMSLIB00017252058","spectrum_index":22795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 34.0076 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.067,"smiles":null,"spectrum_id":"CCMSLIB00017252060","spectrum_index":22796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 433.1768 Da; putative annotation: N/A; putative formula: C21H28N3O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.258,"smiles":null,"spectrum_id":"CCMSLIB00017252063","spectrum_index":22797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cortodoxone (delta mass: 276.0845 Da; putative annotation: N/A; putative formula: C11H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.306,"smiles":null,"spectrum_id":"CCMSLIB00017252065","spectrum_index":22798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anemosapogenin (delta mass: 128.0475 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.41,"smiles":null,"spectrum_id":"CCMSLIB00017252066","spectrum_index":22799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 200.0078 Da; putative annotation: N/A; putative formula: C7H8N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.105,"smiles":null,"spectrum_id":"CCMSLIB00017252069","spectrum_index":22800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 113.0837 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.207,"smiles":null,"spectrum_id":"CCMSLIB00017252072","spectrum_index":22801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Misoprostol (free acid) (delta mass: 106.0781 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.342,"smiles":null,"spectrum_id":"CCMSLIB00017252073","spectrum_index":22802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2-Dimethyl-4-pentenoic acid (delta mass: 291.2043 Da; putative annotation: N/A; putative formula: C14H29NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.295,"smiles":null,"spectrum_id":"CCMSLIB00017252076","spectrum_index":22803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrocortisone (delta mass: 126.0827 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.299,"smiles":null,"spectrum_id":"CCMSLIB00017252077","spectrum_index":22804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 13.9141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017252080","spectrum_index":22805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 112.0578 Da; putative annotation: N/A; putative formula: C5H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.18,"smiles":null,"spectrum_id":"CCMSLIB00017252082","spectrum_index":22806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8(9)-Epoxy-5Z,11Z,14Z-eicosatrienoic acid (delta mass: 350.3305 Da; putative annotation: N/A; putative formula: C22H42N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.573,"smiles":null,"spectrum_id":"CCMSLIB00017252084","spectrum_index":22807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-palmitoyl-D-erythro-sphinganine (delta mass: 260.2137 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.749,"smiles":null,"spectrum_id":"CCMSLIB00017252087","spectrum_index":22808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-O-rhamnosyl-swertisin (delta mass: 592.1702 Da; putative annotation: N/A; putative formula: C31H32N2O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1185.36,"smiles":null,"spectrum_id":"CCMSLIB00017252089","spectrum_index":22809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 247.1581 Da; putative annotation: N/A; putative formula: C15H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.208,"smiles":null,"spectrum_id":"CCMSLIB00017252091","spectrum_index":22810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 97.0533 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.14,"smiles":null,"spectrum_id":"CCMSLIB00017252094","spectrum_index":22811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Aminobenzyl)phenylamine (delta mass: 34.0304 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.153,"smiles":null,"spectrum_id":"CCMSLIB00017252096","spectrum_index":22812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 170.0936 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.158,"smiles":null,"spectrum_id":"CCMSLIB00017252099","spectrum_index":22813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 84.0198 Da; putative annotation: N/A; putative formula: N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.257,"smiles":null,"spectrum_id":"CCMSLIB00017252101","spectrum_index":22814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxykaurenolide (delta mass: 91.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.274,"smiles":null,"spectrum_id":"CCMSLIB00017252104","spectrum_index":22815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5?-CHOLANIC ACID-3?_ 12?-DIOL-7-ONE (delta mass: 488.2467 Da; putative annotation: N/A; putative formula: C20H40O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.526,"smiles":null,"spectrum_id":"CCMSLIB00017252106","spectrum_index":22816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 228.1083 Da; putative annotation: N/A; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.231,"smiles":null,"spectrum_id":"CCMSLIB00017252108","spectrum_index":22817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 687.5273 Da; putative annotation: N/A; putative formula: C38H73NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.587,"smiles":null,"spectrum_id":"CCMSLIB00017252110","spectrum_index":22818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 57.0576 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.118,"smiles":null,"spectrum_id":"CCMSLIB00017252113","spectrum_index":22819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Ethylbenzoic acid (delta mass: 8.9764 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.052,"smiles":null,"spectrum_id":"CCMSLIB00017252115","spectrum_index":22820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 494.3242 Da; putative annotation: N/A; putative formula: C28H46O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.463,"smiles":null,"spectrum_id":"CCMSLIB00017252117","spectrum_index":22821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4a-Dimethyl-6-methylidene-5-[2-(5-oxo-2H-furan-4-yl)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (delta mass: 130.0782 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.284,"smiles":null,"spectrum_id":"CCMSLIB00017252120","spectrum_index":22822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl indole-4-carboxylate (delta mass: 78.0316 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017252121","spectrum_index":22823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linoelaidic acid (delta mass: 13.9066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017252124","spectrum_index":22824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 54.0471 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017252125","spectrum_index":22825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 12.0399 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.119,"smiles":null,"spectrum_id":"CCMSLIB00017252128","spectrum_index":22826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 59.0261 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.144,"smiles":null,"spectrum_id":"CCMSLIB00017252131","spectrum_index":22827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 68.0249 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.112,"smiles":null,"spectrum_id":"CCMSLIB00017252132","spectrum_index":22828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 471.2499 Da; putative annotation: N/A; putative formula: C22H38N3O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.31,"smiles":null,"spectrum_id":"CCMSLIB00017252135","spectrum_index":22829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desogestrel (delta mass: 92.0469 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.284,"smiles":null,"spectrum_id":"CCMSLIB00017252136","spectrum_index":22830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tripropylene glycol (delta mass: 481.3613 Da; putative annotation: N/A; putative formula: C29H47N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.505,"smiles":null,"spectrum_id":"CCMSLIB00017252139","spectrum_index":22831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 86.037 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.103,"smiles":null,"spectrum_id":"CCMSLIB00017252140","spectrum_index":22832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1,2,3,4-tetrahydroquinazolin-2-one (delta mass: 17.9834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.07,"smiles":null,"spectrum_id":"CCMSLIB00017252143","spectrum_index":22833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of QuinicAcid (delta mass: 102.0834 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017252146","spectrum_index":22834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 27.9889 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.081,"smiles":null,"spectrum_id":"CCMSLIB00017252147","spectrum_index":22835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 98.0361 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.101,"smiles":null,"spectrum_id":"CCMSLIB00017252150","spectrum_index":22836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 284.0981 Da; putative annotation: N/A; putative formula: C8H12N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.139,"smiles":null,"spectrum_id":"CCMSLIB00017252151","spectrum_index":22837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 270.2173 Da; putative annotation: N/A; putative formula: C12H26N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.277,"smiles":null,"spectrum_id":"CCMSLIB00017252154","spectrum_index":22838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 78.0309 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.096,"smiles":null,"spectrum_id":"CCMSLIB00017252155","spectrum_index":22839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine C (delta mass: 308.1539 Da; putative annotation: N/A; putative formula: C17H25O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.335,"smiles":null,"spectrum_id":"CCMSLIB00017252158","spectrum_index":22840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-11,20-dione (delta mass: 85.0379 Da; putative annotation: N/A; putative formula: CH3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.275,"smiles":null,"spectrum_id":"CCMSLIB00017252159","spectrum_index":22841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine (delta mass: 372.2626 Da; putative annotation: N/A; putative formula: C19H36N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.524,"smiles":null,"spectrum_id":"CCMSLIB00017252162","spectrum_index":22842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 152.0123 Da; putative annotation: N/A; putative formula: C8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.072,"smiles":null,"spectrum_id":"CCMSLIB00017252164","spectrum_index":22843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Madecassic acid CollisionEnergy:205060 (delta mass: 120.02 Da; putative annotation: N/A; putative formula: CH5N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.372,"smiles":null,"spectrum_id":"CCMSLIB00017252166","spectrum_index":22844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol - 30.0 eV (delta mass: 15.9776 Da; putative annotation: N/A; putative formula: O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.137,"smiles":null,"spectrum_id":"CCMSLIB00017252169","spectrum_index":22845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 106.0775 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.284,"smiles":null,"spectrum_id":"CCMSLIB00017252170","spectrum_index":22846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 329.0648 Da; putative annotation: N/A; putative formula: C15H11N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.13,"smiles":null,"spectrum_id":"CCMSLIB00017252173","spectrum_index":22847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 66.0468 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017252175","spectrum_index":22848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysanthemyl alcohol (delta mass: 125.087 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.23,"smiles":null,"spectrum_id":"CCMSLIB00017252177","spectrum_index":22849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:102040 (delta mass: 241.2345 Da; putative annotation: N/A; putative formula: C15H32NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.503,"smiles":null,"spectrum_id":"CCMSLIB00017252180","spectrum_index":22850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 42.0567 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.148,"smiles":null,"spectrum_id":"CCMSLIB00017252182","spectrum_index":22851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neoabietic acid (delta mass: 104.0627 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.295,"smiles":null,"spectrum_id":"CCMSLIB00017252184","spectrum_index":22852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Didodecyl 3,3'-thiodipropionate oxide from NIST14 - Hydroxylated variant ? (delta mass: 458.3815 Da; putative annotation: N/A; putative formula: C28H50N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":989.789,"smiles":null,"spectrum_id":"CCMSLIB00017252187","spectrum_index":22853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-6-Octadecenoic acid (delta mass: 116.0828 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.346,"smiles":null,"spectrum_id":"CCMSLIB00017252189","spectrum_index":22854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 132.086 Da; putative annotation: N/A; putative formula: CH8N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.245,"smiles":null,"spectrum_id":"CCMSLIB00017252191","spectrum_index":22855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:102040\"\" (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.139,"smiles":null,"spectrum_id":"CCMSLIB00017252194","spectrum_index":22856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .omega.-3 Arachidonic acid from NIST14 (delta mass: 64.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.3,"smiles":null,"spectrum_id":"CCMSLIB00017252196","spectrum_index":22857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 234.0305 Da; putative annotation: N/A; putative formula: C9H7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.101,"smiles":null,"spectrum_id":"CCMSLIB00017252198","spectrum_index":22858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300060 Koumidine (delta mass: 197.1192 Da; putative annotation: N/A; putative formula: C8H16N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.3,"smiles":null,"spectrum_id":"CCMSLIB00017252200","spectrum_index":22859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxy-16-methoxyoctadeca-9,12-dienoic acid (delta mass: 80.026 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.279,"smiles":null,"spectrum_id":"CCMSLIB00017252203","spectrum_index":22860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol (delta mass: 36.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.18,"smiles":null,"spectrum_id":"CCMSLIB00017252205","spectrum_index":22861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 874.6521 Da; putative annotation: N/A; putative formula: C49H90N6O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1259.82,"smiles":null,"spectrum_id":"CCMSLIB00017252207","spectrum_index":22862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Boscartol F (delta mass: 163.9341 Da; putative annotation: N/A; putative formula: C4H5O-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.15,"smiles":null,"spectrum_id":"CCMSLIB00017252210","spectrum_index":22863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 59.9723 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.08,"smiles":null,"spectrum_id":"CCMSLIB00017252211","spectrum_index":22864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 738.4501 Da; putative annotation: N/A; putative formula: C32H58N12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.547,"smiles":null,"spectrum_id":"CCMSLIB00017252214","spectrum_index":22865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 42.0579 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.139,"smiles":null,"spectrum_id":"CCMSLIB00017252216","spectrum_index":22866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 30.9932 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.091,"smiles":null,"spectrum_id":"CCMSLIB00017252218","spectrum_index":22867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 63.0325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017252221","spectrum_index":22868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-(propylthio)phenylethylamine (delta mass: 92.0077 Da; putative annotation: N/A; putative formula: C6H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.144,"smiles":null,"spectrum_id":"CCMSLIB00017252223","spectrum_index":22869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Amino-1-piperidinyl)cyclohexanol (delta mass: 226.1578 Da; putative annotation: N/A; putative formula: C14H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.338,"smiles":null,"spectrum_id":"CCMSLIB00017252225","spectrum_index":22870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-Hydroxyperhexiline (delta mass: 452.2979 Da; putative annotation: N/A; putative formula: C27H40N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.577,"smiles":null,"spectrum_id":"CCMSLIB00017252228","spectrum_index":22871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Furoyl)-4-piperidinamine (delta mass: 58.0422 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.155,"smiles":null,"spectrum_id":"CCMSLIB00017252229","spectrum_index":22872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 76.0489 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017252232","spectrum_index":22873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 46.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.098,"smiles":null,"spectrum_id":"CCMSLIB00017252233","spectrum_index":22874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 56.0616 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.111,"smiles":null,"spectrum_id":"CCMSLIB00017252236","spectrum_index":22875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 9.9486 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.071,"smiles":null,"spectrum_id":"CCMSLIB00017252238","spectrum_index":22876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 147.0691 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.208,"smiles":null,"spectrum_id":"CCMSLIB00017252240","spectrum_index":22877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alisol B acetate (delta mass: 142.1145 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.488,"smiles":null,"spectrum_id":"CCMSLIB00017252243","spectrum_index":22878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005843 Cinchonine|(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl)-quinolin-4-ylmethanol (delta mass: 193.0683 Da; putative annotation: N/A; putative formula: C2H3N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.249,"smiles":null,"spectrum_id":"CCMSLIB00017252244","spectrum_index":22879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 82.0407 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.08,"smiles":null,"spectrum_id":"CCMSLIB00017252247","spectrum_index":22880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 41.0264 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.133,"smiles":null,"spectrum_id":"CCMSLIB00017252249","spectrum_index":22881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 120.0426 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017252251","spectrum_index":22882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzoic acid (delta mass: 16.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017252254","spectrum_index":22883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycodeoxycholic acid (delta mass: 88.0606 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.382,"smiles":null,"spectrum_id":"CCMSLIB00017252255","spectrum_index":22884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 427.1712 Da; putative annotation: N/A; putative formula: C18H29N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.242,"smiles":null,"spectrum_id":"CCMSLIB00017252258","spectrum_index":22885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betulinic acid (delta mass: 261.2274 Da; putative annotation: N/A; putative formula: C6H23N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.595,"smiles":null,"spectrum_id":"CCMSLIB00017252261","spectrum_index":22886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+/-)-Cathinone (delta mass: 51.0114 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.103,"smiles":null,"spectrum_id":"CCMSLIB00017252262","spectrum_index":22887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 229.079 Da; putative annotation: N/A; putative formula: C11H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.176,"smiles":null,"spectrum_id":"CCMSLIB00017252265","spectrum_index":22888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 112.0531 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.332,"smiles":null,"spectrum_id":"CCMSLIB00017252267","spectrum_index":22889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,16-Dimethylprostaglandin D2 (delta mass: 27.0475 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.311,"smiles":null,"spectrum_id":"CCMSLIB00017252269","spectrum_index":22890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 119.058 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.227,"smiles":null,"spectrum_id":"CCMSLIB00017252272","spectrum_index":22891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-7-carboxaldehyde (delta mass: 28.9741 Da; putative annotation: N/A; putative formula: C13H18N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.034,"smiles":null,"spectrum_id":"CCMSLIB00017252273","spectrum_index":22892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 212.0688 Da; putative annotation: N/A; putative formula: C10H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017252276","spectrum_index":22893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 2.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.2,"smiles":null,"spectrum_id":"CCMSLIB00017252279","spectrum_index":22894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flavonol base + 4O, 1MeO, O-Hex (delta mass: 162.0524 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.166,"smiles":null,"spectrum_id":"CCMSLIB00017252280","spectrum_index":22895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12(13)-Epoxy-9Z-octadecenoic acid (delta mass: 49.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.295,"smiles":null,"spectrum_id":"CCMSLIB00017252283","spectrum_index":22896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-1H-indole-2-carboxamide (delta mass: 90.0528 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.171,"smiles":null,"spectrum_id":"CCMSLIB00017252284","spectrum_index":22897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 496.2586 Da; putative annotation: N/A; putative formula: C29H32N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.329,"smiles":null,"spectrum_id":"CCMSLIB00017252287","spectrum_index":22898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 404.2932 Da; putative annotation: N/A; putative formula: C18H40N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.359,"smiles":null,"spectrum_id":"CCMSLIB00017252288","spectrum_index":22899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 154.0205 Da; putative annotation: N/A; putative formula: C14H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.086,"smiles":null,"spectrum_id":"CCMSLIB00017252291","spectrum_index":22900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Hydroxy-2-methyl-6-quinolinyl)acetamide (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.108,"smiles":null,"spectrum_id":"CCMSLIB00017252294","spectrum_index":22901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 15.0112 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.15,"smiles":null,"spectrum_id":"CCMSLIB00017252295","spectrum_index":22902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Methoxyphenyl)acetic acid (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017252298","spectrum_index":22903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.beta.,17.alpha.-triol (delta mass: 128.0998 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.327,"smiles":null,"spectrum_id":"CCMSLIB00017252299","spectrum_index":22904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:205060\"\" (delta mass: 120.0324 Da; putative annotation: N/A; putative formula: C6H4N2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.124,"smiles":null,"spectrum_id":"CCMSLIB00017252302","spectrum_index":22905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 49.0029 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.975,"smiles":null,"spectrum_id":"CCMSLIB00017252303","spectrum_index":22906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 55.0231 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.078,"smiles":null,"spectrum_id":"CCMSLIB00017252306","spectrum_index":22907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 71.0407 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.132,"smiles":null,"spectrum_id":"CCMSLIB00017252307","spectrum_index":22908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Monoelaidin from NIST14 (delta mass: 418.2491 Da; putative annotation: N/A; putative formula: C22H43OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":775.549,"smiles":null,"spectrum_id":"CCMSLIB00017252310","spectrum_index":22909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3S,4S,9bR)-4-Hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione (delta mass: 161.9581 Da; putative annotation: N/A; putative formula: CH-1N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.086,"smiles":null,"spectrum_id":"CCMSLIB00017252313","spectrum_index":22910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tripropylene glycol (delta mass: 307.2357 Da; putative annotation: N/A; putative formula: C12H25N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.379,"smiles":null,"spectrum_id":"CCMSLIB00017252314","spectrum_index":22911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Oxo-10E,12Z,15Z-octadecatrienoic acid (delta mass: 132.079 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.29,"smiles":null,"spectrum_id":"CCMSLIB00017252317","spectrum_index":22912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indolmycin (delta mass: 59.0261 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.15,"smiles":null,"spectrum_id":"CCMSLIB00017252318","spectrum_index":22913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017252321","spectrum_index":22914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.107,"smiles":null,"spectrum_id":"CCMSLIB00017252323","spectrum_index":22915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 73.9955 Da; putative annotation: N/A; putative formula: CH2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.065,"smiles":null,"spectrum_id":"CCMSLIB00017252325","spectrum_index":22916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Stearidonic acid from NIST14 (delta mass: 339.3141 Da; putative annotation: N/A; putative formula: C21H41NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.53,"smiles":null,"spectrum_id":"CCMSLIB00017252328","spectrum_index":22917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lynestrenol (delta mass: 110.0581 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.279,"smiles":null,"spectrum_id":"CCMSLIB00017252330","spectrum_index":22918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Picrinine (delta mass: 174.1611 Da; putative annotation: N/A; putative formula: C6H18N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.331,"smiles":null,"spectrum_id":"CCMSLIB00017252332","spectrum_index":22919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Strobilactone A (delta mass: 78.0465 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017252335","spectrum_index":22920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 163.0852 Da; putative annotation: N/A; putative formula: C7H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.234,"smiles":null,"spectrum_id":"CCMSLIB00017252336","spectrum_index":22921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Ethylpiperazine (delta mass: 41.977 Da; putative annotation: N/A; putative formula: H-1N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.1,"smiles":null,"spectrum_id":"CCMSLIB00017252339","spectrum_index":22922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,16.alpha.,17.alpha.-triol (delta mass: 74.0516 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.278,"smiles":null,"spectrum_id":"CCMSLIB00017252340","spectrum_index":22923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 629.3433 Da; putative annotation: N/A; putative formula: C33H51N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.414,"smiles":null,"spectrum_id":"CCMSLIB00017252343","spectrum_index":22924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dihydroxybenzoic acid (delta mass: 74.0361 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.07,"smiles":null,"spectrum_id":"CCMSLIB00017252346","spectrum_index":22925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,7-dihydroxymellein_130075\"\" (delta mass: 308.092 Da; putative annotation: N/A; putative formula: C15H16O7)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.152,"smiles":null,"spectrum_id":"CCMSLIB00017252347","spectrum_index":22926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 773.327 Da; putative annotation: N/A; putative formula: C40H47N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.387,"smiles":null,"spectrum_id":"CCMSLIB00017252350","spectrum_index":22927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 650.1114 Da; putative annotation: N/A; putative formula: C34H26N4O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.172,"smiles":null,"spectrum_id":"CCMSLIB00017252352","spectrum_index":22928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 623.2583 Da; putative annotation: N/A; putative formula: C36H33N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.329,"smiles":null,"spectrum_id":"CCMSLIB00017252354","spectrum_index":22929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 99.0686 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.239,"smiles":null,"spectrum_id":"CCMSLIB00017252357","spectrum_index":22930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 36.1048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.181,"smiles":null,"spectrum_id":"CCMSLIB00017252358","spectrum_index":22931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 124.0635 Da; putative annotation: N/A; putative formula: C6H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.124,"smiles":null,"spectrum_id":"CCMSLIB00017252361","spectrum_index":22932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-6-ol, 1-(4-methoxyphenyl)-2-methyl-3-nitro- (delta mass: 180.0364 Da; putative annotation: N/A; putative formula: C16H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.139,"smiles":null,"spectrum_id":"CCMSLIB00017252364","spectrum_index":22933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 680.2197 Da; putative annotation: N/A; putative formula: C46H32O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":861.26,"smiles":null,"spectrum_id":"CCMSLIB00017252365","spectrum_index":22934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4Z)-9-Oxooctadeca-2,4-dienoic acid (delta mass: 593.5394 Da; putative annotation: N/A; putative formula: C38H67N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.766,"smiles":null,"spectrum_id":"CCMSLIB00017252368","spectrum_index":22935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ganaxolone (delta mass: 54.0462 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.325,"smiles":null,"spectrum_id":"CCMSLIB00017252369","spectrum_index":22936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 479.143 Da; putative annotation: N/A; putative formula: C17H22N9O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.203,"smiles":null,"spectrum_id":"CCMSLIB00017252372","spectrum_index":22937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[5-(Acetyloxymethyl)-1,2,4a-trimethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 130.0774 Da; putative annotation: N/A; putative formula: C4H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.325,"smiles":null,"spectrum_id":"CCMSLIB00017252374","spectrum_index":22938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 130.078 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.3,"smiles":null,"spectrum_id":"CCMSLIB00017252376","spectrum_index":22939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4E,6E)-2-(Hydroxymethyl)-3-(3-methoxy-3-oxopropyl)deca-4,6-dienoic acid (delta mass: 64.0309 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.201,"smiles":null,"spectrum_id":"CCMSLIB00017252379","spectrum_index":22940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Echinocystic acid (delta mass: 100.0706 Da; putative annotation: N/A; putative formula: C6H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.433,"smiles":null,"spectrum_id":"CCMSLIB00017252381","spectrum_index":22941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 144.0933 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.315,"smiles":null,"spectrum_id":"CCMSLIB00017252383","spectrum_index":22942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxykaurenolide (delta mass: 114.0817 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.293,"smiles":null,"spectrum_id":"CCMSLIB00017252386","spectrum_index":22943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 78.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017252388","spectrum_index":22944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311155 Vanillic acid (not validated) (delta mass: 12.0 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017252390","spectrum_index":22945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 98.0729 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.128,"smiles":null,"spectrum_id":"CCMSLIB00017252393","spectrum_index":22946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017252395","spectrum_index":22947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norisoboldine (delta mass: 138.0889 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.228,"smiles":null,"spectrum_id":"CCMSLIB00017252397","spectrum_index":22948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Picrinine (delta mass: 298.2868 Da; putative annotation: N/A; putative formula: C19H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.457,"smiles":null,"spectrum_id":"CCMSLIB00017252400","spectrum_index":22949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 70.0784 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.248,"smiles":null,"spectrum_id":"CCMSLIB00017252401","spectrum_index":22950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 96.0701 Da; putative annotation: N/A; putative formula: C5H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.141,"smiles":null,"spectrum_id":"CCMSLIB00017252404","spectrum_index":22951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrograpanin (delta mass: 103.0274 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.254,"smiles":null,"spectrum_id":"CCMSLIB00017252406","spectrum_index":22952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 27.9254 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.032,"smiles":null,"spectrum_id":"CCMSLIB00017252408","spectrum_index":22953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 15.0036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017252411","spectrum_index":22954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 176.0467 Da; putative annotation: N/A; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017252413","spectrum_index":22955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine-6-glucuronide (delta mass: 437.3241 Da; putative annotation: N/A; putative formula: C24H43N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.5,"smiles":null,"spectrum_id":"CCMSLIB00017252415","spectrum_index":22956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,19-Dihydroxy-3-cleroden-15-oic acid (delta mass: 134.0728 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.326,"smiles":null,"spectrum_id":"CCMSLIB00017252418","spectrum_index":22957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Testosterone (delta mass: 110.1091 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.325,"smiles":null,"spectrum_id":"CCMSLIB00017252421","spectrum_index":22958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 260.0451 Da; putative annotation: N/A; putative formula: C10H13O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.116,"smiles":null,"spectrum_id":"CCMSLIB00017252422","spectrum_index":22959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 428.3298 Da; putative annotation: N/A; putative formula: C29H40N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.479,"smiles":null,"spectrum_id":"CCMSLIB00017252425","spectrum_index":22960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(1H)-Pyrimidinone, 5-[3-[(1S,2S,4R)-bicyclo[2.2.1]hept-2-yloxy]-4-methoxyphenyl]tetrahydro- (delta mass: 176.029 Da; putative annotation: N/A; putative formula: C2H4N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.215,"smiles":null,"spectrum_id":"CCMSLIB00017252426","spectrum_index":22961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 230.0419 Da; putative annotation: N/A; putative formula: C13H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.227,"smiles":null,"spectrum_id":"CCMSLIB00017252429","spectrum_index":22962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Oxooctadecanoic acid (delta mass: 296.2342 Da; putative annotation: N/A; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.492,"smiles":null,"spectrum_id":"CCMSLIB00017252430","spectrum_index":22963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 727.8559 Da; putative annotation: N/A; putative formula: C28H24O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1112.01,"smiles":null,"spectrum_id":"CCMSLIB00017252433","spectrum_index":22964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE10; MS2Dec (delta mass: 105.0789 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.176,"smiles":null,"spectrum_id":"CCMSLIB00017252434","spectrum_index":22965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 164.031 Da; putative annotation: N/A; putative formula: C6H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.065,"smiles":null,"spectrum_id":"CCMSLIB00017252437","spectrum_index":22966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 133.0558 Da; putative annotation: N/A; putative formula: C5H11NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.132,"smiles":null,"spectrum_id":"CCMSLIB00017252439","spectrum_index":22967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylene glycol monomethyl ether (delta mass: 269.3078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.42,"smiles":null,"spectrum_id":"CCMSLIB00017252441","spectrum_index":22968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylene glycol monomethyl ether (delta mass: 213.2455 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.358,"smiles":null,"spectrum_id":"CCMSLIB00017252444","spectrum_index":22969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methylbenzyl)pyrrolidine (delta mass: 194.1305 Da; putative annotation: N/A; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.274,"smiles":null,"spectrum_id":"CCMSLIB00017252446","spectrum_index":22970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINOSALICYLIC ACID (delta mass: 61.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.092,"smiles":null,"spectrum_id":"CCMSLIB00017252448","spectrum_index":22971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-7,10,13,16,19-Docosapentaenoic acid (delta mass: 158.1018 Da; putative annotation: N/A; putative formula: C6H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.365,"smiles":null,"spectrum_id":"CCMSLIB00017252451","spectrum_index":22972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 267.0831 Da; putative annotation: N/A; putative formula: C15H13N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.124,"smiles":null,"spectrum_id":"CCMSLIB00017252453","spectrum_index":22973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Oxohexanoic acid (delta mass: 288.2815 Da; putative annotation: N/A; putative formula: C21H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.352,"smiles":null,"spectrum_id":"CCMSLIB00017252455","spectrum_index":22974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nandrolone (delta mass: 70.0415 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.242,"smiles":null,"spectrum_id":"CCMSLIB00017252458","spectrum_index":22975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:UA007601 Carboline|9H-Pyrido[2,3-b]indole (delta mass: 17.0248 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.101,"smiles":null,"spectrum_id":"CCMSLIB00017252460","spectrum_index":22976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of nor-Mephedrone (delta mass: 166.1718 Da; putative annotation: N/A; putative formula: C12H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.279,"smiles":null,"spectrum_id":"CCMSLIB00017252462","spectrum_index":22977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylpiperidine-2,6-dione (delta mass: 57.0102 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017252465","spectrum_index":22978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylacetylglutamine (delta mass: 156.0535 Da; putative annotation: N/A; putative formula: C6H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.172,"smiles":null,"spectrum_id":"CCMSLIB00017252467","spectrum_index":22979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.092,"smiles":null,"spectrum_id":"CCMSLIB00017252470","spectrum_index":22980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,18-Dihydroxy-3,13-clerodadien-15-oic acid (delta mass: 100.0727 Da; putative annotation: N/A; putative formula: C6H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.31,"smiles":null,"spectrum_id":"CCMSLIB00017252472","spectrum_index":22981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15.alpha.-Hydroxyculmorin (delta mass: 160.1264 Da; putative annotation: N/A; putative formula: C12H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.322,"smiles":null,"spectrum_id":"CCMSLIB00017252474","spectrum_index":22982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Hydroxyethyl)piperazin-2-one (delta mass: 9.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.134,"smiles":null,"spectrum_id":"CCMSLIB00017252477","spectrum_index":22983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Linoleoylglycerol (delta mass: 172.1452 Da; putative annotation: N/A; putative formula: C10H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.43,"smiles":null,"spectrum_id":"CCMSLIB00017252478","spectrum_index":22984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 199.0183 Da; putative annotation: N/A; putative formula: C10H5N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.11,"smiles":null,"spectrum_id":"CCMSLIB00017252481","spectrum_index":22985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 63.9969 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.062,"smiles":null,"spectrum_id":"CCMSLIB00017252483","spectrum_index":22986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine glucuronide (delta mass: 553.2629 Da; putative annotation: N/A; putative formula: C39H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1143.56,"smiles":null,"spectrum_id":"CCMSLIB00017252485","spectrum_index":22987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Keto-1-methyl-3H-imidazo[4,5-b]pyridin-6-yl)benzamide (delta mass: 18.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.171,"smiles":null,"spectrum_id":"CCMSLIB00017252488","spectrum_index":22988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 159.0419 Da; putative annotation: N/A; putative formula: C4HN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.153,"smiles":null,"spectrum_id":"CCMSLIB00017252490","spectrum_index":22989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 577.1682 Da; putative annotation: N/A; putative formula: C23H36N3O8PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":789.22,"smiles":null,"spectrum_id":"CCMSLIB00017252492","spectrum_index":22990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-4-(methoxymethyl)coumarin (delta mass: 559.2424 Da; putative annotation: N/A; putative formula: C22H37N7O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.308,"smiles":null,"spectrum_id":"CCMSLIB00017252495","spectrum_index":22991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 128.0585 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.103,"smiles":null,"spectrum_id":"CCMSLIB00017252497","spectrum_index":22992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Deoxyprostaglandin E2 (delta mass: 17.9525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.19,"smiles":null,"spectrum_id":"CCMSLIB00017252499","spectrum_index":22993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 32.0627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.16,"smiles":null,"spectrum_id":"CCMSLIB00017252502","spectrum_index":22994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 220.1207 Da; putative annotation: N/A; putative formula: C12H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.202,"smiles":null,"spectrum_id":"CCMSLIB00017252504","spectrum_index":22995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 769.8656 Da; putative annotation: N/A; putative formula: C36H19PS9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1079.98,"smiles":null,"spectrum_id":"CCMSLIB00017252506","spectrum_index":22996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 868.4364 Da; putative annotation: N/A; putative formula: C39H64N8O12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.55,"smiles":null,"spectrum_id":"CCMSLIB00017252509","spectrum_index":22997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 1078.3769 Da; putative annotation: N/A; putative formula: C63H46N14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1388.49,"smiles":null,"spectrum_id":"CCMSLIB00017252510","spectrum_index":22998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 151.0708 Da; putative annotation: N/A; putative formula: C2H9N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.204,"smiles":null,"spectrum_id":"CCMSLIB00017252513","spectrum_index":22999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of all-trans-13,14-Dihydroretinol (delta mass: 52.0317 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.284,"smiles":null,"spectrum_id":"CCMSLIB00017252515","spectrum_index":23000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 205.1312 Da; putative annotation: N/A; putative formula: C9H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.274,"smiles":null,"spectrum_id":"CCMSLIB00017252517","spectrum_index":23001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 45.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.143,"smiles":null,"spectrum_id":"CCMSLIB00017252519","spectrum_index":23002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 64.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.29,"smiles":null,"spectrum_id":"CCMSLIB00017252522","spectrum_index":23003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinamine (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.144,"smiles":null,"spectrum_id":"CCMSLIB00017252524","spectrum_index":23004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine-3-carboxylic acid (delta mass: 66.0098 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.08,"smiles":null,"spectrum_id":"CCMSLIB00017252527","spectrum_index":23005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,11(13)-Eremophiladien-12-oic acid (delta mass: 45.9875 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.157,"smiles":null,"spectrum_id":"CCMSLIB00017252528","spectrum_index":23006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxyoctadecanoic acid (delta mass: 845.7812 Da; putative annotation: N/A; putative formula: C50H99N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1147.05,"smiles":null,"spectrum_id":"CCMSLIB00017252531","spectrum_index":23007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 127.0611 Da; putative annotation: N/A; putative formula: C2H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.1,"smiles":null,"spectrum_id":"CCMSLIB00017252533","spectrum_index":23008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxy-3-[(9-methyl-6-oxohydropurin-8-ylthio)methyl]benzaldehyde CollisionEnergy:102040 (delta mass: 358.1941 Da; putative annotation: N/A; putative formula: C18H26N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.28,"smiles":null,"spectrum_id":"CCMSLIB00017252535","spectrum_index":23009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-Phenylpyrrolidine (delta mass: 50.0155 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.128,"smiles":null,"spectrum_id":"CCMSLIB00017252538","spectrum_index":23010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-5-Dodecenoic acid (delta mass: 52.0677 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.237,"smiles":null,"spectrum_id":"CCMSLIB00017252539","spectrum_index":23011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid (delta mass: 74.0771 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.216,"smiles":null,"spectrum_id":"CCMSLIB00017252542","spectrum_index":23012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Azelaic acid from NIST14 (delta mass: 128.1199 Da; putative annotation: N/A; putative formula: C8H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.232,"smiles":null,"spectrum_id":"CCMSLIB00017252543","spectrum_index":23013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imazaquin (delta mass: 32.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.16,"smiles":null,"spectrum_id":"CCMSLIB00017252546","spectrum_index":23014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.06,"smiles":null,"spectrum_id":"CCMSLIB00017252548","spectrum_index":23015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Ketofusidic acid (delta mass: 98.0613 Da; putative annotation: N/A; putative formula: C3H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.398,"smiles":null,"spectrum_id":"CCMSLIB00017252550","spectrum_index":23016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxyandrost-4-ene-3,17-dione (delta mass: 106.0776 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.273,"smiles":null,"spectrum_id":"CCMSLIB00017252553","spectrum_index":23017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyacetophenone (delta mass: 127.0279 Da; putative annotation: N/A; putative formula: C6HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.088,"smiles":null,"spectrum_id":"CCMSLIB00017252555","spectrum_index":23018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 26,27-Dinorcholest-5-en-24-yne-3,20-diol, (3.beta.)- (delta mass: 166.115 Da; putative annotation: N/A; putative formula: C14H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.409,"smiles":null,"spectrum_id":"CCMSLIB00017252557","spectrum_index":23019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luffariellolide (delta mass: 297.2667 Da; putative annotation: N/A; putative formula: C18H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.556,"smiles":null,"spectrum_id":"CCMSLIB00017252560","spectrum_index":23020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)propane-1,2-diol (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017252562","spectrum_index":23021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dioxa-4,10-diazacyclododecane (delta mass: 123.0933 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.237,"smiles":null,"spectrum_id":"CCMSLIB00017252564","spectrum_index":23022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 72.0578 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.159,"smiles":null,"spectrum_id":"CCMSLIB00017252567","spectrum_index":23023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C17:1 (delta mass: 71.0732 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.41,"smiles":null,"spectrum_id":"CCMSLIB00017252569","spectrum_index":23024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,16-Dimethylprostaglandin E1 (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.331,"smiles":null,"spectrum_id":"CCMSLIB00017252571","spectrum_index":23025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 59.0652 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.121,"smiles":null,"spectrum_id":"CCMSLIB00017252574","spectrum_index":23026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxybenzoic acid (delta mass: 94.0782 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017252575","spectrum_index":23027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Ketodeoxycholic acid (delta mass: 165.0644 Da; putative annotation: N/A; putative formula: C6H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.349,"smiles":null,"spectrum_id":"CCMSLIB00017252578","spectrum_index":23028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 12(13)-Epoxy-9Z-octadecenoic acid from NIST14 (delta mass: 116.1006 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.343,"smiles":null,"spectrum_id":"CCMSLIB00017252580","spectrum_index":23029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 94.1148 Da; putative annotation: N/A; putative formula: C8H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.342,"smiles":null,"spectrum_id":"CCMSLIB00017252582","spectrum_index":23030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 108.0933 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.289,"smiles":null,"spectrum_id":"CCMSLIB00017252585","spectrum_index":23031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Androstene-3.beta.,17.beta.-diol (delta mass: 46.005 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.237,"smiles":null,"spectrum_id":"CCMSLIB00017252586","spectrum_index":23032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7-Triazacyclononane (delta mass: 102.9686 Da; putative annotation: N/A; putative formula: CHN3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.102,"smiles":null,"spectrum_id":"CCMSLIB00017252589","spectrum_index":23033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 38.9958 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.055,"smiles":null,"spectrum_id":"CCMSLIB00017252591","spectrum_index":23034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 284.0327 Da; putative annotation: N/A; putative formula: C15H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.093,"smiles":null,"spectrum_id":"CCMSLIB00017252594","spectrum_index":23035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pinolenic acid from NIST14 (delta mass: 154.0028 Da; putative annotation: N/A; putative formula: C6H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.235,"smiles":null,"spectrum_id":"CCMSLIB00017252596","spectrum_index":23036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 60.0426 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.233,"smiles":null,"spectrum_id":"CCMSLIB00017252598","spectrum_index":23037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)piperidine (delta mass: 338.3183 Da; putative annotation: N/A; putative formula: C22H42O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.425,"smiles":null,"spectrum_id":"CCMSLIB00017252601","spectrum_index":23038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 207.1133 Da; putative annotation: N/A; putative formula: C7H18N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.218,"smiles":null,"spectrum_id":"CCMSLIB00017252602","spectrum_index":23039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 314.0428 Da; putative annotation: N/A; putative formula: C9H18N2O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.103,"smiles":null,"spectrum_id":"CCMSLIB00017252605","spectrum_index":23040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Limaprost (delta mass: 60.0362 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017252606","spectrum_index":23041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 143.0739 Da; putative annotation: N/A; putative formula: C10H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.203,"smiles":null,"spectrum_id":"CCMSLIB00017252609","spectrum_index":23042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 99.0611 Da; putative annotation: N/A; putative formula: C5H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.12,"smiles":null,"spectrum_id":"CCMSLIB00017252610","spectrum_index":23043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Hydroxydodecanoic acid CollisionEnergy:205060 (delta mass: 82.0775 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.257,"smiles":null,"spectrum_id":"CCMSLIB00017252613","spectrum_index":23044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-yl)-2-(4-methoxyphenyl)ethanamine (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.144,"smiles":null,"spectrum_id":"CCMSLIB00017252616","spectrum_index":23045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 73.9998 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.086,"smiles":null,"spectrum_id":"CCMSLIB00017252617","spectrum_index":23046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4,7,7-Trimethylbicyclo[4.1.0]hept-4-en-3-yl)methanol (delta mass: 135.1256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.269,"smiles":null,"spectrum_id":"CCMSLIB00017252620","spectrum_index":23047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11,13,14-Trihydroxyhetisan-2-yl acetate (delta mass: 72.036 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.248,"smiles":null,"spectrum_id":"CCMSLIB00017252622","spectrum_index":23048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Loliolide (delta mass: 45.0212 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.138,"smiles":null,"spectrum_id":"CCMSLIB00017252624","spectrum_index":23049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 122.1458 Da; putative annotation: N/A; putative formula: C10H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.243,"smiles":null,"spectrum_id":"CCMSLIB00017252627","spectrum_index":23050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 12.0337 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.13,"smiles":null,"spectrum_id":"CCMSLIB00017252629","spectrum_index":23051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 299.2836 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.349,"smiles":null,"spectrum_id":"CCMSLIB00017252631","spectrum_index":23052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid (delta mass: 236.0681 Da; putative annotation: N/A; putative formula: C12H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.112,"smiles":null,"spectrum_id":"CCMSLIB00017252633","spectrum_index":23053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Arachidonoylglycerol (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.336,"smiles":null,"spectrum_id":"CCMSLIB00017252636","spectrum_index":23054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 14.0149 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.357,"smiles":null,"spectrum_id":"CCMSLIB00017252638","spectrum_index":23055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 36.0362 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.242,"smiles":null,"spectrum_id":"CCMSLIB00017252640","spectrum_index":23056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 181.0748 Da; putative annotation: N/A; putative formula: C10H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.427,"smiles":null,"spectrum_id":"CCMSLIB00017252643","spectrum_index":23057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethyl-3-piperidinamine (delta mass: 135.1049 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.243,"smiles":null,"spectrum_id":"CCMSLIB00017252645","spectrum_index":23058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 4-hydroxy-3,5-dimethoxybenzoate (delta mass: 17.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017252647","spectrum_index":23059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopimaric acid (delta mass: 126.0888 Da; putative annotation: N/A; putative formula: C5H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.321,"smiles":null,"spectrum_id":"CCMSLIB00017252650","spectrum_index":23060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viscic acid (delta mass: 193.0558 Da; putative annotation: N/A; putative formula: C10H11NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.22,"smiles":null,"spectrum_id":"CCMSLIB00017252652","spectrum_index":23061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 361.155 Da; putative annotation: N/A; putative formula: C18H24N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.294,"smiles":null,"spectrum_id":"CCMSLIB00017252654","spectrum_index":23062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 165.1001 Da; putative annotation: N/A; putative formula: C7H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.285,"smiles":null,"spectrum_id":"CCMSLIB00017252657","spectrum_index":23063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 487.0723 Da; putative annotation: N/A; putative formula: C18H13N7O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.143,"smiles":null,"spectrum_id":"CCMSLIB00017252659","spectrum_index":23064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl 2-(aminomethyl)phenylcarbamate (delta mass: 42.051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.195,"smiles":null,"spectrum_id":"CCMSLIB00017252661","spectrum_index":23065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-4,10,13,16-Docosatetraenoic acid (delta mass: 80.0629 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.342,"smiles":null,"spectrum_id":"CCMSLIB00017252664","spectrum_index":23066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pimara-9(11),15-dien-18-oic acid (delta mass: 126.1047 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.337,"smiles":null,"spectrum_id":"CCMSLIB00017252666","spectrum_index":23067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 50.0 eV (delta mass: 9.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.09,"smiles":null,"spectrum_id":"CCMSLIB00017252668","spectrum_index":23068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 120.7938 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.864,"smiles":null,"spectrum_id":"CCMSLIB00017252671","spectrum_index":23069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 65.9347 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.946,"smiles":null,"spectrum_id":"CCMSLIB00017252672","spectrum_index":23070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kaurane-17,18-dioic acid (delta mass: 50.0512 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.273,"smiles":null,"spectrum_id":"CCMSLIB00017252675","spectrum_index":23071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 86.0369 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.104,"smiles":null,"spectrum_id":"CCMSLIB00017252678","spectrum_index":23072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 60.0362 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.101,"smiles":null,"spectrum_id":"CCMSLIB00017252679","spectrum_index":23073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methylhistidine (delta mass: 42.0102 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.103,"smiles":null,"spectrum_id":"CCMSLIB00017252682","spectrum_index":23074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 126.1037 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.377,"smiles":null,"spectrum_id":"CCMSLIB00017252683","spectrum_index":23075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 322.2503 Da; putative annotation: N/A; putative formula: C20H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.498,"smiles":null,"spectrum_id":"CCMSLIB00017252686","spectrum_index":23076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S)-N-(6-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-3-methyl-2-(1-oxoisoindolin-2-yl)butanamide (delta mass: 2.2718 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.5,"smiles":null,"spectrum_id":"CCMSLIB00017252687","spectrum_index":23077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Divaric acid (delta mass: 106.0419 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.123,"smiles":null,"spectrum_id":"CCMSLIB00017252690","spectrum_index":23078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Lys (delta mass: 283.0919 Da; putative annotation: N/A; putative formula: C12H20N3O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.289,"smiles":null,"spectrum_id":"CCMSLIB00017252692","spectrum_index":23079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE (delta mass: 479.726 Da; putative annotation: N/A; putative formula: H5O10P5S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":789.839,"smiles":null,"spectrum_id":"CCMSLIB00017252694","spectrum_index":23080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((2R)-2-Hydroxycyclohexyl)acetic acid (delta mass: 497.3696 Da; putative annotation: N/A; putative formula: C32H51NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.471,"smiles":null,"spectrum_id":"CCMSLIB00017252697","spectrum_index":23081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethyl-4-methoxybenzoic acid (delta mass: 88.0317 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.118,"smiles":null,"spectrum_id":"CCMSLIB00017252699","spectrum_index":23082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 142.1106 Da; putative annotation: N/A; putative formula: C7H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.191,"smiles":null,"spectrum_id":"CCMSLIB00017252701","spectrum_index":23083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 64.0064 Da; putative annotation: N/A; putative formula: C3N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017252704","spectrum_index":23084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3aS,6S,7R,8aR)-8-Hydroxy-6,8-dimethyl-3-methylidenehexahydro-3'H-spiro[cyclohepta[b]furan-7,2'-furan]-2,5'(3H,4'H)-dione (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017252705","spectrum_index":23085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 130.0781 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.247,"smiles":null,"spectrum_id":"CCMSLIB00017252708","spectrum_index":23086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 25.3799 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.471,"smiles":null,"spectrum_id":"CCMSLIB00017252710","spectrum_index":23087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1(4H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-6-hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl- (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.191,"smiles":null,"spectrum_id":"CCMSLIB00017252712","spectrum_index":23088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 350.3552 Da; putative annotation: N/A; putative formula: C24H46O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.566,"smiles":null,"spectrum_id":"CCMSLIB00017252715","spectrum_index":23089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid CollisionEnergy:205060\"\" (delta mass: 86.0368 Da; putative annotation: N/A; putative formula: C4H6O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017252717","spectrum_index":23090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 78.047 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.227,"smiles":null,"spectrum_id":"CCMSLIB00017252719","spectrum_index":23091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 309.9799 Da; putative annotation: N/A; putative formula: C12H8O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.04,"smiles":null,"spectrum_id":"CCMSLIB00017252722","spectrum_index":23092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 148.1241 Da; putative annotation: N/A; putative formula: C11H16)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.189,"smiles":null,"spectrum_id":"CCMSLIB00017252724","spectrum_index":23093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.269,"smiles":null,"spectrum_id":"CCMSLIB00017252726","spectrum_index":23094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corey PG-lactone diol (delta mass: 80.0622 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017252728","spectrum_index":23095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 355.1235 Da; putative annotation: N/A; putative formula: C12H25N3O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.178,"smiles":null,"spectrum_id":"CCMSLIB00017252730","spectrum_index":23096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 278.2242 Da; putative annotation: Spectral Match to 12(13)-Epoxy-9Z-octadecenoic acid from NIST14; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.461,"smiles":null,"spectrum_id":"CCMSLIB00017252733","spectrum_index":23097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Leu-DL-Val (delta mass: 113.0845 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.255,"smiles":null,"spectrum_id":"CCMSLIB00017252735","spectrum_index":23098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 262.23 Da; putative annotation: Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.415,"smiles":null,"spectrum_id":"CCMSLIB00017252737","spectrum_index":23099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-13-Octadecenoic acid (delta mass: 576.5085 Da; putative annotation: 1-Oleoyl-2-palmitoyl-rac-glycerol; putative formula: C37H68O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":859.772,"smiles":null,"spectrum_id":"CCMSLIB00017252740","spectrum_index":23100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mononervonin (15c) (delta mass: 94.0794 Da; putative annotation: exo-Norborneol; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.473,"smiles":null,"spectrum_id":"CCMSLIB00017252741","spectrum_index":23101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 296.2325 Da; putative annotation: 12,13-Dihydroxy-9Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.47,"smiles":null,"spectrum_id":"CCMSLIB00017252744","spectrum_index":23102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 250.0443 Da; putative annotation: 1728583 - 30.0 eV; putative formula: C8H14N2O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.082,"smiles":null,"spectrum_id":"CCMSLIB00017252747","spectrum_index":23103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 282.1101 Da; putative annotation: Salidroside; putative formula: C14H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.17,"smiles":null,"spectrum_id":"CCMSLIB00017252749","spectrum_index":23104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ369609 Salicylic acid|2-hydroxybenzoic acid (delta mass: 94.0529 Da; putative annotation: (5-Methyl-3-isoxazolyl)methanamine; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.092,"smiles":null,"spectrum_id":"CCMSLIB00017252751","spectrum_index":23105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Stearoyl-2-linoleoyl-sn-glycerol (delta mass: 309.2301 Da; putative annotation: 10-Nitrooleic acid; putative formula: C18H31NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.775,"smiles":null,"spectrum_id":"CCMSLIB00017252754","spectrum_index":23106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 178.0632 Da; putative annotation: 2H-Pyran-2-one, 6-(3,4-dihydroxy-1-penten-1-yl)-; putative formula: C10H10O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.128,"smiles":null,"spectrum_id":"CCMSLIB00017252756","spectrum_index":23107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 311.1013 Da; putative annotation: (2Z)-((4R,5S,6S)-6-(.beta.-D-Glucopyranosyloxy)-4,5-dihydroxycyclohex-2-en-1-ylidene)acetonitrile; putative formula: C14H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.161,"smiles":null,"spectrum_id":"CCMSLIB00017252758","spectrum_index":23108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 214.1312 Da; putative annotation: Thr-Leu; putative formula: C10H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.271,"smiles":null,"spectrum_id":"CCMSLIB00017252761","spectrum_index":23109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 312.2082 Da; putative annotation: 11-Hydroxy-.DELTA.9-tetrahydrocannabinol; putative formula: C21H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.279,"smiles":null,"spectrum_id":"CCMSLIB00017252762","spectrum_index":23110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(3-Octyl-2-oxiranyl)octanoic acid (delta mass: 132.0917 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.35,"smiles":null,"spectrum_id":"CCMSLIB00017252765","spectrum_index":23111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4S)-3,4-pyrrolidinediol (delta mass: 157.053 Da; putative annotation: Massbank:AU248203 7-Amino-4-methylcoumarin|7-amino-4-methylchromen-2-one; putative formula: C10H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.124,"smiles":null,"spectrum_id":"CCMSLIB00017252766","spectrum_index":23112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 169.0528 Da; putative annotation: 3-Indoleacrylic acid; putative formula: C11H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.15,"smiles":null,"spectrum_id":"CCMSLIB00017252769","spectrum_index":23113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrolidine, 2-(diphenylmethyl)-, (2S)- (delta mass: 127.0516 Da; putative annotation: 3-(1H-Pyrazol-3-yl)pyridine; putative formula: C8H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.211,"smiles":null,"spectrum_id":"CCMSLIB00017252772","spectrum_index":23114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Cyclohexanecarbonylpentadecylamine from NIST14 (delta mass: 281.2677 Da; putative annotation: Palmitoyl Ethanolamide; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.609,"smiles":null,"spectrum_id":"CCMSLIB00017252774","spectrum_index":23115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Keto-9Z,11E-octadecadienoic acid (delta mass: 250.1565 Da; putative annotation: Corey PG-lactone diol; putative formula: C15H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.383,"smiles":null,"spectrum_id":"CCMSLIB00017252776","spectrum_index":23116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 9(S)-HpOTrE from NIST14 (delta mass: 307.285 Da; putative annotation: N-Oleoylethanolamine; putative formula: C20H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.507,"smiles":null,"spectrum_id":"CCMSLIB00017252779","spectrum_index":23117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 776.4337 Da; putative annotation: NCGC00385211-01_C42H66O14_Olean-12-en-28-oic acid, 3-[(3-O-beta-D-glucopyranosyl-beta-D-glucopyranuronosyl)oxy]-, (3beta)-; putative formula: C42H64O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.504,"smiles":null,"spectrum_id":"CCMSLIB00017252781","spectrum_index":23118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 149.0837 Da; putative annotation: Synephrine; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.148,"smiles":null,"spectrum_id":"CCMSLIB00017252784","spectrum_index":23119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-methyl-2-pyrone (delta mass: 162.0527 Da; putative annotation: MYO-INOSITOL; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.092,"smiles":null,"spectrum_id":"CCMSLIB00017252786","spectrum_index":23120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 316.2041 Da; putative annotation: MLS000574943-01!; putative formula: C20H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.301,"smiles":null,"spectrum_id":"CCMSLIB00017252789","spectrum_index":23121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicyclic acid (delta mass: 134.0568 Da; putative annotation: ADONITOL; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.096,"smiles":null,"spectrum_id":"CCMSLIB00017252791","spectrum_index":23122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxy-3,6-dimethylbenzoic acid (delta mass: 82.0418 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017252793","spectrum_index":23123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Formyl-2-hydroxy-3-methylbenzoic acid (delta mass: 72.1414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.191,"smiles":null,"spectrum_id":"CCMSLIB00017252796","spectrum_index":23124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-[2-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)ethyl]oxan-2-one (delta mass: 70.0416 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.253,"smiles":null,"spectrum_id":"CCMSLIB00017252798","spectrum_index":23125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearolic acid (delta mass: 41.0264 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.274,"smiles":null,"spectrum_id":"CCMSLIB00017252800","spectrum_index":23126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 15.9802 Da; putative annotation: N/A; putative formula: O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.092,"smiles":null,"spectrum_id":"CCMSLIB00017252803","spectrum_index":23127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 151.0985 Da; putative annotation: N/A; putative formula: C9H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.196,"smiles":null,"spectrum_id":"CCMSLIB00017252805","spectrum_index":23128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000773 Dehydrohistidyl-tryptophanyl-diketopiperazine|(e)-3-(1h-imidazol-4-ylmethylene)-6-(1h-indol-3-ylmethyl)-2,5-piperazinedione (delta mass: 18.0028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.133,"smiles":null,"spectrum_id":"CCMSLIB00017252807","spectrum_index":23129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,11E,13E)-18-(2,6-Dioxopiperidin-4-yl)-9-hydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11,13-tetraenoic acid (delta mass: 214.1304 Da; putative annotation: N/A; putative formula: C12H23O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.41,"smiles":null,"spectrum_id":"CCMSLIB00017252810","spectrum_index":23130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 85.0162 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.097,"smiles":null,"spectrum_id":"CCMSLIB00017252812","spectrum_index":23131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 212.0753 Da; putative annotation: N/A; putative formula: C14H13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.25,"smiles":null,"spectrum_id":"CCMSLIB00017252814","spectrum_index":23132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Val (delta mass: 67.0422 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.171,"smiles":null,"spectrum_id":"CCMSLIB00017252817","spectrum_index":23133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017252819","spectrum_index":23134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1050.6479 Da; putative annotation: N/A; putative formula: C62H90N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1213.71,"smiles":null,"spectrum_id":"CCMSLIB00017252821","spectrum_index":23135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 185.0236 Da; putative annotation: N/A; putative formula: C2H3N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.126,"smiles":null,"spectrum_id":"CCMSLIB00017252824","spectrum_index":23136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin E1 ethanolamide (delta mass: 60.0362 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.326,"smiles":null,"spectrum_id":"CCMSLIB00017252826","spectrum_index":23137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Oxo-6E,8Z,11Z,14Z-eicosatetraenoic acid (delta mass: 38.0151 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.242,"smiles":null,"spectrum_id":"CCMSLIB00017252828","spectrum_index":23138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycodeoxycholic acid (delta mass: 116.0913 Da; putative annotation: N/A; putative formula: CH8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.413,"smiles":null,"spectrum_id":"CCMSLIB00017252831","spectrum_index":23139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 44.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017252833","spectrum_index":23140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norethindrone (delta mass: 215.0925 Da; putative annotation: N/A; putative formula: C9H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.293,"smiles":null,"spectrum_id":"CCMSLIB00017252835","spectrum_index":23141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-HYDROXYPHENYL ACETIC ACID (delta mass: 54.0314 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.086,"smiles":null,"spectrum_id":"CCMSLIB00017252838","spectrum_index":23142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ozagrel (delta mass: 23.9917 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.089,"smiles":null,"spectrum_id":"CCMSLIB00017252839","spectrum_index":23143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 56.0621 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.18,"smiles":null,"spectrum_id":"CCMSLIB00017252842","spectrum_index":23144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Palmitoyl-2-linoleoyl-rac-glycerol (delta mass: 227.2243 Da; putative annotation: N/A; putative formula: C14H29NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":820.738,"smiles":null,"spectrum_id":"CCMSLIB00017252843","spectrum_index":23145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 677.5237 Da; putative annotation: N/A; putative formula: C41H75NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1006.79,"smiles":null,"spectrum_id":"CCMSLIB00017252846","spectrum_index":23146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14 (delta mass: 140.1203 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.368,"smiles":null,"spectrum_id":"CCMSLIB00017252849","spectrum_index":23147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11.beta.,21-Dihydroxy-5.beta.-pregnane-3,20-dione (delta mass: 49.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.29,"smiles":null,"spectrum_id":"CCMSLIB00017252850","spectrum_index":23148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of stearic acid CollisionEnergy:102040 (delta mass: 88.0154 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.294,"smiles":null,"spectrum_id":"CCMSLIB00017252852","spectrum_index":23149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxysebacic acid (delta mass: 173.0322 Da; putative annotation: N/A; putative formula: C6H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.155,"smiles":null,"spectrum_id":"CCMSLIB00017252854","spectrum_index":23150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 60.0535 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.15,"smiles":null,"spectrum_id":"CCMSLIB00017252857","spectrum_index":23151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 18.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.18,"smiles":null,"spectrum_id":"CCMSLIB00017252860","spectrum_index":23152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 601.2579 Da; putative annotation: N/A; putative formula: C30H43N5O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":826.37,"smiles":null,"spectrum_id":"CCMSLIB00017252861","spectrum_index":23153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 767.4824 Da; putative annotation: N/A; putative formula: C41H69NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":948.553,"smiles":null,"spectrum_id":"CCMSLIB00017252864","spectrum_index":23154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 530.2367 Da; putative annotation: N/A; putative formula: C28H39N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.403,"smiles":null,"spectrum_id":"CCMSLIB00017252867","spectrum_index":23155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN - 30.0 eV (delta mass: 81.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.174,"smiles":null,"spectrum_id":"CCMSLIB00017252868","spectrum_index":23156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-cis-Retinoic acid (delta mass: 106.078 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.294,"smiles":null,"spectrum_id":"CCMSLIB00017252871","spectrum_index":23157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Amino-2-propanol (delta mass: 25.0307 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":101.106,"smiles":null,"spectrum_id":"CCMSLIB00017252874","spectrum_index":23158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxybenzaldehyde (delta mass: 122.0209 Da; putative annotation: N/A; putative formula: C3H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.06,"smiles":null,"spectrum_id":"CCMSLIB00017252875","spectrum_index":23159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 266.188 Da; putative annotation: N/A; putative formula: C16H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.28,"smiles":null,"spectrum_id":"CCMSLIB00017252878","spectrum_index":23160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 755.2739 Da; putative annotation: N/A; putative formula: C38H41N7O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":947.339,"smiles":null,"spectrum_id":"CCMSLIB00017252880","spectrum_index":23161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180346-02_C22H25N5O2_3-(1H-Imidazol-4-ylmethyl)-10b-(2-methyl-3-buten-2-yl)-6,10b,11,11a-tetrahydro-2H-pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-1,4(3H,5aH)-dione (delta mass: 98.0149 Da; putative annotation: N/A; putative formula: C2H3N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.223,"smiles":null,"spectrum_id":"CCMSLIB00017252882","spectrum_index":23162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00179890-03_C22H28N2O5_Methyl (16Z)-9-hydroxy-16-(methoxymethylene)-2-oxocorynoxan-17-oate (delta mass: 30.0134 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.22,"smiles":null,"spectrum_id":"CCMSLIB00017252885","spectrum_index":23163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Undecynoic acid (delta mass: 162.0523 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.19,"smiles":null,"spectrum_id":"CCMSLIB00017252887","spectrum_index":23164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stearidonic acid (delta mass: 94.0789 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017252889","spectrum_index":23165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 69.0415 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.263,"smiles":null,"spectrum_id":"CCMSLIB00017252892","spectrum_index":23166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F2.alpha. alcohol methyl ether (delta mass: 88.0696 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.354,"smiles":null,"spectrum_id":"CCMSLIB00017252893","spectrum_index":23167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kirenol (delta mass: 104.1016 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.355,"smiles":null,"spectrum_id":"CCMSLIB00017252896","spectrum_index":23168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ornithine-aMCA (delta mass: 522.3687 Da; putative annotation: N/A; putative formula: C27H55O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1045.74,"smiles":null,"spectrum_id":"CCMSLIB00017252899","spectrum_index":23169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 297.2656 Da; putative annotation: N/A; putative formula: C18H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.326,"smiles":null,"spectrum_id":"CCMSLIB00017252900","spectrum_index":23170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid (delta mass: 371.3027 Da; putative annotation: N/A; putative formula: C21H41NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.54,"smiles":null,"spectrum_id":"CCMSLIB00017252903","spectrum_index":23171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Marrubiin (delta mass: 156.124 Da; putative annotation: N/A; putative formula: C4H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.33,"smiles":null,"spectrum_id":"CCMSLIB00017252904","spectrum_index":23172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 234.1256 Da; putative annotation: N/A; putative formula: C14H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.196,"smiles":null,"spectrum_id":"CCMSLIB00017252907","spectrum_index":23173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-amino-4-methylbenzoate (delta mass: 99.0685 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017252910","spectrum_index":23174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 20-Carboxyarachidonic acid (delta mass: 36.0376 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.259,"smiles":null,"spectrum_id":"CCMSLIB00017252911","spectrum_index":23175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 197.0919 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.225,"smiles":null,"spectrum_id":"CCMSLIB00017252914","spectrum_index":23176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 211.069 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.176,"smiles":null,"spectrum_id":"CCMSLIB00017252915","spectrum_index":23177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ332502 Epinephrine|4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol (delta mass: 268.0832 Da; putative annotation: N/A; putative formula: C9H13N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.18,"smiles":null,"spectrum_id":"CCMSLIB00017252918","spectrum_index":23178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017252921","spectrum_index":23179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminoheptanoic acid (delta mass: 80.0621 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017252923","spectrum_index":23180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of URIDINE5DIPHOSPHATE (delta mass: 179.0789 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.088,"smiles":null,"spectrum_id":"CCMSLIB00017252925","spectrum_index":23181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tibolone (delta mass: 32.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.243,"smiles":null,"spectrum_id":"CCMSLIB00017252928","spectrum_index":23182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.beta.-Androsterone (delta mass: 62.0522 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.284,"smiles":null,"spectrum_id":"CCMSLIB00017252929","spectrum_index":23183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 90.0278 Da; putative annotation: N/A; putative formula: C2H6N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.13,"smiles":null,"spectrum_id":"CCMSLIB00017252932","spectrum_index":23184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 18.0098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.06,"smiles":null,"spectrum_id":"CCMSLIB00017252935","spectrum_index":23185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 279.089 Da; putative annotation: N/A; putative formula: C9H17N3O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.222,"smiles":null,"spectrum_id":"CCMSLIB00017252936","spectrum_index":23186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 131.045 Da; putative annotation: N/A; putative formula: C2H5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.132,"smiles":null,"spectrum_id":"CCMSLIB00017252939","spectrum_index":23187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 63.0512 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.118,"smiles":null,"spectrum_id":"CCMSLIB00017252942","spectrum_index":23188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 34.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.145,"smiles":null,"spectrum_id":"CCMSLIB00017252943","spectrum_index":23189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.253,"smiles":null,"spectrum_id":"CCMSLIB00017252946","spectrum_index":23190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4-Dimethylcholest-8(9),24-dien-3.beta.-ol (delta mass: 114.0668 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.445,"smiles":null,"spectrum_id":"CCMSLIB00017252949","spectrum_index":23191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 229.0955 Da; putative annotation: N/A; putative formula: C11H19NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.312,"smiles":null,"spectrum_id":"CCMSLIB00017252950","spectrum_index":23192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Docosatetraenoyl ethanolamide (delta mass: 132.099 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.42,"smiles":null,"spectrum_id":"CCMSLIB00017252953","spectrum_index":23193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 340.1161 Da; putative annotation: N/A; putative formula: C11H17N8O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.207,"smiles":null,"spectrum_id":"CCMSLIB00017252956","spectrum_index":23194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Farnesol (delta mass: 266.1519 Da; putative annotation: N/A; putative formula: C15H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.358,"smiles":null,"spectrum_id":"CCMSLIB00017252957","spectrum_index":23195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Palmitoyl-2-oleoyl-sn-glycerol from NIST14 (delta mass: 588.5503 Da; putative annotation: N/A; putative formula: C40H68N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1184.08,"smiles":null,"spectrum_id":"CCMSLIB00017252960","spectrum_index":23196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 110.0369 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.097,"smiles":null,"spectrum_id":"CCMSLIB00017252962","spectrum_index":23197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-13-Docosenoic acid (delta mass: 68.0631 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.389,"smiles":null,"spectrum_id":"CCMSLIB00017252964","spectrum_index":23198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 32.0152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.05,"smiles":null,"spectrum_id":"CCMSLIB00017252967","spectrum_index":23199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 246.0738 Da; putative annotation: N/A; putative formula: C10H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.197,"smiles":null,"spectrum_id":"CCMSLIB00017252968","spectrum_index":23200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 644.2315 Da; putative annotation: N/A; putative formula: C44H39O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.313,"smiles":null,"spectrum_id":"CCMSLIB00017252971","spectrum_index":23201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381425-01!8-hydroxy-8-(3-octyloxiran-2-yl)octanoic acid [IIN-based on: CCMSLIB00000846585] (delta mass: 66.0833 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.336,"smiles":null,"spectrum_id":"CCMSLIB00017252973","spectrum_index":23202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 117.1147 Da; putative annotation: N/A; putative formula: C2H11N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.294,"smiles":null,"spectrum_id":"CCMSLIB00017252975","spectrum_index":23203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carabrol (delta mass: 42.0102 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.174,"smiles":null,"spectrum_id":"CCMSLIB00017252978","spectrum_index":23204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 215.0893 Da; putative annotation: N/A; putative formula: C10H18NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.244,"smiles":null,"spectrum_id":"CCMSLIB00017252980","spectrum_index":23205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 43.006 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.072,"smiles":null,"spectrum_id":"CCMSLIB00017252982","spectrum_index":23206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Ala (delta mass: 220.0842 Da; putative annotation: N/A; putative formula: C13H17O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.213,"smiles":null,"spectrum_id":"CCMSLIB00017252985","spectrum_index":23207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyloxycarbonylglycine (delta mass: 209.0722 Da; putative annotation: N/A; putative formula: C7H15NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.148,"smiles":null,"spectrum_id":"CCMSLIB00017252986","spectrum_index":23208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 90.0457 Da; putative annotation: N/A; putative formula: CH7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.143,"smiles":null,"spectrum_id":"CCMSLIB00017252989","spectrum_index":23209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-4-Hydroxynon-2-enoic acid (delta mass: 115.0634 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.181,"smiles":null,"spectrum_id":"CCMSLIB00017252990","spectrum_index":23210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 22.8948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.2,"smiles":null,"spectrum_id":"CCMSLIB00017252993","spectrum_index":23211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(hydroxymethyl)-4,9a-dimethyl-2,7,8,9-tetrahydro-1H-benzo[7]annulen-3-one (delta mass: 102.0825 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.247,"smiles":null,"spectrum_id":"CCMSLIB00017252996","spectrum_index":23212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 76.0158 Da; putative annotation: N/A; putative formula: C2H4O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.102,"smiles":null,"spectrum_id":"CCMSLIB00017252997","spectrum_index":23213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galiellalactone (delta mass: 248.1284 Da; putative annotation: N/A; putative formula: C17H16N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.23,"smiles":null,"spectrum_id":"CCMSLIB00017253000","spectrum_index":23214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (10-Hydroxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl) (Z)-2-methylbut-2-enoate (delta mass: 358.1423 Da; putative annotation: N/A; putative formula: C20H22O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.276,"smiles":null,"spectrum_id":"CCMSLIB00017253001","spectrum_index":23215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14(15)-Epoxy-5Z,8Z,11Z,17Z-eicosatetraenoic acid (delta mass: 34.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.279,"smiles":null,"spectrum_id":"CCMSLIB00017253004","spectrum_index":23216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 46.0067 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.093,"smiles":null,"spectrum_id":"CCMSLIB00017253006","spectrum_index":23217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzyl-5-methyl-1,2-oxazole-4-carboxylic acid (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017253008","spectrum_index":23218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Perillic acid (delta mass: 54.0465 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017253011","spectrum_index":23219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2.beta.,5.xi.,9.xi.)-Kaur-16-ene-2,18,19-triol (delta mass: 318.1844 Da; putative annotation: N/A; putative formula: C20H22N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.427,"smiles":null,"spectrum_id":"CCMSLIB00017253013","spectrum_index":23220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclotridecan-2-one (delta mass: 70.0781 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.263,"smiles":null,"spectrum_id":"CCMSLIB00017253016","spectrum_index":23221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU100601 Sulfaclozine|4-amino-N-(6-chloropyrazin-2-yl)benzenesulfonamide (delta mass: 285.2392 Da; putative annotation: N/A; putative formula: C11H27N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.26,"smiles":null,"spectrum_id":"CCMSLIB00017253018","spectrum_index":23222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12-Octadecadiynoic acid (delta mass: 314.2796 Da; putative annotation: N/A; putative formula: C15H34N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.496,"smiles":null,"spectrum_id":"CCMSLIB00017253020","spectrum_index":23223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Myristoylsphinganine (delta mass: 108.0927 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.596,"smiles":null,"spectrum_id":"CCMSLIB00017253023","spectrum_index":23224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 289.1722 Da; putative annotation: N/A; putative formula: C14H29NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.232,"smiles":null,"spectrum_id":"CCMSLIB00017253024","spectrum_index":23225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 728.4186 Da; putative annotation: N/A; putative formula: C47H56N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":909.489,"smiles":null,"spectrum_id":"CCMSLIB00017253027","spectrum_index":23226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 90.0316 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017253029","spectrum_index":23227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asperlactone (delta mass: 35.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017253031","spectrum_index":23228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-methoxybenzoic acid (delta mass: 102.0469 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.096,"smiles":null,"spectrum_id":"CCMSLIB00017253034","spectrum_index":23229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 575.2431 Da; putative annotation: N/A; putative formula: C25H42N3O8PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.314,"smiles":null,"spectrum_id":"CCMSLIB00017253035","spectrum_index":23230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(E)-5-Hydroxy-3-methylpent-3-enyl]-3,5,5-trimethylcyclohex-2-en-1-one (delta mass: 202.2051 Da; putative annotation: N/A; putative formula: C7H22N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.39,"smiles":null,"spectrum_id":"CCMSLIB00017253038","spectrum_index":23231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 173.1006 Da; putative annotation: N/A; putative formula: C7H15N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.186,"smiles":null,"spectrum_id":"CCMSLIB00017253039","spectrum_index":23232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-erythro-Sphinganine (delta mass: 242.0198 Da; putative annotation: N/A; putative formula: C7H15O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.325,"smiles":null,"spectrum_id":"CCMSLIB00017253042","spectrum_index":23233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Pregnane-3.alpha.,21-diol-20-one (delta mass: 101.0837 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.342,"smiles":null,"spectrum_id":"CCMSLIB00017253045","spectrum_index":23234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 64.0766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.351,"smiles":null,"spectrum_id":"CCMSLIB00017253046","spectrum_index":23235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Quinic acid (delta mass: 242.1306 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.201,"smiles":null,"spectrum_id":"CCMSLIB00017253049","spectrum_index":23236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 450.2254 Da; putative annotation: N/A; putative formula: C24H34O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.29,"smiles":null,"spectrum_id":"CCMSLIB00017253050","spectrum_index":23237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nipecotic acid (delta mass: 180.0416 Da; putative annotation: N/A; putative formula: C3H9N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017253053","spectrum_index":23238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxy Vitamin D3 (delta mass: 152.0982 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.44,"smiles":null,"spectrum_id":"CCMSLIB00017253056","spectrum_index":23239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Monopalmitolein (9c) (delta mass: 443.3243 Da; putative annotation: N/A; putative formula: C24H45NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.593,"smiles":null,"spectrum_id":"CCMSLIB00017253057","spectrum_index":23240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 693.4422 Da; putative annotation: N/A; putative formula: C34H59N7O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":856.502,"smiles":null,"spectrum_id":"CCMSLIB00017253060","spectrum_index":23241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 95.0159 Da; putative annotation: N/A; putative formula: C8HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.113,"smiles":null,"spectrum_id":"CCMSLIB00017253062","spectrum_index":23242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 453.2202 Da; putative annotation: N/A; putative formula: C18H34N9O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.28,"smiles":null,"spectrum_id":"CCMSLIB00017253064","spectrum_index":23243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 282.2193 Da; putative annotation: N/A; putative formula: C17H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.311,"smiles":null,"spectrum_id":"CCMSLIB00017253067","spectrum_index":23244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 216.1923 Da; putative annotation: N/A; putative formula: C6H20N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.284,"smiles":null,"spectrum_id":"CCMSLIB00017253068","spectrum_index":23245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic JBIR 27 (delta mass: 82.0416 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017253071","spectrum_index":23246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 130.0783 Da; putative annotation: N/A; putative formula: C10H10)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017253074","spectrum_index":23247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melatonin (delta mass: 88.0158 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017253075","spectrum_index":23248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 27.9466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.033,"smiles":null,"spectrum_id":"CCMSLIB00017253078","spectrum_index":23249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-linolenic acid (delta mass: 369.2781 Da; putative annotation: N/A; putative formula: C23H35N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.51,"smiles":null,"spectrum_id":"CCMSLIB00017253079","spectrum_index":23250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 306.0441 Da; putative annotation: N/A; putative formula: C10H15N2O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.085,"smiles":null,"spectrum_id":"CCMSLIB00017253082","spectrum_index":23251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Oxocholesterol (delta mass: 80.022 Da; putative annotation: N/A; putative formula: CN6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.363,"smiles":null,"spectrum_id":"CCMSLIB00017253085","spectrum_index":23252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 77.1208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.16,"smiles":null,"spectrum_id":"CCMSLIB00017253086","spectrum_index":23253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Manool CollisionEnergy:102040 (delta mass: 225.2059 Da; putative annotation: N/A; putative formula: C10H23N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.474,"smiles":null,"spectrum_id":"CCMSLIB00017253089","spectrum_index":23254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of QuinicAcid (delta mass: 168.1292 Da; putative annotation: N/A; putative formula: C9H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.2,"smiles":null,"spectrum_id":"CCMSLIB00017253091","spectrum_index":23255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 456.3468 Da; putative annotation: N/A; putative formula: C27H44N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.417,"smiles":null,"spectrum_id":"CCMSLIB00017253093","spectrum_index":23256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 159.1261 Da; putative annotation: N/A; putative formula: C8H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.208,"smiles":null,"spectrum_id":"CCMSLIB00017253096","spectrum_index":23257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 96.0939 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.201,"smiles":null,"spectrum_id":"CCMSLIB00017253098","spectrum_index":23258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLPUTRESCINE (delta mass: 68.001 Da; putative annotation: N/A; putative formula: C2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.119,"smiles":null,"spectrum_id":"CCMSLIB00017253100","spectrum_index":23259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetyl-2-hydroxybenzoic acid (delta mass: 18.0041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.054,"smiles":null,"spectrum_id":"CCMSLIB00017253103","spectrum_index":23260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 346.0868 Da; putative annotation: N/A; putative formula: C10H22N2O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.237,"smiles":null,"spectrum_id":"CCMSLIB00017253105","spectrum_index":23261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017253107","spectrum_index":23262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Acetaminobenzoic acid (delta mass: 29.0132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.079,"smiles":null,"spectrum_id":"CCMSLIB00017253110","spectrum_index":23263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxyculmorin (delta mass: 150.1044 Da; putative annotation: N/A; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.3,"smiles":null,"spectrum_id":"CCMSLIB00017253113","spectrum_index":23264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Vinylphenol (delta mass: 189.0424 Da; putative annotation: N/A; putative formula: C10H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.107,"smiles":null,"spectrum_id":"CCMSLIB00017253115","spectrum_index":23265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 818.5878 Da; putative annotation: N/A; putative formula: C44H78N6O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1203.75,"smiles":null,"spectrum_id":"CCMSLIB00017253117","spectrum_index":23266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 139.1613 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.263,"smiles":null,"spectrum_id":"CCMSLIB00017253119","spectrum_index":23267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,7,9-Tetramethyl-5-decyne-4,7-diol (delta mass: 70.0425 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.243,"smiles":null,"spectrum_id":"CCMSLIB00017253121","spectrum_index":23268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 71.0365 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.16,"smiles":null,"spectrum_id":"CCMSLIB00017253124","spectrum_index":23269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-cyclohexanecarboxylic acid (delta mass: 36.0333 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.14,"smiles":null,"spectrum_id":"CCMSLIB00017253126","spectrum_index":23270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Hydroxycyclohexyl)butanoic acid (delta mass: 74.0371 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.17,"smiles":null,"spectrum_id":"CCMSLIB00017253128","spectrum_index":23271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-methylolivetolcarboxylic acid (delta mass: 126.2141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.342,"smiles":null,"spectrum_id":"CCMSLIB00017253131","spectrum_index":23272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrotachysterol (delta mass: 90.0498 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.412,"smiles":null,"spectrum_id":"CCMSLIB00017253133","spectrum_index":23273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorobenzyl)piperidine (delta mass: 31.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.16,"smiles":null,"spectrum_id":"CCMSLIB00017253135","spectrum_index":23274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-dihydroxy-5-methoxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0?,]dodecane]-2''-one (delta mass: 70.0419 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.264,"smiles":null,"spectrum_id":"CCMSLIB00017253137","spectrum_index":23275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 395.1878 Da; putative annotation: N/A; putative formula: C19H29N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.374,"smiles":null,"spectrum_id":"CCMSLIB00017253140","spectrum_index":23276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 322.3278 Da; putative annotation: N/A; putative formula: C22H42O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.518,"smiles":null,"spectrum_id":"CCMSLIB00017253141","spectrum_index":23277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 228.1082 Da; putative annotation: N/A; putative formula: C6H12N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.247,"smiles":null,"spectrum_id":"CCMSLIB00017253144","spectrum_index":23278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 161.0366 Da; putative annotation: N/A; putative formula: C3H7N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.159,"smiles":null,"spectrum_id":"CCMSLIB00017253147","spectrum_index":23279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 64.0147 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.119,"smiles":null,"spectrum_id":"CCMSLIB00017253148","spectrum_index":23280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine - 40.0 eV (delta mass: 70.0403 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.091,"smiles":null,"spectrum_id":"CCMSLIB00017253151","spectrum_index":23281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Resedine (delta mass: 9.0005 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.071,"smiles":null,"spectrum_id":"CCMSLIB00017253152","spectrum_index":23282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 41.063 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.166,"smiles":null,"spectrum_id":"CCMSLIB00017253155","spectrum_index":23283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 8.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.102,"smiles":null,"spectrum_id":"CCMSLIB00017253158","spectrum_index":23284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecan-5-ol (delta mass: 90.0833 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.331,"smiles":null,"spectrum_id":"CCMSLIB00017253159","spectrum_index":23285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(glycylprolyl) (delta mass: 87.0208 Da; putative annotation: N/A; putative formula: C5HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017253162","spectrum_index":23286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxy-4-methylbenzoic acid (delta mass: 64.0831 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.133,"smiles":null,"spectrum_id":"CCMSLIB00017253163","spectrum_index":23287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PAR_146.0966_8.3 (delta mass: 72.0413 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.138,"smiles":null,"spectrum_id":"CCMSLIB00017253166","spectrum_index":23288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidone (delta mass: 407.2543 Da; putative annotation: N/A; putative formula: C21H29N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.33,"smiles":null,"spectrum_id":"CCMSLIB00017253168","spectrum_index":23289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 116.0846 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.187,"smiles":null,"spectrum_id":"CCMSLIB00017253170","spectrum_index":23290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300390 Aristolochic acid C (delta mass: 26.9662 Da; putative annotation: N/A; putative formula: C9H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.011,"smiles":null,"spectrum_id":"CCMSLIB00017253173","spectrum_index":23291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperazine (delta mass: 706.2744 Da; putative annotation: N/A; putative formula: C30H42N8O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":807.382,"smiles":null,"spectrum_id":"CCMSLIB00017253176","spectrum_index":23292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 573.7776 Da; putative annotation: N/A; putative formula: C16H14O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.844,"smiles":null,"spectrum_id":"CCMSLIB00017253177","spectrum_index":23293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 150.08 Da; putative annotation: N/A; putative formula: C8H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.151,"smiles":null,"spectrum_id":"CCMSLIB00017253180","spectrum_index":23294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 96.0572 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.159,"smiles":null,"spectrum_id":"CCMSLIB00017253182","spectrum_index":23295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000626 o-Anisic acid|2-methoxybenzoic acid (delta mass: 128.061 Da; putative annotation: N/A; putative formula: C4H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.116,"smiles":null,"spectrum_id":"CCMSLIB00017253184","spectrum_index":23296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gabapentin (delta mass: 24.9478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.081,"smiles":null,"spectrum_id":"CCMSLIB00017253187","spectrum_index":23297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyisovanillic acid (delta mass: 24.9383 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.983,"smiles":null,"spectrum_id":"CCMSLIB00017253189","spectrum_index":23298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclohexylacetic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.117,"smiles":null,"spectrum_id":"CCMSLIB00017253191","spectrum_index":23299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 18.0081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.114,"smiles":null,"spectrum_id":"CCMSLIB00017253194","spectrum_index":23300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Junceic acid (delta mass: 8.0041 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.215,"smiles":null,"spectrum_id":"CCMSLIB00017253195","spectrum_index":23301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 170.0695 Da; putative annotation: N/A; putative formula: C7H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.129,"smiles":null,"spectrum_id":"CCMSLIB00017253198","spectrum_index":23302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 393.9346 Da; putative annotation: N/A; putative formula: C9H6N4O8S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.063,"smiles":null,"spectrum_id":"CCMSLIB00017253201","spectrum_index":23303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,12,14-Octadecatrienoic acid, 16-oxo-, (9Z,12Z,14E)- (delta mass: 255.1836 Da; putative annotation: N/A; putative formula: C14H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.395,"smiles":null,"spectrum_id":"CCMSLIB00017253202","spectrum_index":23304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 (delta mass: 66.0813 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.619,"smiles":null,"spectrum_id":"CCMSLIB00017253205","spectrum_index":23305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 89.0313 Da; putative annotation: N/A; putative formula: C3H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.091,"smiles":null,"spectrum_id":"CCMSLIB00017253206","spectrum_index":23306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutethimide (delta mass: 261.1454 Da; putative annotation: N/A; putative formula: C10H15N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.263,"smiles":null,"spectrum_id":"CCMSLIB00017253209","spectrum_index":23307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Acetyl-2-methoxyphenoxy)acetic acid (delta mass: 69.9994 Da; putative annotation: N/A; putative formula: C2H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.075,"smiles":null,"spectrum_id":"CCMSLIB00017253211","spectrum_index":23308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxykaurenolide (delta mass: 28.0312 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.242,"smiles":null,"spectrum_id":"CCMSLIB00017253213","spectrum_index":23309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Deoxy-12-hydroxyandrographolide (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.269,"smiles":null,"spectrum_id":"CCMSLIB00017253216","spectrum_index":23310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 118.099 Da; putative annotation: N/A; putative formula: C2H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.18,"smiles":null,"spectrum_id":"CCMSLIB00017253217","spectrum_index":23311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 18.0163 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017253220","spectrum_index":23312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 169.1355 Da; putative annotation: N/A; putative formula: C7H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017253222","spectrum_index":23313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 497.281 Da; putative annotation: N/A; putative formula: C26H43NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.346,"smiles":null,"spectrum_id":"CCMSLIB00017253224","spectrum_index":23314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 197.0686 Da; putative annotation: N/A; putative formula: C9H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.208,"smiles":null,"spectrum_id":"CCMSLIB00017253227","spectrum_index":23315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 116.0343 Da; putative annotation: N/A; putative formula: C2H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.11,"smiles":null,"spectrum_id":"CCMSLIB00017253228","spectrum_index":23316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Hydroxyphenyl)propanoic acid (delta mass: 9.9838 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.054,"smiles":null,"spectrum_id":"CCMSLIB00017253231","spectrum_index":23317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,6R)-2-methyl-6-tridecylpiperidine (delta mass: 43.005 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.32,"smiles":null,"spectrum_id":"CCMSLIB00017253234","spectrum_index":23318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 147.0351 Da; putative annotation: N/A; putative formula: C7H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.137,"smiles":null,"spectrum_id":"CCMSLIB00017253235","spectrum_index":23319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxybenzoic acid (delta mass: 109.0528 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.129,"smiles":null,"spectrum_id":"CCMSLIB00017253238","spectrum_index":23320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311011 Feruloyl allylamine (delta mass: 262.1756 Da; putative annotation: N/A; putative formula: C17H26S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.288,"smiles":null,"spectrum_id":"CCMSLIB00017253240","spectrum_index":23321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid; LC-tDDA; CE10 (delta mass: 69.0582 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.098,"smiles":null,"spectrum_id":"CCMSLIB00017253242","spectrum_index":23322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylbenzoic acid (delta mass: 161.1052 Da; putative annotation: N/A; putative formula: C7H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.165,"smiles":null,"spectrum_id":"CCMSLIB00017253245","spectrum_index":23323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenol (delta mass: 28.998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.068,"smiles":null,"spectrum_id":"CCMSLIB00017253247","spectrum_index":23324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(6R)-2-methyl-6-((2R,3S,5S,7R,8R,9S,10S,12S,13R,14S,17R)-2,3,7,12-tetrahydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)heptanoic acid\"\" (delta mass: 447.3339 Da; putative annotation: N/A; putative formula: C27H45NO4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.671,"smiles":null,"spectrum_id":"CCMSLIB00017253249","spectrum_index":23325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 367.3084 Da; putative annotation: N/A; putative formula: C22H41NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.379,"smiles":null,"spectrum_id":"CCMSLIB00017253252","spectrum_index":23326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 99.0676 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.17,"smiles":null,"spectrum_id":"CCMSLIB00017253254","spectrum_index":23327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 238.1354 Da; putative annotation: N/A; putative formula: C17H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.242,"smiles":null,"spectrum_id":"CCMSLIB00017253257","spectrum_index":23328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Palmitoyl-rac-glycerol (delta mass: 167.1314 Da; putative annotation: N/A; putative formula: C10H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.416,"smiles":null,"spectrum_id":"CCMSLIB00017253259","spectrum_index":23329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOBENZOATE (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.113,"smiles":null,"spectrum_id":"CCMSLIB00017253261","spectrum_index":23330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (24E)-3-Oxodammara-1,12,24-trien-26-oic acid (delta mass: 54.0313 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.368,"smiles":null,"spectrum_id":"CCMSLIB00017253264","spectrum_index":23331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Teucroxide (delta mass: 144.0422 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.217,"smiles":null,"spectrum_id":"CCMSLIB00017253266","spectrum_index":23332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Picrinine (delta mass: 216.2089 Da; putative annotation: N/A; putative formula: C9H24N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.379,"smiles":null,"spectrum_id":"CCMSLIB00017253268","spectrum_index":23333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 205.0959 Da; putative annotation: N/A; putative formula: C9H19NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.208,"smiles":null,"spectrum_id":"CCMSLIB00017253271","spectrum_index":23334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 146.0798 Da; putative annotation: N/A; putative formula: C4H10N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.255,"smiles":null,"spectrum_id":"CCMSLIB00017253272","spectrum_index":23335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 131.0401 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.111,"smiles":null,"spectrum_id":"CCMSLIB00017253275","spectrum_index":23336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 369.0893 Da; putative annotation: N/A; putative formula: C17H23NO2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.274,"smiles":null,"spectrum_id":"CCMSLIB00017253278","spectrum_index":23337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 270.1832 Da; putative annotation: N/A; putative formula: C15H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.27,"smiles":null,"spectrum_id":"CCMSLIB00017253279","spectrum_index":23338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 159.0895 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.187,"smiles":null,"spectrum_id":"CCMSLIB00017253282","spectrum_index":23339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidinecarboxamide (delta mass: 87.0326 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.135,"smiles":null,"spectrum_id":"CCMSLIB00017253283","spectrum_index":23340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dinor-12-oxophytodienoic acid (delta mass: 70.0778 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017253286","spectrum_index":23341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cassythicine (delta mass: 184.072 Da; putative annotation: N/A; putative formula: C13H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.211,"smiles":null,"spectrum_id":"CCMSLIB00017253289","spectrum_index":23342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxolup-20(29)-en-28-oic acid (delta mass: 505.1644 Da; putative annotation: N/A; putative formula: C23H23N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.516,"smiles":null,"spectrum_id":"CCMSLIB00017253290","spectrum_index":23343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 379.3449 Da; putative annotation: N/A; putative formula: C24H45NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.431,"smiles":null,"spectrum_id":"CCMSLIB00017253293","spectrum_index":23344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumol (delta mass: 127.9121 Da; putative annotation: N/A; putative formula: HO2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.097,"smiles":null,"spectrum_id":"CCMSLIB00017253294","spectrum_index":23345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S)-4-Amino-5-hydroxypentanoic acid (delta mass: 182.167 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.248,"smiles":null,"spectrum_id":"CCMSLIB00017253297","spectrum_index":23346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,6,9,12-Tetraoxatetracosan-1-ol (delta mass: 84.0934 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.404,"smiles":null,"spectrum_id":"CCMSLIB00017253300","spectrum_index":23347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (4.alpha.)- (delta mass: 156.1361 Da; putative annotation: N/A; putative formula: C7H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.494,"smiles":null,"spectrum_id":"CCMSLIB00017253301","spectrum_index":23348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 685.2215 Da; putative annotation: N/A; putative formula: C43H31N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.282,"smiles":null,"spectrum_id":"CCMSLIB00017253304","spectrum_index":23349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 50.0516 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017253305","spectrum_index":23350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,18-Dihydroxykaurenolide (delta mass: 130.0814 Da; putative annotation: N/A; putative formula: C7H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.287,"smiles":null,"spectrum_id":"CCMSLIB00017253308","spectrum_index":23351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 13-Labdene-2,8,15-triol (ent-2a,8a,13E)-form) (delta mass: 142.1149 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.389,"smiles":null,"spectrum_id":"CCMSLIB00017253310","spectrum_index":23352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alisol B acetate (delta mass: 104.1045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.478,"smiles":null,"spectrum_id":"CCMSLIB00017253312","spectrum_index":23353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Acetoxy-6-oxo-7,13-labdadien-15-oic acid (delta mass: 78.0462 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.279,"smiles":null,"spectrum_id":"CCMSLIB00017253315","spectrum_index":23354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylene Glycol Monododecyl Ether (delta mass: 114.0682 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.353,"smiles":null,"spectrum_id":"CCMSLIB00017253316","spectrum_index":23355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Ketofusidic acid (delta mass: 144.0534 Da; putative annotation: N/A; putative formula: C5H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.39,"smiles":null,"spectrum_id":"CCMSLIB00017253319","spectrum_index":23356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 226.0753 Da; putative annotation: N/A; putative formula: C6H10N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.172,"smiles":null,"spectrum_id":"CCMSLIB00017253322","spectrum_index":23357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 49.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.102,"smiles":null,"spectrum_id":"CCMSLIB00017253323","spectrum_index":23358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 42.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.149,"smiles":null,"spectrum_id":"CCMSLIB00017253326","spectrum_index":23359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.alpha.-Hydroxystanozolol (delta mass: 45.994 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.248,"smiles":null,"spectrum_id":"CCMSLIB00017253327","spectrum_index":23360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,6E,10Z)-12-Hydroxy-10-(hydroxymethyl)-6-methyl-2-(4-methylpent-3-enyl)dodeca-2,6,10-trienoic acid (delta mass: 64.0675 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.305,"smiles":null,"spectrum_id":"CCMSLIB00017253330","spectrum_index":23361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 171.0905 Da; putative annotation: N/A; putative formula: C9H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.224,"smiles":null,"spectrum_id":"CCMSLIB00017253333","spectrum_index":23362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Abietic acid CollisionEnergy:205060 (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.253,"smiles":null,"spectrum_id":"CCMSLIB00017253334","spectrum_index":23363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ent-15-Hydroxy-8(17)-labden-2-one (delta mass: 118.0777 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.341,"smiles":null,"spectrum_id":"CCMSLIB00017253337","spectrum_index":23364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Deoxy-12-hydroxyandrographolide (delta mass: 62.0524 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.269,"smiles":null,"spectrum_id":"CCMSLIB00017253339","spectrum_index":23365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethylbenzoic acid (delta mass: 452.2158 Da; putative annotation: N/A; putative formula: C22H32N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.291,"smiles":null,"spectrum_id":"CCMSLIB00017253341","spectrum_index":23366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 102.0316 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017253344","spectrum_index":23367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 99.0211 Da; putative annotation: N/A; putative formula: C6HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.17,"smiles":null,"spectrum_id":"CCMSLIB00017253345","spectrum_index":23368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alisol B acetate (delta mass: 95.0582 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.431,"smiles":null,"spectrum_id":"CCMSLIB00017253348","spectrum_index":23369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 137.0479 Da; putative annotation: N/A; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017253350","spectrum_index":23370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 446.2894 Da; putative annotation: N/A; putative formula: C24H38N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.326,"smiles":null,"spectrum_id":"CCMSLIB00017253352","spectrum_index":23371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpiperidin-2-one (delta mass: 60.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.149,"smiles":null,"spectrum_id":"CCMSLIB00017253355","spectrum_index":23372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KU036-10 (delta mass: 102.0836 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.347,"smiles":null,"spectrum_id":"CCMSLIB00017253358","spectrum_index":23373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylpiperidine-3-carboxylic acid (delta mass: 103.0379 Da; putative annotation: N/A; putative formula: C2H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.14,"smiles":null,"spectrum_id":"CCMSLIB00017253359","spectrum_index":23374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 143.057 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.186,"smiles":null,"spectrum_id":"CCMSLIB00017253362","spectrum_index":23375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 102.0469 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.097,"smiles":null,"spectrum_id":"CCMSLIB00017253363","spectrum_index":23376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 176.0304 Da; putative annotation: N/A; putative formula: C3H8N6O-1S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.101,"smiles":null,"spectrum_id":"CCMSLIB00017253366","spectrum_index":23377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 294.2552 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.379,"smiles":null,"spectrum_id":"CCMSLIB00017253369","spectrum_index":23378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 268.0369 Da; putative annotation: N/A; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.213,"smiles":null,"spectrum_id":"CCMSLIB00017253370","spectrum_index":23379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isomyristic acid (delta mass: 57.0579 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.274,"smiles":null,"spectrum_id":"CCMSLIB00017253373","spectrum_index":23380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroluciferin (delta mass: 14.0068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.996,"smiles":null,"spectrum_id":"CCMSLIB00017253376","spectrum_index":23381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platanic acid (delta mass: 108.0934 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.44,"smiles":null,"spectrum_id":"CCMSLIB00017253377","spectrum_index":23382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 375.2265 Da; putative annotation: N/A; putative formula: C19H37NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.297,"smiles":null,"spectrum_id":"CCMSLIB00017253380","spectrum_index":23383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 132.0379 Da; putative annotation: N/A; putative formula: C4H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.13,"smiles":null,"spectrum_id":"CCMSLIB00017253381","spectrum_index":23384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 104.1017 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.292,"smiles":null,"spectrum_id":"CCMSLIB00017253384","spectrum_index":23385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1122.6858 Da; putative annotation: N/A; putative formula: C47H82N26O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1344.78,"smiles":null,"spectrum_id":"CCMSLIB00017253387","spectrum_index":23386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 134.0492 Da; putative annotation: N/A; putative formula: C5H11O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.141,"smiles":null,"spectrum_id":"CCMSLIB00017253388","spectrum_index":23387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 112.0268 Da; putative annotation: N/A; putative formula: C4H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.118,"smiles":null,"spectrum_id":"CCMSLIB00017253391","spectrum_index":23388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 434.1299 Da; putative annotation: N/A; putative formula: C16H18N8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.19,"smiles":null,"spectrum_id":"CCMSLIB00017253394","spectrum_index":23389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 442.1451 Da; putative annotation: N/A; putative formula: C24H26O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.294,"smiles":null,"spectrum_id":"CCMSLIB00017253395","spectrum_index":23390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 27.5238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.628,"smiles":null,"spectrum_id":"CCMSLIB00017253398","spectrum_index":23391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 216.1466 Da; putative annotation: N/A; putative formula: C12H25O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.27,"smiles":null,"spectrum_id":"CCMSLIB00017253400","spectrum_index":23392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-yl)ethanamine (delta mass: 50.0253 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.128,"smiles":null,"spectrum_id":"CCMSLIB00017253402","spectrum_index":23393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Tetradecynoic acid (delta mass: 125.9984 Da; putative annotation: N/A; putative formula: C4H3N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.183,"smiles":null,"spectrum_id":"CCMSLIB00017253405","spectrum_index":23394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Incensole (delta mass: 156.1355 Da; putative annotation: N/A; putative formula: C10H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.399,"smiles":null,"spectrum_id":"CCMSLIB00017253406","spectrum_index":23395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,5,6-Tetramethylterephthalic acid (delta mass: 116.0471 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.144,"smiles":null,"spectrum_id":"CCMSLIB00017253409","spectrum_index":23396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ((1S)-5-Methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]octan-4-yl)methanol (delta mass: 203.1694 Da; putative annotation: N/A; putative formula: C14H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.37,"smiles":null,"spectrum_id":"CCMSLIB00017253410","spectrum_index":23397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ent-15-Hydroxy-8(17)-labden-2-one (delta mass: 134.0768 Da; putative annotation: N/A; putative formula: C2H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.34,"smiles":null,"spectrum_id":"CCMSLIB00017253413","spectrum_index":23398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxandrolone (delta mass: 106.0788 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.306,"smiles":null,"spectrum_id":"CCMSLIB00017253416","spectrum_index":23399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Stachen-19-ol (delta mass: 107.1174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.37,"smiles":null,"spectrum_id":"CCMSLIB00017253417","spectrum_index":23400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxypregnenolone (delta mass: 186.0795 Da; putative annotation: N/A; putative formula: C11H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.322,"smiles":null,"spectrum_id":"CCMSLIB00017253420","spectrum_index":23401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 21-Hydroxyprogesterone (delta mass: 18.0099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017253421","spectrum_index":23402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 104.1336 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.209,"smiles":null,"spectrum_id":"CCMSLIB00017253424","spectrum_index":23403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Oxoandrostenediol (delta mass: 48.0367 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.248,"smiles":null,"spectrum_id":"CCMSLIB00017253425","spectrum_index":23404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacetic acid (delta mass: 115.0634 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017253428","spectrum_index":23405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 98.0927 Da; putative annotation: N/A; putative formula: C4H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.194,"smiles":null,"spectrum_id":"CCMSLIB00017253429","spectrum_index":23406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 43.006 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.113,"smiles":null,"spectrum_id":"CCMSLIB00017253432","spectrum_index":23407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sebacic acid monomethyl ester from NIST14 (delta mass: 13.9946 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017253435","spectrum_index":23408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA283009 Naltrexone|(5alpha)-17-(Cyclopropylmethyl)-3,14-dihydroxy-4,5-epoxymorphinan-6-one (delta mass: 30.0471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.217,"smiles":null,"spectrum_id":"CCMSLIB00017253436","spectrum_index":23409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethanone, 1-(5-hydroxy-1-pentyl-1H-indol-3-yl)-2-(2-methoxyphenyl)- (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.201,"smiles":null,"spectrum_id":"CCMSLIB00017253439","spectrum_index":23410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naratriptan N-oxide (delta mass: 18.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.238,"smiles":null,"spectrum_id":"CCMSLIB00017253442","spectrum_index":23411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 269.163 Da; putative annotation: N/A; putative formula: C14H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.223,"smiles":null,"spectrum_id":"CCMSLIB00017253443","spectrum_index":23412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 265.1161 Da; putative annotation: N/A; putative formula: C10H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.207,"smiles":null,"spectrum_id":"CCMSLIB00017253446","spectrum_index":23413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 481.2864 Da; putative annotation: N/A; putative formula: C26H43NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.357,"smiles":null,"spectrum_id":"CCMSLIB00017253449","spectrum_index":23414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 152.1243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.227,"smiles":null,"spectrum_id":"CCMSLIB00017253450","spectrum_index":23415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 153.0781 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.18,"smiles":null,"spectrum_id":"CCMSLIB00017253453","spectrum_index":23416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 144.0406 Da; putative annotation: N/A; putative formula: C10H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.078,"smiles":null,"spectrum_id":"CCMSLIB00017253454","spectrum_index":23417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLSALICYLIC ACID (delta mass: 71.0585 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.113,"smiles":null,"spectrum_id":"CCMSLIB00017253457","spectrum_index":23418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 23.0524 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.118,"smiles":null,"spectrum_id":"CCMSLIB00017253460","spectrum_index":23419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Allylphenoxy)acetic acid (delta mass: 10.0208 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.107,"smiles":null,"spectrum_id":"CCMSLIB00017253461","spectrum_index":23420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (9Z,12Z)-15-Hydroxyoctadeca-9,12-dienoic acid (delta mass: 331.2728 Da; putative annotation: N/A; putative formula: C18H37NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.515,"smiles":null,"spectrum_id":"CCMSLIB00017253464","spectrum_index":23421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 741.002 Da; putative annotation: N/A; putative formula: C62H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":963.099,"smiles":null,"spectrum_id":"CCMSLIB00017253465","spectrum_index":23422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 142.0636 Da; putative annotation: N/A; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.228,"smiles":null,"spectrum_id":"CCMSLIB00017253468","spectrum_index":23423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE10; CorrDec (delta mass: 88.0562 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.122,"smiles":null,"spectrum_id":"CCMSLIB00017253469","spectrum_index":23424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 869.4778 Da; putative annotation: N/A; putative formula: C45H75NO11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1050.55,"smiles":null,"spectrum_id":"CCMSLIB00017253472","spectrum_index":23425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E,10Z,14E)-6,14-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid (delta mass: 32.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.217,"smiles":null,"spectrum_id":"CCMSLIB00017253475","spectrum_index":23426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 236.0876 Da; putative annotation: N/A; putative formula: C13H16O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.211,"smiles":null,"spectrum_id":"CCMSLIB00017253476","spectrum_index":23427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [(3-Benzoyl-1-benzofuran-5-yl)oxy]acetic acid (delta mass: 104.0263 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.102,"smiles":null,"spectrum_id":"CCMSLIB00017253479","spectrum_index":23428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 118.0274 Da; putative annotation: N/A; putative formula: C5H10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.146,"smiles":null,"spectrum_id":"CCMSLIB00017253481","spectrum_index":23429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helicin (delta mass: 135.0898 Da; putative annotation: N/A; putative formula: C6H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.187,"smiles":null,"spectrum_id":"CCMSLIB00017253483","spectrum_index":23430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Oleoyl-2-acetyl-sn-glycerol (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.348,"smiles":null,"spectrum_id":"CCMSLIB00017253485","spectrum_index":23431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Monolinolenin (delta mass: 238.2291 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.498,"smiles":null,"spectrum_id":"CCMSLIB00017253487","spectrum_index":23432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(R)-Hydroxydocosahexaenoic acid (delta mass: 72.0347 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.277,"smiles":null,"spectrum_id":"CCMSLIB00017253490","spectrum_index":23433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 17(18)-Epoxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid (delta mass: 90.0457 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.272,"smiles":null,"spectrum_id":"CCMSLIB00017253492","spectrum_index":23434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 215.152 Da; putative annotation: N/A; putative formula: C11H21NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.202,"smiles":null,"spectrum_id":"CCMSLIB00017253494","spectrum_index":23435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19-Hydroxytestosterone (delta mass: 112.0666 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.278,"smiles":null,"spectrum_id":"CCMSLIB00017253496","spectrum_index":23436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(2E,6E,10E)-9,12-Dihydroxy-6,10-dimethyldodeca-2,6,10-trien-2-yl]-5-methyl-2,3-dihydropyran-6-one (delta mass: 74.051 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.273,"smiles":null,"spectrum_id":"CCMSLIB00017253498","spectrum_index":23437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rosiridol (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017253500","spectrum_index":23438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[1,2,4a-trimethyl-5-(3-methylbutanoyloxymethyl)-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpentanoic acid (delta mass: 142.0783 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.394,"smiles":null,"spectrum_id":"CCMSLIB00017253502","spectrum_index":23439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3S)-5-[(1S,8aR)-2,5,5,8a-tetramethyl-4-oxo-4a,6,7,8-tetrahydro-1H-naphthalen-1-yl]-3-methylpentanoic acid (delta mass: 118.0783 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.321,"smiles":null,"spectrum_id":"CCMSLIB00017253504","spectrum_index":23440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lupinine (delta mass: 22.8964 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.05,"smiles":null,"spectrum_id":"CCMSLIB00017253506","spectrum_index":23441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol (delta mass: 17.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.222,"smiles":null,"spectrum_id":"CCMSLIB00017253509","spectrum_index":23442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 178.0203 Da; putative annotation: N/A; putative formula: C8H6N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.112,"smiles":null,"spectrum_id":"CCMSLIB00017253510","spectrum_index":23443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5.alpha.-Androstan-3.beta.-ol (delta mass: 130.1174 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.37,"smiles":null,"spectrum_id":"CCMSLIB00017253513","spectrum_index":23444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl vanillate (delta mass: 197.9748 Da; putative annotation: N/A; putative formula: C6H4N2O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.04,"smiles":null,"spectrum_id":"CCMSLIB00017253515","spectrum_index":23445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7.beta.,9.alpha.)-Cedr-8(15)-en-9-ol (delta mass: 149.09 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.28,"smiles":null,"spectrum_id":"CCMSLIB00017253517","spectrum_index":23446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3S,4R,4aR,7R,8S)-8-[2-(Furan-3-yl)ethyl]-4a,7,8-trimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-2,3-diol (delta mass: 76.0683 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.29,"smiles":null,"spectrum_id":"CCMSLIB00017253520","spectrum_index":23447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-methylbenzoic acid (delta mass: 16.0313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.086,"smiles":null,"spectrum_id":"CCMSLIB00017253522","spectrum_index":23448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Oxopentanoic acid (delta mass: 28.0142 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.069,"smiles":null,"spectrum_id":"CCMSLIB00017253524","spectrum_index":23449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vanillic acid (delta mass: 112.0533 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.103,"smiles":null,"spectrum_id":"CCMSLIB00017253527","spectrum_index":23450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prostaglandin F3.alpha. (delta mass: 66.0844 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.317,"smiles":null,"spectrum_id":"CCMSLIB00017253528","spectrum_index":23451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R,4s,5S)-Piperidine-3,4,5-triol (delta mass: 82.0418 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017253531","spectrum_index":23452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.beta.-Allotetrahydrocortisol (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.295,"smiles":null,"spectrum_id":"CCMSLIB00017253532","spectrum_index":23453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid (delta mass: 316.2032 Da; putative annotation: N/A; putative formula: C20H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.414,"smiles":null,"spectrum_id":"CCMSLIB00017253535","spectrum_index":23454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 226.0282 Da; putative annotation: N/A; putative formula: C6H16N2O-1P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.141,"smiles":null,"spectrum_id":"CCMSLIB00017253536","spectrum_index":23455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 219.0532 Da; putative annotation: N/A; putative formula: C11H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.181,"smiles":null,"spectrum_id":"CCMSLIB00017253539","spectrum_index":23456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 107.0942 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.17,"smiles":null,"spectrum_id":"CCMSLIB00017253540","spectrum_index":23457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 136.052 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.164,"smiles":null,"spectrum_id":"CCMSLIB00017253543","spectrum_index":23458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Amino-4,4-dimethylpentanoic acid (delta mass: 123.0392 Da; putative annotation: N/A; putative formula: H5N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.157,"smiles":null,"spectrum_id":"CCMSLIB00017253544","spectrum_index":23459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 24S-Hydroxycholesterol (delta mass: 86.0543 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.411,"smiles":null,"spectrum_id":"CCMSLIB00017253547","spectrum_index":23460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-tert-Butylbenzoic acid (delta mass: 12.0357 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.142,"smiles":null,"spectrum_id":"CCMSLIB00017253548","spectrum_index":23461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.181,"smiles":null,"spectrum_id":"CCMSLIB00017253551","spectrum_index":23462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetylpiperazine (delta mass: 69.0592 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.161,"smiles":null,"spectrum_id":"CCMSLIB00017253552","spectrum_index":23463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroferulic acid (delta mass: 45.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.138,"smiles":null,"spectrum_id":"CCMSLIB00017253553","spectrum_index":23464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 28.9981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017253556","spectrum_index":23465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anemosapogenin (delta mass: 154.121 Da; putative annotation: N/A; putative formula: C7H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.484,"smiles":null,"spectrum_id":"CCMSLIB00017253557","spectrum_index":23466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (1S,4R)-p-Mentha-2,8-dien-1-ol from METLIN (delta mass: 91.0998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.227,"smiles":null,"spectrum_id":"CCMSLIB00017253560","spectrum_index":23467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anticopalic acid (delta mass: 198.076 Da; putative annotation: N/A; putative formula: C8H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.323,"smiles":null,"spectrum_id":"CCMSLIB00017253561","spectrum_index":23468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 80.0635 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.129,"smiles":null,"spectrum_id":"CCMSLIB00017253564","spectrum_index":23469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 81.0554 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.205,"smiles":null,"spectrum_id":"CCMSLIB00017253566","spectrum_index":23470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic JBIR 27 (delta mass: 114.0235 Da; putative annotation: N/A; putative formula: C5H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.188,"smiles":null,"spectrum_id":"CCMSLIB00017253568","spectrum_index":23471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 249.1592 Da; putative annotation: N/A; putative formula: C12H19N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.23,"smiles":null,"spectrum_id":"CCMSLIB00017253570","spectrum_index":23472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cholic Acid, Methyl Ester (delta mass: 156.0938 Da; putative annotation: N/A; putative formula: C12H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.404,"smiles":null,"spectrum_id":"CCMSLIB00017253572","spectrum_index":23473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 28.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.233,"smiles":null,"spectrum_id":"CCMSLIB00017253575","spectrum_index":23474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-4-[(1R,2S,3S,4R,8aS)-2,3,4-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one (delta mass: 146.1094 Da; putative annotation: N/A; putative formula: C11H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.331,"smiles":null,"spectrum_id":"CCMSLIB00017253577","spectrum_index":23475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18.alpha.-Glycyrrhetinic acid (delta mass: 124.0677 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.415,"smiles":null,"spectrum_id":"CCMSLIB00017253579","spectrum_index":23476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 28.0829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.148,"smiles":null,"spectrum_id":"CCMSLIB00017253581","spectrum_index":23477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 8.9939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":123.085,"smiles":null,"spectrum_id":"CCMSLIB00017253583","spectrum_index":23478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CHEMBL358188 CollisionEnergy:205060 (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.15,"smiles":null,"spectrum_id":"CCMSLIB00017253585","spectrum_index":23479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU244302 2-Amino-9H-pyrido[2,3-b]indole (AalphaC)|2-Amino-9H-pyrido[2,3-b]indole|9H-pyrido[2,3-b]indol-2-amine (delta mass: 17.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.124,"smiles":null,"spectrum_id":"CCMSLIB00017253587","spectrum_index":23480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Piperidin-4-ylpropanoic acid (delta mass: 9.9837 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.101,"smiles":null,"spectrum_id":"CCMSLIB00017253589","spectrum_index":23481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azocan-2-one (delta mass: 107.9865 Da; putative annotation: N/A; putative formula: C4HN2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.094,"smiles":null,"spectrum_id":"CCMSLIB00017253591","spectrum_index":23482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heneicosapentaenoic acid (delta mass: 82.0783 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.326,"smiles":null,"spectrum_id":"CCMSLIB00017253594","spectrum_index":23483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 112.0678 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017253596","spectrum_index":23484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 162.053 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.155,"smiles":null,"spectrum_id":"CCMSLIB00017253598","spectrum_index":23485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 117.0424 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.113,"smiles":null,"spectrum_id":"CCMSLIB00017253600","spectrum_index":23486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ursolic acid methyl ester (delta mass: 138.0888 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.472,"smiles":null,"spectrum_id":"CCMSLIB00017253602","spectrum_index":23487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminophenol (delta mass: 73.0164 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.076,"smiles":null,"spectrum_id":"CCMSLIB00017253604","spectrum_index":23488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ceanothic acid (delta mass: 111.9923 Da; putative annotation: N/A; putative formula: C3N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.334,"smiles":null,"spectrum_id":"CCMSLIB00017253606","spectrum_index":23489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caprolactam (delta mass: 300.0485 Da; putative annotation: N/A; putative formula: C15H13N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.14,"smiles":null,"spectrum_id":"CCMSLIB00017253609","spectrum_index":23490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tripropylene glycol (delta mass: 249.192 Da; putative annotation: N/A; putative formula: C16H27NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.335,"smiles":null,"spectrum_id":"CCMSLIB00017253610","spectrum_index":23491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tripropylene glycol (delta mass: 539.3989 Da; putative annotation: N/A; putative formula: C35H49N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.542,"smiles":null,"spectrum_id":"CCMSLIB00017253613","spectrum_index":23492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 65.0793 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.176,"smiles":null,"spectrum_id":"CCMSLIB00017253614","spectrum_index":23493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 16.0325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.202,"smiles":null,"spectrum_id":"CCMSLIB00017253617","spectrum_index":23494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 269.1366 Da; putative annotation: N/A; putative formula: C12H19N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.291,"smiles":null,"spectrum_id":"CCMSLIB00017253618","spectrum_index":23495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Methylbenzyl)piperazine (delta mass: 54.0457 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017253621","spectrum_index":23496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mesterolone (delta mass: 112.0663 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.314,"smiles":null,"spectrum_id":"CCMSLIB00017253622","spectrum_index":23497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-4-piperidinecarboxylic acid (delta mass: 165.1034 Da; putative annotation: N/A; putative formula: C7H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.205,"smiles":null,"spectrum_id":"CCMSLIB00017253625","spectrum_index":23498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenoxybenzenemethanol (delta mass: 353.1956 Da; putative annotation: N/A; putative formula: C19H34NO-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.287,"smiles":null,"spectrum_id":"CCMSLIB00017253626","spectrum_index":23499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 185.1781 Da; putative annotation: N/A; putative formula: C11H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.311,"smiles":null,"spectrum_id":"CCMSLIB00017253629","spectrum_index":23500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Val (delta mass: 99.0694 Da; putative annotation: L-Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.214,"smiles":null,"spectrum_id":"CCMSLIB00017253630","spectrum_index":23501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 148.0524 Da; putative annotation: Caffeoyl alcohol; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017253633","spectrum_index":23502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Leu (delta mass: 101.0473 Da; putative annotation: L-Threonine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.218,"smiles":null,"spectrum_id":"CCMSLIB00017253636","spectrum_index":23503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 132.0534 Da; putative annotation: 3-Ethylbenzoic acid; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017253637","spectrum_index":23504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 309.1212 Da; putative annotation: Massbank:PR310826 N-Fructosyl phenylalanine; putative formula: C15H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.245,"smiles":null,"spectrum_id":"CCMSLIB00017253640","spectrum_index":23505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 9.981 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.092,"smiles":null,"spectrum_id":"CCMSLIB00017253641","spectrum_index":23506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 358.2143 Da; putative annotation: N/A; putative formula: C22H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.341,"smiles":null,"spectrum_id":"CCMSLIB00017253644","spectrum_index":23507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 199.123 Da; putative annotation: N/A; putative formula: C9H18N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.288,"smiles":null,"spectrum_id":"CCMSLIB00017253646","spectrum_index":23508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Asp (delta mass: 202.0778 Da; putative annotation: N/A; putative formula: C8H14N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.181,"smiles":null,"spectrum_id":"CCMSLIB00017253648","spectrum_index":23509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 176.0327 Da; putative annotation: N/A; putative formula: C7H12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.171,"smiles":null,"spectrum_id":"CCMSLIB00017253651","spectrum_index":23510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 4.9818 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.025,"smiles":null,"spectrum_id":"CCMSLIB00017253652","spectrum_index":23511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 27.994 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017253655","spectrum_index":23512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 2.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.096,"smiles":null,"spectrum_id":"CCMSLIB00017253657","spectrum_index":23513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET050303 DEP_174.1277_10.3|N-desmethyldeprenyl (Desmethylselegiline)|1-phenyl-N-prop-2-ynylpropan-2-amine (delta mass: 146.042 Da; putative annotation: N/A; putative formula: C6H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.17,"smiles":null,"spectrum_id":"CCMSLIB00017253659","spectrum_index":23514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 416.1317 Da; putative annotation: N/A; putative formula: C16H12N14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.218,"smiles":null,"spectrum_id":"CCMSLIB00017253662","spectrum_index":23515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 309.08 Da; putative annotation: N/A; putative formula: C11H20NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.161,"smiles":null,"spectrum_id":"CCMSLIB00017253663","spectrum_index":23516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 114.0194 Da; putative annotation: N/A; putative formula: CH3N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.085,"smiles":null,"spectrum_id":"CCMSLIB00017253666","spectrum_index":23517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 162.1118 Da; putative annotation: N/A; putative formula: C5H14N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.214,"smiles":null,"spectrum_id":"CCMSLIB00017253668","spectrum_index":23518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA274410 Morphine|(5alpha,6alpha)-17-Methyl-7,8-didehydro-4,5-epoxymorphinan-3,6-diol (delta mass: 19.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.16,"smiles":null,"spectrum_id":"CCMSLIB00017253670","spectrum_index":23519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 52.0676 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.211,"smiles":null,"spectrum_id":"CCMSLIB00017253673","spectrum_index":23520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 249.0876 Da; putative annotation: N/A; putative formula: C11H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.174,"smiles":null,"spectrum_id":"CCMSLIB00017253674","spectrum_index":23521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 987.5044 Da; putative annotation: N/A; putative formula: C62H65N7O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1168.58,"smiles":null,"spectrum_id":"CCMSLIB00017253677","spectrum_index":23522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 908.4746 Da; putative annotation: N/A; putative formula: C44H80N2O9S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1101.55,"smiles":null,"spectrum_id":"CCMSLIB00017253679","spectrum_index":23523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 126.0322 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.197,"smiles":null,"spectrum_id":"CCMSLIB00017253681","spectrum_index":23524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 86.0009 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.087,"smiles":null,"spectrum_id":"CCMSLIB00017253684","spectrum_index":23525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 95.0588 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.119,"smiles":null,"spectrum_id":"CCMSLIB00017253685","spectrum_index":23526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 91.0615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.099,"smiles":null,"spectrum_id":"CCMSLIB00017253688","spectrum_index":23527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)benzamide (delta mass: 60.0215 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017253690","spectrum_index":23528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 47.0583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.101,"smiles":null,"spectrum_id":"CCMSLIB00017253692","spectrum_index":23529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 435.3354 Da; putative annotation: N/A; putative formula: C26H45NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.401,"smiles":null,"spectrum_id":"CCMSLIB00017253695","spectrum_index":23530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 224.1776 Da; putative annotation: N/A; putative formula: C14H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.285,"smiles":null,"spectrum_id":"CCMSLIB00017253696","spectrum_index":23531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 98.0736 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.186,"smiles":null,"spectrum_id":"CCMSLIB00017253699","spectrum_index":23532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 56.0725 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.185,"smiles":null,"spectrum_id":"CCMSLIB00017253701","spectrum_index":23533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 350.2099 Da; putative annotation: N/A; putative formula: C13H30N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.306,"smiles":null,"spectrum_id":"CCMSLIB00017253703","spectrum_index":23534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 190.0035 Da; putative annotation: N/A; putative formula: C6H7O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.064,"smiles":null,"spectrum_id":"CCMSLIB00017253706","spectrum_index":23535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 27.0087 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.126,"smiles":null,"spectrum_id":"CCMSLIB00017253707","spectrum_index":23536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 166.048 Da; putative annotation: N/A; putative formula: C5H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.139,"smiles":null,"spectrum_id":"CCMSLIB00017253710","spectrum_index":23537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 151.0635 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.139,"smiles":null,"spectrum_id":"CCMSLIB00017253712","spectrum_index":23538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 136.1249 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.248,"smiles":null,"spectrum_id":"CCMSLIB00017253714","spectrum_index":23539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 23.513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.584,"smiles":null,"spectrum_id":"CCMSLIB00017253716","spectrum_index":23540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 173.0637 Da; putative annotation: N/A; putative formula: C6H13N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.15,"smiles":null,"spectrum_id":"CCMSLIB00017253718","spectrum_index":23541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 637.3546 Da; putative annotation: N/A; putative formula: C38H48N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":818.425,"smiles":null,"spectrum_id":"CCMSLIB00017253721","spectrum_index":23542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-Binaphthyl-8,8'-dicarboxylic acid (delta mass: 34.0335 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.13,"smiles":null,"spectrum_id":"CCMSLIB00017253723","spectrum_index":23543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C4:0 (delta mass: 113.0839 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.291,"smiles":null,"spectrum_id":"CCMSLIB00017253725","spectrum_index":23544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-yl)ethanamine (delta mass: 74.0341 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.137,"smiles":null,"spectrum_id":"CCMSLIB00017253728","spectrum_index":23545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 24.0013 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.072,"smiles":null,"spectrum_id":"CCMSLIB00017253731","spectrum_index":23546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 185.0707 Da; putative annotation: N/A; putative formula: C9H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.157,"smiles":null,"spectrum_id":"CCMSLIB00017253732","spectrum_index":23547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 658.2826 Da; putative annotation: N/A; putative formula: C36H42N4O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.447,"smiles":null,"spectrum_id":"CCMSLIB00017253735","spectrum_index":23548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 182.1725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.221,"smiles":null,"spectrum_id":"CCMSLIB00017253737","spectrum_index":23549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HarmalolHCl2H2O///harmalol///Harmalol CollisionEnergy:102040 (delta mass: 151.083 Da; putative annotation: N/A; putative formula: C9H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.185,"smiles":null,"spectrum_id":"CCMSLIB00017253739","spectrum_index":23550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 228.0529 Da; putative annotation: N/A; putative formula: C4H12N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.118,"smiles":null,"spectrum_id":"CCMSLIB00017253742","spectrum_index":23551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 129.0427 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.171,"smiles":null,"spectrum_id":"CCMSLIB00017253743","spectrum_index":23552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 319.1269 Da; putative annotation: N/A; putative formula: C13H21NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.277,"smiles":null,"spectrum_id":"CCMSLIB00017253746","spectrum_index":23553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-C9:0 (delta mass: 70.0781 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.259,"smiles":null,"spectrum_id":"CCMSLIB00017253749","spectrum_index":23554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 73.0187 Da; putative annotation: N/A; putative formula: CH4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.096,"smiles":null,"spectrum_id":"CCMSLIB00017253750","spectrum_index":23555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 15.9964 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.067,"smiles":null,"spectrum_id":"CCMSLIB00017253753","spectrum_index":23556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Mannitol from NIST14 (delta mass: 118.0785 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.165,"smiles":null,"spectrum_id":"CCMSLIB00017253756","spectrum_index":23557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 504.2006 Da; putative annotation: N/A; putative formula: C37H29P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.323,"smiles":null,"spectrum_id":"CCMSLIB00017253757","spectrum_index":23558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 45.0183 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.145,"smiles":null,"spectrum_id":"CCMSLIB00017253760","spectrum_index":23559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 1.9954 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.063,"smiles":null,"spectrum_id":"CCMSLIB00017253762","spectrum_index":23560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 112.0529 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.145,"smiles":null,"spectrum_id":"CCMSLIB00017253764","spectrum_index":23561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 59.9223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.957,"smiles":null,"spectrum_id":"CCMSLIB00017253767","spectrum_index":23562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 87.0353 Da; putative annotation: N/A; putative formula: C2H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.111,"smiles":null,"spectrum_id":"CCMSLIB00017253769","spectrum_index":23563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1149.5693 Da; putative annotation: N/A; putative formula: C54H83N7O20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1312.63,"smiles":null,"spectrum_id":"CCMSLIB00017253771","spectrum_index":23564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 15.9763 Da; putative annotation: N/A; putative formula: O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.078,"smiles":null,"spectrum_id":"CCMSLIB00017253774","spectrum_index":23565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carmoxirole (delta mass: 135.076 Da; putative annotation: N/A; putative formula: C2H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.283,"smiles":null,"spectrum_id":"CCMSLIB00017253775","spectrum_index":23566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 115.0825 Da; putative annotation: N/A; putative formula: C6H13NO-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.132,"smiles":null,"spectrum_id":"CCMSLIB00017253778","spectrum_index":23567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 9.9883 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.122,"smiles":null,"spectrum_id":"CCMSLIB00017253781","spectrum_index":23568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 62.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017253782","spectrum_index":23569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 485.3721 Da; putative annotation: N/A; putative formula: C28H55NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.443,"smiles":null,"spectrum_id":"CCMSLIB00017253785","spectrum_index":23570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 160.1155 Da; putative annotation: N/A; putative formula: C6H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.15,"smiles":null,"spectrum_id":"CCMSLIB00017253787","spectrum_index":23571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 78.0792 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.118,"smiles":null,"spectrum_id":"CCMSLIB00017253789","spectrum_index":23572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 250.1399 Da; putative annotation: N/A; putative formula: C15H24O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.2,"smiles":null,"spectrum_id":"CCMSLIB00017253792","spectrum_index":23573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 374.2095 Da; putative annotation: N/A; putative formula: C22H30O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.301,"smiles":null,"spectrum_id":"CCMSLIB00017253794","spectrum_index":23574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 162.0526 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.165,"smiles":null,"spectrum_id":"CCMSLIB00017253796","spectrum_index":23575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 46.0053 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.069,"smiles":null,"spectrum_id":"CCMSLIB00017253799","spectrum_index":23576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 108.0233 Da; putative annotation: N/A; putative formula: C5H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.147,"smiles":null,"spectrum_id":"CCMSLIB00017253801","spectrum_index":23577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 120.1008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017253803","spectrum_index":23578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 36.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.17,"smiles":null,"spectrum_id":"CCMSLIB00017253806","spectrum_index":23579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 83.0089 Da; putative annotation: N/A; putative formula: C2HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.085,"smiles":null,"spectrum_id":"CCMSLIB00017253808","spectrum_index":23580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid CollisionEnergy:205060 (delta mass: 87.0327 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.135,"smiles":null,"spectrum_id":"CCMSLIB00017253810","spectrum_index":23581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 365.1328 Da; putative annotation: N/A; putative formula: C17H24N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.213,"smiles":null,"spectrum_id":"CCMSLIB00017253813","spectrum_index":23582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 77.0836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.148,"smiles":null,"spectrum_id":"CCMSLIB00017253814","spectrum_index":23583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 37.9837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.07,"smiles":null,"spectrum_id":"CCMSLIB00017253817","spectrum_index":23584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 72.0365 Da; putative annotation: N/A; putative formula: C7H4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.097,"smiles":null,"spectrum_id":"CCMSLIB00017253819","spectrum_index":23585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 68.9851 Da; putative annotation: N/A; putative formula: C2H-1NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.108,"smiles":null,"spectrum_id":"CCMSLIB00017253821","spectrum_index":23586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 45.0212 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017253824","spectrum_index":23587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 39.9941 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.054,"smiles":null,"spectrum_id":"CCMSLIB00017253825","spectrum_index":23588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 27.0188 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.105,"smiles":null,"spectrum_id":"CCMSLIB00017253828","spectrum_index":23589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380254-01_C17H21N3O3_10b-Hydroxy-3-isobutyl-6,10b,11,11a-tetrahydro-2H-pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-1,4(3H,5aH)-dione (delta mass: 78.0139 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.18,"smiles":null,"spectrum_id":"CCMSLIB00017253830","spectrum_index":23590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 93.0213 Da; putative annotation: N/A; putative formula: C5H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.107,"smiles":null,"spectrum_id":"CCMSLIB00017253832","spectrum_index":23591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 43.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.169,"smiles":null,"spectrum_id":"CCMSLIB00017253835","spectrum_index":23592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kenpaullone (delta mass: 343.211 Da; putative annotation: N/A; putative formula: C16H29N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.224,"smiles":null,"spectrum_id":"CCMSLIB00017253836","spectrum_index":23593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 35.0981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.2,"smiles":null,"spectrum_id":"CCMSLIB00017253839","spectrum_index":23594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169534-02_C14H18O9_Ethanone, 1-[4-(beta-D-glucopyranosyloxy)-2,6-dihydroxyphenyl]- (delta mass: 84.0146 Da; putative annotation: N/A; putative formula: C3H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.117,"smiles":null,"spectrum_id":"CCMSLIB00017253842","spectrum_index":23595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381092-01_C15H20O8_2-Acetyl-5-hydroxy-3-methylphenyl beta-D-glucopyranoside (delta mass: 160.0508 Da; putative annotation: N/A; putative formula: C4H9N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.174,"smiles":null,"spectrum_id":"CCMSLIB00017253843","spectrum_index":23596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 285.1822 Da; putative annotation: N/A; putative formula: C13H19N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.359,"smiles":null,"spectrum_id":"CCMSLIB00017253846","spectrum_index":23597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 264.2461 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.322,"smiles":null,"spectrum_id":"CCMSLIB00017253847","spectrum_index":23598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 283.2879 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.359,"smiles":null,"spectrum_id":"CCMSLIB00017253850","spectrum_index":23599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 57.0102 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017253853","spectrum_index":23600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 55.0015 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.029,"smiles":null,"spectrum_id":"CCMSLIB00017253854","spectrum_index":23601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 96.0213 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.092,"smiles":null,"spectrum_id":"CCMSLIB00017253857","spectrum_index":23602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 295.8866 Da; putative annotation: N/A; putative formula: H2N4O7P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.973,"smiles":null,"spectrum_id":"CCMSLIB00017253859","spectrum_index":23603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.097,"smiles":null,"spectrum_id":"CCMSLIB00017253861","spectrum_index":23604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 24.9952 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.113,"smiles":null,"spectrum_id":"CCMSLIB00017253864","spectrum_index":23605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 359.2676 Da; putative annotation: N/A; putative formula: C20H41NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.338,"smiles":null,"spectrum_id":"CCMSLIB00017253865","spectrum_index":23606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 296.2109 Da; putative annotation: N/A; putative formula: C17H24N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.381,"smiles":null,"spectrum_id":"CCMSLIB00017253868","spectrum_index":23607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)-1-methyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one (delta mass: 133.041 Da; putative annotation: N/A; putative formula: C3H8N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.138,"smiles":null,"spectrum_id":"CCMSLIB00017253871","spectrum_index":23608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 39.011 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.066,"smiles":null,"spectrum_id":"CCMSLIB00017253874","spectrum_index":23609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOSALICYLIC ACID (delta mass: 22.0207 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.071,"smiles":null,"spectrum_id":"CCMSLIB00017253877","spectrum_index":23610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 86.0365 Da; putative annotation: N/A; putative formula: C4H6O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017253878","spectrum_index":23611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 80.0138 Da; putative annotation: N/A; putative formula: C2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.08,"smiles":null,"spectrum_id":"CCMSLIB00017253881","spectrum_index":23612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 82.0421 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.102,"smiles":null,"spectrum_id":"CCMSLIB00017253883","spectrum_index":23613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 472.3665 Da; putative annotation: N/A; putative formula: C29H48N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.521,"smiles":null,"spectrum_id":"CCMSLIB00017253885","spectrum_index":23614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 777.4304 Da; putative annotation: N/A; putative formula: C41H63NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1060.53,"smiles":null,"spectrum_id":"CCMSLIB00017253887","spectrum_index":23615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 93.0579 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017253890","spectrum_index":23616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Allylphenoxy)acetic acid (delta mass: 27.0477 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.134,"smiles":null,"spectrum_id":"CCMSLIB00017253892","spectrum_index":23617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 50.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.186,"smiles":null,"spectrum_id":"CCMSLIB00017253895","spectrum_index":23618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 144.0781 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017253897","spectrum_index":23619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 98.0368 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.091,"smiles":null,"spectrum_id":"CCMSLIB00017253899","spectrum_index":23620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 89.0187 Da; putative annotation: N/A; putative formula: CH3N3O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.089,"smiles":null,"spectrum_id":"CCMSLIB00017253902","spectrum_index":23621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 66.0102 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.081,"smiles":null,"spectrum_id":"CCMSLIB00017253905","spectrum_index":23622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Picrinine (delta mass: 258.256 Da; putative annotation: N/A; putative formula: C12H30N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.426,"smiles":null,"spectrum_id":"CCMSLIB00017253906","spectrum_index":23623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 98.0722 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.205,"smiles":null,"spectrum_id":"CCMSLIB00017253909","spectrum_index":23624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 75.0299 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.09,"smiles":null,"spectrum_id":"CCMSLIB00017253912","spectrum_index":23625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apomorphine (delta mass: 14.012 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.145,"smiles":null,"spectrum_id":"CCMSLIB00017253913","spectrum_index":23626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 262.1083 Da; putative annotation: N/A; putative formula: C10H19N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.2,"smiles":null,"spectrum_id":"CCMSLIB00017253916","spectrum_index":23627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 369.1051 Da; putative annotation: N/A; putative formula: C10H20N5O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.196,"smiles":null,"spectrum_id":"CCMSLIB00017253917","spectrum_index":23628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 128.0463 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.175,"smiles":null,"spectrum_id":"CCMSLIB00017253920","spectrum_index":23629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 38.0511 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.163,"smiles":null,"spectrum_id":"CCMSLIB00017253923","spectrum_index":23630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 280.1047 Da; putative annotation: N/A; putative formula: C10H8N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.239,"smiles":null,"spectrum_id":"CCMSLIB00017253924","spectrum_index":23631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 115.0612 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.126,"smiles":null,"spectrum_id":"CCMSLIB00017253927","spectrum_index":23632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 632.6368 Da; putative annotation: N/A; putative formula: C45H80N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":818.708,"smiles":null,"spectrum_id":"CCMSLIB00017253930","spectrum_index":23633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 342.2127 Da; putative annotation: N/A; putative formula: C13H26N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.253,"smiles":null,"spectrum_id":"CCMSLIB00017253931","spectrum_index":23634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 307.172 Da; putative annotation: N/A; putative formula: C16H25N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.213,"smiles":null,"spectrum_id":"CCMSLIB00017253934","spectrum_index":23635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 128.0473 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.171,"smiles":null,"spectrum_id":"CCMSLIB00017253935","spectrum_index":23636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 27.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.133,"smiles":null,"spectrum_id":"CCMSLIB00017253938","spectrum_index":23637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 84.0323 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.093,"smiles":null,"spectrum_id":"CCMSLIB00017253941","spectrum_index":23638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 94.0422 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.108,"smiles":null,"spectrum_id":"CCMSLIB00017253942","spectrum_index":23639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 171.0295 Da; putative annotation: N/A; putative formula: C6HN7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.298,"smiles":null,"spectrum_id":"CCMSLIB00017253945","spectrum_index":23640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 38.0522 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017253947","spectrum_index":23641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid CollisionEnergy:205060 (delta mass: 55.0425 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017253949","spectrum_index":23642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 123.0697 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.112,"smiles":null,"spectrum_id":"CCMSLIB00017253952","spectrum_index":23643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 368.1089 Da; putative annotation: N/A; putative formula: C14H20N6O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":809.311,"smiles":null,"spectrum_id":"CCMSLIB00017253954","spectrum_index":23644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 16.0171 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.145,"smiles":null,"spectrum_id":"CCMSLIB00017253956","spectrum_index":23645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 13.992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.099,"smiles":null,"spectrum_id":"CCMSLIB00017253959","spectrum_index":23646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 589.5198 Da; putative annotation: N/A; putative formula: C37H63N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.653,"smiles":null,"spectrum_id":"CCMSLIB00017253960","spectrum_index":23647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 866.7298 Da; putative annotation: N/A; putative formula: C63H94O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1088.83,"smiles":null,"spectrum_id":"CCMSLIB00017253963","spectrum_index":23648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1,N1-dimethyl-N2-phenyl-1,2-ethanediamine (delta mass: 33.9842 Da; putative annotation: N/A; putative formula: C3H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.123,"smiles":null,"spectrum_id":"CCMSLIB00017253966","spectrum_index":23649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 179.0883 Da; putative annotation: N/A; putative formula: C9H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.138,"smiles":null,"spectrum_id":"CCMSLIB00017253968","spectrum_index":23650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 523.4585 Da; putative annotation: N/A; putative formula: C14H49N23O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.529,"smiles":null,"spectrum_id":"CCMSLIB00017253971","spectrum_index":23651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 100.0149 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.107,"smiles":null,"spectrum_id":"CCMSLIB00017253973","spectrum_index":23652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 74.0619 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017253976","spectrum_index":23653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 457.2099 Da; putative annotation: N/A; putative formula: C25H31NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.281,"smiles":null,"spectrum_id":"CCMSLIB00017253978","spectrum_index":23654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 49.0053 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.133,"smiles":null,"spectrum_id":"CCMSLIB00017253980","spectrum_index":23655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 210.0888 Da; putative annotation: N/A; putative formula: C11H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017253983","spectrum_index":23656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 90.0104 Da; putative annotation: N/A; putative formula: C6H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.134,"smiles":null,"spectrum_id":"CCMSLIB00017253984","spectrum_index":23657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 145.0792 Da; putative annotation: N/A; putative formula: C4H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.178,"smiles":null,"spectrum_id":"CCMSLIB00017253987","spectrum_index":23658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 130.0627 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.117,"smiles":null,"spectrum_id":"CCMSLIB00017253990","spectrum_index":23659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 520.1669 Da; putative annotation: N/A; putative formula: C21H36N4O3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.362,"smiles":null,"spectrum_id":"CCMSLIB00017253991","spectrum_index":23660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 37.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.092,"smiles":null,"spectrum_id":"CCMSLIB00017253994","spectrum_index":23661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 258.0369 Da; putative annotation: N/A; putative formula: C6H18N2OP4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.134,"smiles":null,"spectrum_id":"CCMSLIB00017253995","spectrum_index":23662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 92.0309 Da; putative annotation: N/A; putative formula: H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.17,"smiles":null,"spectrum_id":"CCMSLIB00017253998","spectrum_index":23663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 349.1348 Da; putative annotation: N/A; putative formula: C18H23NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.2,"smiles":null,"spectrum_id":"CCMSLIB00017254001","spectrum_index":23664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 141.0865 Da; putative annotation: N/A; putative formula: C2H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.184,"smiles":null,"spectrum_id":"CCMSLIB00017254002","spectrum_index":23665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 302.0954 Da; putative annotation: N/A; putative formula: C21H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.196,"smiles":null,"spectrum_id":"CCMSLIB00017254004","spectrum_index":23666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 40.0 eV (delta mass: 86.0636 Da; putative annotation: N/A; putative formula: C5H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.15,"smiles":null,"spectrum_id":"CCMSLIB00017254007","spectrum_index":23667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione (delta mass: 115.0845 Da; putative annotation: N/A; putative formula: C3H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.213,"smiles":null,"spectrum_id":"CCMSLIB00017254009","spectrum_index":23668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 24.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.17,"smiles":null,"spectrum_id":"CCMSLIB00017254011","spectrum_index":23669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 60.0202 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.066,"smiles":null,"spectrum_id":"CCMSLIB00017254014","spectrum_index":23670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 60.0452 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.143,"smiles":null,"spectrum_id":"CCMSLIB00017254017","spectrum_index":23671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 116.047 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017254019","spectrum_index":23672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 62.0844 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.186,"smiles":null,"spectrum_id":"CCMSLIB00017254021","spectrum_index":23673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 43.9924 Da; putative annotation: N/A; putative formula: HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.097,"smiles":null,"spectrum_id":"CCMSLIB00017254024","spectrum_index":23674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 48.0368 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.17,"smiles":null,"spectrum_id":"CCMSLIB00017254026","spectrum_index":23675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371609 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 70.0201 Da; putative annotation: N/A; putative formula: C7H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.09,"smiles":null,"spectrum_id":"CCMSLIB00017254028","spectrum_index":23676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 142.1151 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.239,"smiles":null,"spectrum_id":"CCMSLIB00017254031","spectrum_index":23677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 73.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.217,"smiles":null,"spectrum_id":"CCMSLIB00017254033","spectrum_index":23678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 26.0737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.17,"smiles":null,"spectrum_id":"CCMSLIB00017254035","spectrum_index":23679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 180.1225 Da; putative annotation: N/A; putative formula: C6H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.235,"smiles":null,"spectrum_id":"CCMSLIB00017254038","spectrum_index":23680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 144.021 Da; putative annotation: N/A; putative formula: C9H4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.081,"smiles":null,"spectrum_id":"CCMSLIB00017254039","spectrum_index":23681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bulbocapnine (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.154,"smiles":null,"spectrum_id":"CCMSLIB00017254042","spectrum_index":23682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 139.048 Da; putative annotation: N/A; putative formula: HN11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.16,"smiles":null,"spectrum_id":"CCMSLIB00017254045","spectrum_index":23683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Untitled CollisionEnergy:205060 (delta mass: 163.1693 Da; putative annotation: N/A; putative formula: C12H21NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.334,"smiles":null,"spectrum_id":"CCMSLIB00017254046","spectrum_index":23684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylglutamine (delta mass: 111.033 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.152,"smiles":null,"spectrum_id":"CCMSLIB00017254049","spectrum_index":23685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 212.0758 Da; putative annotation: Pro-Asp; putative formula: C9H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.251,"smiles":null,"spectrum_id":"CCMSLIB00017254050","spectrum_index":23686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Leu from NIST14 (delta mass: 214.132 Da; putative annotation: Ile-Thr; putative formula: C10H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.282,"smiles":null,"spectrum_id":"CCMSLIB00017254053","spectrum_index":23687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 119.0367 Da; putative annotation: 4-AMINOBENZOATE - 20.0 eV; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.16,"smiles":null,"spectrum_id":"CCMSLIB00017254056","spectrum_index":23688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 370.2083 Da; putative annotation: 2,4-Dihydroxy-6-(hydroxymethyl)-3-[(6-hydroxy-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl)methyl]benzaldehyde; putative formula: C23H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.249,"smiles":null,"spectrum_id":"CCMSLIB00017254057","spectrum_index":23689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 139.1003 Da; putative annotation: Methyl 2-[(3S)-piperidin-3-yl]acetate; putative formula: C8H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.181,"smiles":null,"spectrum_id":"CCMSLIB00017254060","spectrum_index":23690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 126.0319 Da; putative annotation: trans-2-Butene-1,4-dicarboxylic acid; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.103,"smiles":null,"spectrum_id":"CCMSLIB00017254063","spectrum_index":23691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 210.1053 Da; putative annotation: 2-[4-(Benzyloxy)phenyl]ethanol; putative formula: C15H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.181,"smiles":null,"spectrum_id":"CCMSLIB00017254064","spectrum_index":23692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 150.032 Da; putative annotation: Phloroacetophenone; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.161,"smiles":null,"spectrum_id":"CCMSLIB00017254067","spectrum_index":23693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methoxycarbonyl)but-3-enoic acid (delta mass: 144.0423 Da; putative annotation: 3-Hydroxy-3-methylglutaric acid; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.092,"smiles":null,"spectrum_id":"CCMSLIB00017254069","spectrum_index":23694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 184.0193 Da; putative annotation: Xanthotoxol; putative formula: C11H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.09,"smiles":null,"spectrum_id":"CCMSLIB00017254071","spectrum_index":23695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 228.1271 Da; putative annotation: N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]propanamide; putative formula: C14H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.198,"smiles":null,"spectrum_id":"CCMSLIB00017254074","spectrum_index":23696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 116.0831 Da; putative annotation: 1,1,1-Tris(hydroxymethyl)propane; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.196,"smiles":null,"spectrum_id":"CCMSLIB00017254077","spectrum_index":23697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 140.0739 Da; putative annotation: N/A; putative formula: C10H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.155,"smiles":null,"spectrum_id":"CCMSLIB00017254078","spectrum_index":23698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 288.2169 Da; putative annotation: N/A; putative formula: C14H24N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.267,"smiles":null,"spectrum_id":"CCMSLIB00017254081","spectrum_index":23699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 50.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017254084","spectrum_index":23700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GALACTOSAMINE (delta mass: 112.1234 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.21,"smiles":null,"spectrum_id":"CCMSLIB00017254085","spectrum_index":23701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 604.3519 Da; putative annotation: N/A; putative formula: C29H48N8O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.49,"smiles":null,"spectrum_id":"CCMSLIB00017254088","spectrum_index":23702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-acetyl-4-hydroxy-1-(2-imidazol-4-ylethyl)-2-(3-methoxyphenyl)-5-oxo-3-pyrrol ine CollisionEnergy:102040 (delta mass: 18.0352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.18,"smiles":null,"spectrum_id":"CCMSLIB00017254089","spectrum_index":23703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 927.4849 Da; putative annotation: N/A; putative formula: C40H69N11O12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1120.56,"smiles":null,"spectrum_id":"CCMSLIB00017254092","spectrum_index":23704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 149.0255 Da; putative annotation: N/A; putative formula: C5H4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.121,"smiles":null,"spectrum_id":"CCMSLIB00017254094","spectrum_index":23705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 688.2424 Da; putative annotation: N/A; putative formula: C42H43O3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1015.37,"smiles":null,"spectrum_id":"CCMSLIB00017254096","spectrum_index":23706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Furanacetic acid, 3-(3,4'-dihydroxy-2,5-dimethoxy[1,1'-biphenyl]-4-yl)-2,5-dihydro-5-oxo- (delta mass: 78.012 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.119,"smiles":null,"spectrum_id":"CCMSLIB00017254099","spectrum_index":23707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine; AIF; CE0; MS2Dec (delta mass: 282.193 Da; putative annotation: N/A; putative formula: C17H31O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.279,"smiles":null,"spectrum_id":"CCMSLIB00017254100","spectrum_index":23708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Thr (delta mass: 210.1977 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.285,"smiles":null,"spectrum_id":"CCMSLIB00017254103","spectrum_index":23709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 48.0039 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.084,"smiles":null,"spectrum_id":"CCMSLIB00017254105","spectrum_index":23710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 252.2459 Da; putative annotation: N/A; putative formula: C17H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.354,"smiles":null,"spectrum_id":"CCMSLIB00017254107","spectrum_index":23711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 103.0121 Da; putative annotation: N/A; putative formula: HN5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.092,"smiles":null,"spectrum_id":"CCMSLIB00017254110","spectrum_index":23712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 25.9774 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017254111","spectrum_index":23713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.066,"smiles":null,"spectrum_id":"CCMSLIB00017254114","spectrum_index":23714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 385.1393 Da; putative annotation: N/A; putative formula: C19H23N5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.199,"smiles":null,"spectrum_id":"CCMSLIB00017254116","spectrum_index":23715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 72.0335 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.104,"smiles":null,"spectrum_id":"CCMSLIB00017254118","spectrum_index":23716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 364.4152 Da; putative annotation: N/A; putative formula: C25H52N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.456,"smiles":null,"spectrum_id":"CCMSLIB00017254121","spectrum_index":23717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylose (delta mass: 6.0399 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.1,"smiles":null,"spectrum_id":"CCMSLIB00017254123","spectrum_index":23718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 99.0761 Da; putative annotation: N/A; putative formula: C4H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.209,"smiles":null,"spectrum_id":"CCMSLIB00017254125","spectrum_index":23719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 39.9939 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.179,"smiles":null,"spectrum_id":"CCMSLIB00017254128","spectrum_index":23720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pantothenic acid (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017254129","spectrum_index":23721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 341.1319 Da; putative annotation: N/A; putative formula: C25H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.255,"smiles":null,"spectrum_id":"CCMSLIB00017254132","spectrum_index":23722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 120.0915 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.132,"smiles":null,"spectrum_id":"CCMSLIB00017254133","spectrum_index":23723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 407.3711 Da; putative annotation: N/A; putative formula: C25H49N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.447,"smiles":null,"spectrum_id":"CCMSLIB00017254136","spectrum_index":23724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 134.0729 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.154,"smiles":null,"spectrum_id":"CCMSLIB00017254137","spectrum_index":23725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 161.1009 Da; putative annotation: N/A; putative formula: C3H11N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.199,"smiles":null,"spectrum_id":"CCMSLIB00017254140","spectrum_index":23726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 220.224 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.347,"smiles":null,"spectrum_id":"CCMSLIB00017254141","spectrum_index":23727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 162.0528 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.134,"smiles":null,"spectrum_id":"CCMSLIB00017254144","spectrum_index":23728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 710.2613 Da; putative annotation: N/A; putative formula: C40H30N12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.343,"smiles":null,"spectrum_id":"CCMSLIB00017254145","spectrum_index":23729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 60.045 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.319,"smiles":null,"spectrum_id":"CCMSLIB00017254148","spectrum_index":23730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 226.1682 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.312,"smiles":null,"spectrum_id":"CCMSLIB00017254149","spectrum_index":23731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imazaquin (delta mass: 622.2847 Da; putative annotation: N/A; putative formula: C39H43O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":934.419,"smiles":null,"spectrum_id":"CCMSLIB00017254152","spectrum_index":23732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 491.2397 Da; putative annotation: N/A; putative formula: C21H38N3O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.31,"smiles":null,"spectrum_id":"CCMSLIB00017254155","spectrum_index":23733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 239.1369 Da; putative annotation: N/A; putative formula: C13H23NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.191,"smiles":null,"spectrum_id":"CCMSLIB00017254157","spectrum_index":23734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 812.5885 Da; putative annotation: N/A; putative formula: C44H84N4O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":980.69,"smiles":null,"spectrum_id":"CCMSLIB00017254160","spectrum_index":23735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 297.3029 Da; putative annotation: N/A; putative formula: C19H39NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.368,"smiles":null,"spectrum_id":"CCMSLIB00017254162","spectrum_index":23736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-1H-indole-3-carbaldehyde (delta mass: 235.1459 Da; putative annotation: N/A; putative formula: C9H22N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.167,"smiles":null,"spectrum_id":"CCMSLIB00017254164","spectrum_index":23737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 56.0632 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.16,"smiles":null,"spectrum_id":"CCMSLIB00017254167","spectrum_index":23738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 177.1703 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.277,"smiles":null,"spectrum_id":"CCMSLIB00017254168","spectrum_index":23739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 8.9892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017254171","spectrum_index":23740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 248.0884 Da; putative annotation: N/A; putative formula: C14H18P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.237,"smiles":null,"spectrum_id":"CCMSLIB00017254173","spectrum_index":23741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 396.2385 Da; putative annotation: N/A; putative formula: C20H28N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.387,"smiles":null,"spectrum_id":"CCMSLIB00017254175","spectrum_index":23742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Glu (delta mass: 83.0373 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.166,"smiles":null,"spectrum_id":"CCMSLIB00017254178","spectrum_index":23743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 57.0277 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.103,"smiles":null,"spectrum_id":"CCMSLIB00017254180","spectrum_index":23744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Gln (delta mass: 129.0421 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.177,"smiles":null,"spectrum_id":"CCMSLIB00017254183","spectrum_index":23745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 30.0131 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.089,"smiles":null,"spectrum_id":"CCMSLIB00017254185","spectrum_index":23746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 59.0391 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.094,"smiles":null,"spectrum_id":"CCMSLIB00017254187","spectrum_index":23747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 10.9866 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.11,"smiles":null,"spectrum_id":"CCMSLIB00017254190","spectrum_index":23748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 397.3036 Da; putative annotation: N/A; putative formula: C16H35N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.369,"smiles":null,"spectrum_id":"CCMSLIB00017254193","spectrum_index":23749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 308.1973 Da; putative annotation: N/A; putative formula: C12H29N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.257,"smiles":null,"spectrum_id":"CCMSLIB00017254194","spectrum_index":23750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C5:0 (delta mass: 43.9899 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.134,"smiles":null,"spectrum_id":"CCMSLIB00017254197","spectrum_index":23751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 136.0386 Da; putative annotation: N/A; putative formula: C5H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.115,"smiles":null,"spectrum_id":"CCMSLIB00017254199","spectrum_index":23752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 86.0822 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.179,"smiles":null,"spectrum_id":"CCMSLIB00017254201","spectrum_index":23753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 185.0873 Da; putative annotation: N/A; putative formula: C9H15NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.277,"smiles":null,"spectrum_id":"CCMSLIB00017254204","spectrum_index":23754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benz[a]anthracen-1-ol, 8-methoxy-3-methyl- (delta mass: 46.0184 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.141,"smiles":null,"spectrum_id":"CCMSLIB00017254207","spectrum_index":23755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 102.0826 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.163,"smiles":null,"spectrum_id":"CCMSLIB00017254209","spectrum_index":23756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1149.5493 Da; putative annotation: N/A; putative formula: C58H75N11O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1312.61,"smiles":null,"spectrum_id":"CCMSLIB00017254211","spectrum_index":23757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 33.0192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.105,"smiles":null,"spectrum_id":"CCMSLIB00017254214","spectrum_index":23758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 128.1408 Da; putative annotation: N/A; putative formula: C6H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.279,"smiles":null,"spectrum_id":"CCMSLIB00017254216","spectrum_index":23759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 38.0158 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.06,"smiles":null,"spectrum_id":"CCMSLIB00017254219","spectrum_index":23760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 286.1906 Da; putative annotation: N/A; putative formula: C15H22N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.367,"smiles":null,"spectrum_id":"CCMSLIB00017254221","spectrum_index":23761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 191.027 Da; putative annotation: N/A; putative formula: C7H5N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.087,"smiles":null,"spectrum_id":"CCMSLIB00017254224","spectrum_index":23762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000462 Glutamic acid|2-aminopentanedioic acid (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017254226","spectrum_index":23763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 105.0895 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.192,"smiles":null,"spectrum_id":"CCMSLIB00017254228","spectrum_index":23764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 159.0911 Da; putative annotation: N/A; putative formula: C8H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.178,"smiles":null,"spectrum_id":"CCMSLIB00017254230","spectrum_index":23765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 223.1209 Da; putative annotation: N/A; putative formula: C12H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.191,"smiles":null,"spectrum_id":"CCMSLIB00017254233","spectrum_index":23766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:205060\"\" (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017254234","spectrum_index":23767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.076,"smiles":null,"spectrum_id":"CCMSLIB00017254237","spectrum_index":23768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 113.1998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.295,"smiles":null,"spectrum_id":"CCMSLIB00017254240","spectrum_index":23769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017254242","spectrum_index":23770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 324.0636 Da; putative annotation: N/A; putative formula: C11H20N2O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.187,"smiles":null,"spectrum_id":"CCMSLIB00017254244","spectrum_index":23771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 84.0575 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017254247","spectrum_index":23772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 357.1349 Da; putative annotation: N/A; putative formula: C17H20N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.247,"smiles":null,"spectrum_id":"CCMSLIB00017254248","spectrum_index":23773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 55.9022 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.974,"smiles":null,"spectrum_id":"CCMSLIB00017254251","spectrum_index":23774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 315.1896 Da; putative annotation: N/A; putative formula: C15H30N3PS)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.26,"smiles":null,"spectrum_id":"CCMSLIB00017254254","spectrum_index":23775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 301.0512 Da; putative annotation: N/A; putative formula: C16H16NO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.117,"smiles":null,"spectrum_id":"CCMSLIB00017254255","spectrum_index":23776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 79.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017254258","spectrum_index":23777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 457.2093 Da; putative annotation: N/A; putative formula: C19H32N5O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.28,"smiles":null,"spectrum_id":"CCMSLIB00017254259","spectrum_index":23778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 42.0078 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.11,"smiles":null,"spectrum_id":"CCMSLIB00017254262","spectrum_index":23779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 524.3975 Da; putative annotation: N/A; putative formula: C33H52N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.458,"smiles":null,"spectrum_id":"CCMSLIB00017254265","spectrum_index":23780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 243.0856 Da; putative annotation: N/A; putative formula: C9H13N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.181,"smiles":null,"spectrum_id":"CCMSLIB00017254266","spectrum_index":23781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 291.1616 Da; putative annotation: N/A; putative formula: C12H25N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.207,"smiles":null,"spectrum_id":"CCMSLIB00017254269","spectrum_index":23782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 473.1905 Da; putative annotation: N/A; putative formula: C22H35NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.251,"smiles":null,"spectrum_id":"CCMSLIB00017254270","spectrum_index":23783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 284.0324 Da; putative annotation: N/A; putative formula: C8H16N2O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.161,"smiles":null,"spectrum_id":"CCMSLIB00017254273","spectrum_index":23784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 227.0903 Da; putative annotation: N/A; putative formula: C9H13N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.15,"smiles":null,"spectrum_id":"CCMSLIB00017254276","spectrum_index":23785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 54.0108 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017254277","spectrum_index":23786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 58.0347 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.105,"smiles":null,"spectrum_id":"CCMSLIB00017254280","spectrum_index":23787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 128.0549 Da; putative annotation: N/A; putative formula: CH4N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.094,"smiles":null,"spectrum_id":"CCMSLIB00017254281","spectrum_index":23788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 537.1485 Da; putative annotation: N/A; putative formula: C19H24N9O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.188,"smiles":null,"spectrum_id":"CCMSLIB00017254284","spectrum_index":23789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 400.1477 Da; putative annotation: N/A; putative formula: C19H29O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.266,"smiles":null,"spectrum_id":"CCMSLIB00017254287","spectrum_index":23790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 286.1681 Da; putative annotation: N/A; putative formula: C17H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.27,"smiles":null,"spectrum_id":"CCMSLIB00017254288","spectrum_index":23791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 206.1631 Da; putative annotation: N/A; putative formula: C10H18N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.25,"smiles":null,"spectrum_id":"CCMSLIB00017254291","spectrum_index":23792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 178.0323 Da; putative annotation: N/A; putative formula: C5H11N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.091,"smiles":null,"spectrum_id":"CCMSLIB00017254294","spectrum_index":23793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 241.19 Da; putative annotation: N/A; putative formula: C11H23N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.276,"smiles":null,"spectrum_id":"CCMSLIB00017254295","spectrum_index":23794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 836.7167 Da; putative annotation: N/A; putative formula: C43H84N18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1511.96,"smiles":null,"spectrum_id":"CCMSLIB00017254298","spectrum_index":23795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 320.853 Da; putative annotation: N/A; putative formula: C8H3NOS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":996.099,"smiles":null,"spectrum_id":"CCMSLIB00017254301","spectrum_index":23796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 454.2178 Da; putative annotation: N/A; putative formula: C27H34O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.403,"smiles":null,"spectrum_id":"CCMSLIB00017254302","spectrum_index":23797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 365.1305 Da; putative annotation: N/A; putative formula: C14H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.201,"smiles":null,"spectrum_id":"CCMSLIB00017254305","spectrum_index":23798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 130.0498 Da; putative annotation: N/A; putative formula: C3H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.111,"smiles":null,"spectrum_id":"CCMSLIB00017254308","spectrum_index":23799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 48.0065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.056,"smiles":null,"spectrum_id":"CCMSLIB00017254309","spectrum_index":23800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 415.1691 Da; putative annotation: N/A; putative formula: C21H21N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.24,"smiles":null,"spectrum_id":"CCMSLIB00017254312","spectrum_index":23801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-O-((2E)-3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoyl)hex-2-ulofuranosyl hexopyranoside (delta mass: 284.0312 Da; putative annotation: N/A; putative formula: C9H9N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.202,"smiles":null,"spectrum_id":"CCMSLIB00017254315","spectrum_index":23802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 644.4337 Da; putative annotation: N/A; putative formula: C36H60N4O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.583,"smiles":null,"spectrum_id":"CCMSLIB00017254317","spectrum_index":23803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole-3-acetic acid (delta mass: 40.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.155,"smiles":null,"spectrum_id":"CCMSLIB00017254320","spectrum_index":23804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 276.0851 Da; putative annotation: N/A; putative formula: C14H17N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.166,"smiles":null,"spectrum_id":"CCMSLIB00017254322","spectrum_index":23805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 74.0085 Da; putative annotation: N/A; putative formula: CH2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.095,"smiles":null,"spectrum_id":"CCMSLIB00017254324","spectrum_index":23806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 18.0185 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.133,"smiles":null,"spectrum_id":"CCMSLIB00017254327","spectrum_index":23807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 986.7329 Da; putative annotation: N/A; putative formula: C61H98N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1120.83,"smiles":null,"spectrum_id":"CCMSLIB00017254330","spectrum_index":23808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 238.1448 Da; putative annotation: N/A; putative formula: C11H18N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.215,"smiles":null,"spectrum_id":"CCMSLIB00017254331","spectrum_index":23809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017254334","spectrum_index":23810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 240.2453 Da; putative annotation: N/A; putative formula: C16H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.336,"smiles":null,"spectrum_id":"CCMSLIB00017254337","spectrum_index":23811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 449.3169 Da; putative annotation: N/A; putative formula: C25H44N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.388,"smiles":null,"spectrum_id":"CCMSLIB00017254338","spectrum_index":23812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 174.0799 Da; putative annotation: N/A; putative formula: C3H10N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.135,"smiles":null,"spectrum_id":"CCMSLIB00017254341","spectrum_index":23813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 703.3394 Da; putative annotation: N/A; putative formula: C30H53N7O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.424,"smiles":null,"spectrum_id":"CCMSLIB00017254344","spectrum_index":23814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.134,"smiles":null,"spectrum_id":"CCMSLIB00017254345","spectrum_index":23815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 362.1575 Da; putative annotation: N/A; putative formula: C14H14N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.197,"smiles":null,"spectrum_id":"CCMSLIB00017254348","spectrum_index":23816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 194.1295 Da; putative annotation: N/A; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.17,"smiles":null,"spectrum_id":"CCMSLIB00017254351","spectrum_index":23817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 375.2986 Da; putative annotation: N/A; putative formula: C20H41NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.369,"smiles":null,"spectrum_id":"CCMSLIB00017254352","spectrum_index":23818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 945.4936 Da; putative annotation: N/A; putative formula: C52H67N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1108.55,"smiles":null,"spectrum_id":"CCMSLIB00017254355","spectrum_index":23819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 426.2621 Da; putative annotation: N/A; putative formula: C26H39N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.322,"smiles":null,"spectrum_id":"CCMSLIB00017254358","spectrum_index":23820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 46.0803 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.14,"smiles":null,"spectrum_id":"CCMSLIB00017254359","spectrum_index":23821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 260.1627 Da; putative annotation: N/A; putative formula: C13H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.26,"smiles":null,"spectrum_id":"CCMSLIB00017254362","spectrum_index":23822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-tryptophan (delta mass: 106.042 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.15,"smiles":null,"spectrum_id":"CCMSLIB00017254363","spectrum_index":23823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 653.2166 Da; putative annotation: N/A; putative formula: C26H39NO18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.287,"smiles":null,"spectrum_id":"CCMSLIB00017254366","spectrum_index":23824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-3-pyridazinol (delta mass: 46.005 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.06,"smiles":null,"spectrum_id":"CCMSLIB00017254369","spectrum_index":23825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 230.0417 Da; putative annotation: N/A; putative formula: C13H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.102,"smiles":null,"spectrum_id":"CCMSLIB00017254370","spectrum_index":23826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 167.0432 Da; putative annotation: N/A; putative formula: C4H9NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.124,"smiles":null,"spectrum_id":"CCMSLIB00017254373","spectrum_index":23827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 133.1487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.22,"smiles":null,"spectrum_id":"CCMSLIB00017254374","spectrum_index":23828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 255.2573 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.312,"smiles":null,"spectrum_id":"CCMSLIB00017254377","spectrum_index":23829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 88.0677 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017254380","spectrum_index":23830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 84.0208 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017254381","spectrum_index":23831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 284.2683 Da; putative annotation: N/A; putative formula: C14H32N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.427,"smiles":null,"spectrum_id":"CCMSLIB00017254384","spectrum_index":23832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 170.0566 Da; putative annotation: N/A; putative formula: C12H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.168,"smiles":null,"spectrum_id":"CCMSLIB00017254387","spectrum_index":23833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 283.1782 Da; putative annotation: N/A; putative formula: C15H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.238,"smiles":null,"spectrum_id":"CCMSLIB00017254388","spectrum_index":23834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.086,"smiles":null,"spectrum_id":"CCMSLIB00017254391","spectrum_index":23835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ellipticine (delta mass: 32.035 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.158,"smiles":null,"spectrum_id":"CCMSLIB00017254394","spectrum_index":23836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 29.4243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017254395","spectrum_index":23837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 162.0713 Da; putative annotation: N/A; putative formula: C7H14O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.142,"smiles":null,"spectrum_id":"CCMSLIB00017254398","spectrum_index":23838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-yl)ethanamine (delta mass: 87.0816 Da; putative annotation: N/A; putative formula: C3H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.184,"smiles":null,"spectrum_id":"CCMSLIB00017254399","spectrum_index":23839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 171.1253 Da; putative annotation: N/A; putative formula: C9H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.258,"smiles":null,"spectrum_id":"CCMSLIB00017254402","spectrum_index":23840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 27.9968 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.063,"smiles":null,"spectrum_id":"CCMSLIB00017254405","spectrum_index":23841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 284.0908 Da; putative annotation: N/A; putative formula: C14H12N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.24,"smiles":null,"spectrum_id":"CCMSLIB00017254406","spectrum_index":23842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 180.0639 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.15,"smiles":null,"spectrum_id":"CCMSLIB00017254409","spectrum_index":23843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 36.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017254410","spectrum_index":23844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 46.0052 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.133,"smiles":null,"spectrum_id":"CCMSLIB00017254413","spectrum_index":23845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00178646-02!2,4-dihydroxyheptadecyl acetate (delta mass: 64.0687 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.353,"smiles":null,"spectrum_id":"CCMSLIB00017254416","spectrum_index":23846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 44.0357 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017254417","spectrum_index":23847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.123,"smiles":null,"spectrum_id":"CCMSLIB00017254420","spectrum_index":23848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 92.0476 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017254422","spectrum_index":23849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 177.0451 Da; putative annotation: N/A; putative formula: C8H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.142,"smiles":null,"spectrum_id":"CCMSLIB00017254424","spectrum_index":23850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 40.0152 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.143,"smiles":null,"spectrum_id":"CCMSLIB00017254427","spectrum_index":23851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucine propyl ester (delta mass: 113.0843 Da; putative annotation: Massbank:PR311151 Isoleucine (not validated); putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.233,"smiles":null,"spectrum_id":"CCMSLIB00017254428","spectrum_index":23852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 113.0838 Da; putative annotation: 2-Amino-2-ethylbutanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.228,"smiles":null,"spectrum_id":"CCMSLIB00017254431","spectrum_index":23853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 149.0519 Da; putative annotation: 2-Amino-3-methoxybenzoic acid; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.129,"smiles":null,"spectrum_id":"CCMSLIB00017254434","spectrum_index":23854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 162.0781 Da; putative annotation: L-Tyrosinamide; putative formula: C9H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.164,"smiles":null,"spectrum_id":"CCMSLIB00017254435","spectrum_index":23855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 128.0594 Da; putative annotation: 3-Ureidoisobutyric acid; AIF; CE0; CorrDec; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.204,"smiles":null,"spectrum_id":"CCMSLIB00017254438","spectrum_index":23856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 154.0989 Da; putative annotation: 8-Oxononanoic acid; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.17,"smiles":null,"spectrum_id":"CCMSLIB00017254439","spectrum_index":23857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 162.052 Da; putative annotation: 2-(Hydroxymethyl)-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one; putative formula: C7H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.091,"smiles":null,"spectrum_id":"CCMSLIB00017254442","spectrum_index":23858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 162.0526 Da; putative annotation: D-(+)-Mannose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.103,"smiles":null,"spectrum_id":"CCMSLIB00017254444","spectrum_index":23859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 310.1054 Da; putative annotation: 3-(4-(.beta.-D-Glucopyranosyloxy)phenyl)propanoic acid; putative formula: C15H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.165,"smiles":null,"spectrum_id":"CCMSLIB00017254446","spectrum_index":23860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 288.0844 Da; putative annotation: 2-(2-Oxo-2-(quinolin-3-ylamino)ethyl)benzoic acid; putative formula: C18H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017254449","spectrum_index":23861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 64.068 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.201,"smiles":null,"spectrum_id":"CCMSLIB00017254451","spectrum_index":23862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate (delta mass: 56.1883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.28,"smiles":null,"spectrum_id":"CCMSLIB00017254453","spectrum_index":23863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 165.173 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.275,"smiles":null,"spectrum_id":"CCMSLIB00017254456","spectrum_index":23864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 853.4823 Da; putative annotation: N/A; putative formula: C42H59N15O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.55,"smiles":null,"spectrum_id":"CCMSLIB00017254457","spectrum_index":23865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 553.2154 Da; putative annotation: N/A; putative formula: C39H27N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.38,"smiles":null,"spectrum_id":"CCMSLIB00017254460","spectrum_index":23866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 32.9521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.038,"smiles":null,"spectrum_id":"CCMSLIB00017254463","spectrum_index":23867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 148.1481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.276,"smiles":null,"spectrum_id":"CCMSLIB00017254464","spectrum_index":23868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 479.287 Da; putative annotation: N/A; putative formula: C30H43NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.358,"smiles":null,"spectrum_id":"CCMSLIB00017254467","spectrum_index":23869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 677.2399 Da; putative annotation: N/A; putative formula: C40H27N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.3,"smiles":null,"spectrum_id":"CCMSLIB00017254470","spectrum_index":23870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 376.1011 Da; putative annotation: N/A; putative formula: C18H21N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.161,"smiles":null,"spectrum_id":"CCMSLIB00017254471","spectrum_index":23871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 421.1378 Da; putative annotation: N/A; putative formula: C23H24N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.208,"smiles":null,"spectrum_id":"CCMSLIB00017254474","spectrum_index":23872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 170.0947 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.16,"smiles":null,"spectrum_id":"CCMSLIB00017254476","spectrum_index":23873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 96.069 Da; putative annotation: N/A; putative formula: C5H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.129,"smiles":null,"spectrum_id":"CCMSLIB00017254479","spectrum_index":23874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 94.066 Da; putative annotation: N/A; putative formula: C4H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.205,"smiles":null,"spectrum_id":"CCMSLIB00017254481","spectrum_index":23875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 156.0788 Da; putative annotation: N/A; putative formula: C8H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.207,"smiles":null,"spectrum_id":"CCMSLIB00017254484","spectrum_index":23876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 141.0754 Da; putative annotation: N/A; putative formula: C3H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.166,"smiles":null,"spectrum_id":"CCMSLIB00017254485","spectrum_index":23877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 143.888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.915,"smiles":null,"spectrum_id":"CCMSLIB00017254488","spectrum_index":23878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 11.9767 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.042,"smiles":null,"spectrum_id":"CCMSLIB00017254490","spectrum_index":23879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 662.5328 Da; putative annotation: N/A; putative formula: C37H74O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1197.8,"smiles":null,"spectrum_id":"CCMSLIB00017254492","spectrum_index":23880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 555.1222 Da; putative annotation: N/A; putative formula: C29H25N5OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.182,"smiles":null,"spectrum_id":"CCMSLIB00017254495","spectrum_index":23881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 114.0347 Da; putative annotation: N/A; putative formula: C4H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.158,"smiles":null,"spectrum_id":"CCMSLIB00017254496","spectrum_index":23882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 189.0793 Da; putative annotation: N/A; putative formula: C11H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.175,"smiles":null,"spectrum_id":"CCMSLIB00017254499","spectrum_index":23883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 8.9896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.139,"smiles":null,"spectrum_id":"CCMSLIB00017254502","spectrum_index":23884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Ile (delta mass: 242.1269 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.288,"smiles":null,"spectrum_id":"CCMSLIB00017254503","spectrum_index":23885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 142.1358 Da; putative annotation: N/A; putative formula: C9H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.213,"smiles":null,"spectrum_id":"CCMSLIB00017254506","spectrum_index":23886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 398.1176 Da; putative annotation: N/A; putative formula: C15H29O6P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.225,"smiles":null,"spectrum_id":"CCMSLIB00017254509","spectrum_index":23887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 182.0973 Da; putative annotation: N/A; putative formula: C9H15N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.145,"smiles":null,"spectrum_id":"CCMSLIB00017254510","spectrum_index":23888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 368.1425 Da; putative annotation: N/A; putative formula: C26H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.213,"smiles":null,"spectrum_id":"CCMSLIB00017254513","spectrum_index":23889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 18.007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.066,"smiles":null,"spectrum_id":"CCMSLIB00017254516","spectrum_index":23890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 96.9611 Da; putative annotation: N/A; putative formula: C3H-1NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.157,"smiles":null,"spectrum_id":"CCMSLIB00017254519","spectrum_index":23891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylglutamine (delta mass: 182.1665 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.285,"smiles":null,"spectrum_id":"CCMSLIB00017254520","spectrum_index":23892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 14.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.101,"smiles":null,"spectrum_id":"CCMSLIB00017254523","spectrum_index":23893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of emetine (delta mass: 17.0949 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.401,"smiles":null,"spectrum_id":"CCMSLIB00017254525","spectrum_index":23894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 130.0967 Da; putative annotation: N/A; putative formula: C3H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.225,"smiles":null,"spectrum_id":"CCMSLIB00017254527","spectrum_index":23895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 543.4852 Da; putative annotation: N/A; putative formula: C29H57N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.545,"smiles":null,"spectrum_id":"CCMSLIB00017254530","spectrum_index":23896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 409.2105 Da; putative annotation: N/A; putative formula: C24H32N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.281,"smiles":null,"spectrum_id":"CCMSLIB00017254531","spectrum_index":23897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 179.056 Da; putative annotation: N/A; putative formula: C5H5N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.232,"smiles":null,"spectrum_id":"CCMSLIB00017254534","spectrum_index":23898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 138.0316 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.071,"smiles":null,"spectrum_id":"CCMSLIB00017254537","spectrum_index":23899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 274.1937 Da; putative annotation: N/A; putative formula: C18H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.295,"smiles":null,"spectrum_id":"CCMSLIB00017254538","spectrum_index":23900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 314.1899 Da; putative annotation: N/A; putative formula: C21H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.25,"smiles":null,"spectrum_id":"CCMSLIB00017254541","spectrum_index":23901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 249.2449 Da; putative annotation: N/A; putative formula: C17H31N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.337,"smiles":null,"spectrum_id":"CCMSLIB00017254544","spectrum_index":23902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 111.0681 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.175,"smiles":null,"spectrum_id":"CCMSLIB00017254545","spectrum_index":23903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 126.0791 Da; putative annotation: N/A; putative formula: C6H10N2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.139,"smiles":null,"spectrum_id":"CCMSLIB00017254548","spectrum_index":23904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 39.9443 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.031,"smiles":null,"spectrum_id":"CCMSLIB00017254551","spectrum_index":23905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250803 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 101.0743 Da; putative annotation: N/A; putative formula: C5H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.134,"smiles":null,"spectrum_id":"CCMSLIB00017254553","spectrum_index":23906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 456.1966 Da; putative annotation: N/A; putative formula: C28H29N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":811.33,"smiles":null,"spectrum_id":"CCMSLIB00017254556","spectrum_index":23907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311082 Dicoumaroyl Spermidine (delta mass: 162.0322 Da; putative annotation: N/A; putative formula: C2H6N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.271,"smiles":null,"spectrum_id":"CCMSLIB00017254558","spectrum_index":23908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 134.0586 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.333,"smiles":null,"spectrum_id":"CCMSLIB00017254561","spectrum_index":23909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYANTHRANILATE - 30.0 eV (delta mass: 42.1043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.154,"smiles":null,"spectrum_id":"CCMSLIB00017254563","spectrum_index":23910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 294.293 Da; putative annotation: N/A; putative formula: C20H38O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.346,"smiles":null,"spectrum_id":"CCMSLIB00017254566","spectrum_index":23911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 180.1143 Da; putative annotation: N/A; putative formula: C11H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.394,"smiles":null,"spectrum_id":"CCMSLIB00017254569","spectrum_index":23912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 138.0791 Da; putative annotation: N/A; putative formula: C7H10N2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.139,"smiles":null,"spectrum_id":"CCMSLIB00017254572","spectrum_index":23913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 243.1471 Da; putative annotation: N/A; putative formula: C12H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.213,"smiles":null,"spectrum_id":"CCMSLIB00017254574","spectrum_index":23914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 82.003 Da; putative annotation: N/A; putative formula: H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.1,"smiles":null,"spectrum_id":"CCMSLIB00017254576","spectrum_index":23915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 92.0465 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.2,"smiles":null,"spectrum_id":"CCMSLIB00017254579","spectrum_index":23916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 143.1311 Da; putative annotation: N/A; putative formula: C8H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.196,"smiles":null,"spectrum_id":"CCMSLIB00017254582","spectrum_index":23917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 142.0748 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.151,"smiles":null,"spectrum_id":"CCMSLIB00017254583","spectrum_index":23918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.175,"smiles":null,"spectrum_id":"CCMSLIB00017254586","spectrum_index":23919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 141.0434 Da; putative annotation: N/A; putative formula: C7H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.13,"smiles":null,"spectrum_id":"CCMSLIB00017254587","spectrum_index":23920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017254590","spectrum_index":23921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Homoserine (delta mass: 23.0145 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.08,"smiles":null,"spectrum_id":"CCMSLIB00017254591","spectrum_index":23922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-2-carboxylic acid (delta mass: 124.052 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.086,"smiles":null,"spectrum_id":"CCMSLIB00017254594","spectrum_index":23923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 228.209 Da; putative annotation: N/A; putative formula: C14H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.274,"smiles":null,"spectrum_id":"CCMSLIB00017254597","spectrum_index":23924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 89.0109 Da; putative annotation: N/A; putative formula: C2H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.081,"smiles":null,"spectrum_id":"CCMSLIB00017254598","spectrum_index":23925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 82.0777 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.268,"smiles":null,"spectrum_id":"CCMSLIB00017254601","spectrum_index":23926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 48.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.108,"smiles":null,"spectrum_id":"CCMSLIB00017254604","spectrum_index":23927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 144.16 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017254606","spectrum_index":23928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 118.0783 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017254609","spectrum_index":23929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 44.959 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.019,"smiles":null,"spectrum_id":"CCMSLIB00017254611","spectrum_index":23930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 186.0777 Da; putative annotation: N/A; putative formula: C7H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.153,"smiles":null,"spectrum_id":"CCMSLIB00017254614","spectrum_index":23931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 52.0675 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.174,"smiles":null,"spectrum_id":"CCMSLIB00017254615","spectrum_index":23932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentanedioic acid, 2-hydroxy, 1,5-diethyl ester (delta mass: 110.0929 Da; putative annotation: N/A; putative formula: C5H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.2,"smiles":null,"spectrum_id":"CCMSLIB00017254618","spectrum_index":23933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 114.0684 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.123,"smiles":null,"spectrum_id":"CCMSLIB00017254620","spectrum_index":23934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 43.0833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.11,"smiles":null,"spectrum_id":"CCMSLIB00017254623","spectrum_index":23935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 78.0316 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017254625","spectrum_index":23936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 105.0659 Da; putative annotation: N/A; putative formula: CH7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.173,"smiles":null,"spectrum_id":"CCMSLIB00017254627","spectrum_index":23937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 198.1628 Da; putative annotation: N/A; putative formula: C12H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.241,"smiles":null,"spectrum_id":"CCMSLIB00017254630","spectrum_index":23938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 102.1119 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.204,"smiles":null,"spectrum_id":"CCMSLIB00017254632","spectrum_index":23939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 144.0434 Da; putative annotation: N/A; putative formula: C7H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.192,"smiles":null,"spectrum_id":"CCMSLIB00017254634","spectrum_index":23940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 50.0158 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.076,"smiles":null,"spectrum_id":"CCMSLIB00017254637","spectrum_index":23941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 88.0177 Da; putative annotation: N/A; putative formula: C4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.171,"smiles":null,"spectrum_id":"CCMSLIB00017254638","spectrum_index":23942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 332.2912 Da; putative annotation: N/A; putative formula: C23H40O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.388,"smiles":null,"spectrum_id":"CCMSLIB00017254641","spectrum_index":23943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 180.1515 Da; putative annotation: N/A; putative formula: C12H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.233,"smiles":null,"spectrum_id":"CCMSLIB00017254644","spectrum_index":23944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.071,"smiles":null,"spectrum_id":"CCMSLIB00017254645","spectrum_index":23945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA270101 10,11-trans-Dihydroxy-10,11-dihydrocarbamazepine|(5S,6S)-5,6-bis(oxidanyl)-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 119.112 Da; putative annotation: N/A; putative formula: C9H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.22,"smiles":null,"spectrum_id":"CCMSLIB00017254648","spectrum_index":23946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 80.0629 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.222,"smiles":null,"spectrum_id":"CCMSLIB00017254649","spectrum_index":23947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 177.1612 Da; putative annotation: N/A; putative formula: C11H19N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.316,"smiles":null,"spectrum_id":"CCMSLIB00017254652","spectrum_index":23948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 130.026 Da; putative annotation: N/A; putative formula: C5H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.076,"smiles":null,"spectrum_id":"CCMSLIB00017254655","spectrum_index":23949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 252.2091 Da; putative annotation: N/A; putative formula: C16H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.338,"smiles":null,"spectrum_id":"CCMSLIB00017254656","spectrum_index":23950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid (delta mass: 112.0582 Da; putative annotation: N/A; putative formula: C5H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.154,"smiles":null,"spectrum_id":"CCMSLIB00017254659","spectrum_index":23951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 175.9113 Da; putative annotation: N/A; putative formula: H4O3P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.961,"smiles":null,"spectrum_id":"CCMSLIB00017254660","spectrum_index":23952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 200.0619 Da; putative annotation: N/A; putative formula: C8H12N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.153,"smiles":null,"spectrum_id":"CCMSLIB00017254663","spectrum_index":23953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 128.0111 Da; putative annotation: N/A; putative formula: C5H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.071,"smiles":null,"spectrum_id":"CCMSLIB00017254666","spectrum_index":23954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methanone, [1-(2-hydroxypentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)- (delta mass: 187.1208 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.348,"smiles":null,"spectrum_id":"CCMSLIB00017254667","spectrum_index":23955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 70.0977 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.141,"smiles":null,"spectrum_id":"CCMSLIB00017254670","spectrum_index":23956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 172.0963 Da; putative annotation: N/A; putative formula: C6H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.199,"smiles":null,"spectrum_id":"CCMSLIB00017254671","spectrum_index":23957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 124.0698 Da; putative annotation: N/A; putative formula: C8H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.167,"smiles":null,"spectrum_id":"CCMSLIB00017254674","spectrum_index":23958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(prolyltyrosyl) (delta mass: 42.0111 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017254675","spectrum_index":23959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 35.9664 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.048,"smiles":null,"spectrum_id":"CCMSLIB00017254678","spectrum_index":23960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 334.0904 Da; putative annotation: N/A; putative formula: C16H19N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.239,"smiles":null,"spectrum_id":"CCMSLIB00017254679","spectrum_index":23961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 645.2476 Da; putative annotation: N/A; putative formula: C38H35N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.328,"smiles":null,"spectrum_id":"CCMSLIB00017254682","spectrum_index":23962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 2.0342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.12,"smiles":null,"spectrum_id":"CCMSLIB00017254683","spectrum_index":23963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 167.124 Da; putative annotation: N/A; putative formula: C10H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.2,"smiles":null,"spectrum_id":"CCMSLIB00017254686","spectrum_index":23964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 687.2024 Da; putative annotation: N/A; putative formula: C30H33N5O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.263,"smiles":null,"spectrum_id":"CCMSLIB00017254687","spectrum_index":23965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 621.4613 Da; putative annotation: N/A; putative formula: C37H59N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.532,"smiles":null,"spectrum_id":"CCMSLIB00017254690","spectrum_index":23966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 266.0574 Da; putative annotation: N/A; putative formula: C8H14N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.181,"smiles":null,"spectrum_id":"CCMSLIB00017254691","spectrum_index":23967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 140.2524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.339,"smiles":null,"spectrum_id":"CCMSLIB00017254694","spectrum_index":23968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 41.024 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.12,"smiles":null,"spectrum_id":"CCMSLIB00017254696","spectrum_index":23969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 46.0097 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.149,"smiles":null,"spectrum_id":"CCMSLIB00017254698","spectrum_index":23970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 105.0787 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.227,"smiles":null,"spectrum_id":"CCMSLIB00017254701","spectrum_index":23971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 425.2058 Da; putative annotation: N/A; putative formula: C22H35NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.318,"smiles":null,"spectrum_id":"CCMSLIB00017254702","spectrum_index":23972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310824 N-Fructosyl isoleucine (delta mass: 824.4247 Da; putative annotation: N/A; putative formula: C46H48N16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1118.58,"smiles":null,"spectrum_id":"CCMSLIB00017254705","spectrum_index":23973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004401 1-hydroxypyrene|pyren-1-ol (delta mass: 60.0172 Da; putative annotation: N/A; putative formula: CH4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.098,"smiles":null,"spectrum_id":"CCMSLIB00017254706","spectrum_index":23974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 357.1607 Da; putative annotation: N/A; putative formula: C19H24N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.346,"smiles":null,"spectrum_id":"CCMSLIB00017254709","spectrum_index":23975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 531.3056 Da; putative annotation: N/A; putative formula: C27H41N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.41,"smiles":null,"spectrum_id":"CCMSLIB00017254710","spectrum_index":23976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 140.0991 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017254713","spectrum_index":23977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 24.9886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.158,"smiles":null,"spectrum_id":"CCMSLIB00017254715","spectrum_index":23978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 284.0809 Da; putative annotation: N/A; putative formula: C16H8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.172,"smiles":null,"spectrum_id":"CCMSLIB00017254717","spectrum_index":23979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.19,"smiles":null,"spectrum_id":"CCMSLIB00017254720","spectrum_index":23980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-methoxybenzyl)ethanamine (delta mass: 137.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.233,"smiles":null,"spectrum_id":"CCMSLIB00017254721","spectrum_index":23981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 117.0262 Da; putative annotation: N/A; putative formula: C4H9NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.112,"smiles":null,"spectrum_id":"CCMSLIB00017254723","spectrum_index":23982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 199.0828 Da; putative annotation: N/A; putative formula: C13H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.18,"smiles":null,"spectrum_id":"CCMSLIB00017254725","spectrum_index":23983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-indole-3-carbaldehyde (delta mass: 204.0899 Da; putative annotation: N/A; putative formula: C11H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.166,"smiles":null,"spectrum_id":"CCMSLIB00017254728","spectrum_index":23984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 303.2049 Da; putative annotation: N/A; putative formula: C15H29NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.265,"smiles":null,"spectrum_id":"CCMSLIB00017254729","spectrum_index":23985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 70.0054 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.066,"smiles":null,"spectrum_id":"CCMSLIB00017254732","spectrum_index":23986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 68.0625 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.123,"smiles":null,"spectrum_id":"CCMSLIB00017254735","spectrum_index":23987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 319.308 Da; putative annotation: N/A; putative formula: C19H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.399,"smiles":null,"spectrum_id":"CCMSLIB00017254736","spectrum_index":23988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 426.2178 Da; putative annotation: N/A; putative formula: C23H39OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.289,"smiles":null,"spectrum_id":"CCMSLIB00017254739","spectrum_index":23989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.081,"smiles":null,"spectrum_id":"CCMSLIB00017254740","spectrum_index":23990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dimethoxy-4-hydroxycinnamic acid (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017254743","spectrum_index":23991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 149.1058 Da; putative annotation: N/A; putative formula: C7H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.239,"smiles":null,"spectrum_id":"CCMSLIB00017254746","spectrum_index":23992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 288.0842 Da; putative annotation: N/A; putative formula: C18H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017254747","spectrum_index":23993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 69.0583 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.197,"smiles":null,"spectrum_id":"CCMSLIB00017254750","spectrum_index":23994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 175.0499 Da; putative annotation: N/A; putative formula: C7H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.173,"smiles":null,"spectrum_id":"CCMSLIB00017254751","spectrum_index":23995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 24.0098 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.118,"smiles":null,"spectrum_id":"CCMSLIB00017254754","spectrum_index":23996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 54.9961 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.067,"smiles":null,"spectrum_id":"CCMSLIB00017254757","spectrum_index":23997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 151.0476 Da; putative annotation: N/A; putative formula: C4H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.108,"smiles":null,"spectrum_id":"CCMSLIB00017254758","spectrum_index":23998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dichloro-1H-indole-2-carboxylic acid (delta mass: 284.1727 Da; putative annotation: N/A; putative formula: C14H24N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.15,"smiles":null,"spectrum_id":"CCMSLIB00017254761","spectrum_index":23999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 110.0214 Da; putative annotation: N/A; putative formula: C3H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.086,"smiles":null,"spectrum_id":"CCMSLIB00017254763","spectrum_index":24000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Aminobutyl)guanidine (delta mass: 161.0102 Da; putative annotation: N/A; putative formula: C2H4N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017254765","spectrum_index":24001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 94.0455 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.126,"smiles":null,"spectrum_id":"CCMSLIB00017254768","spectrum_index":24002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyanomethyl)-1H-indole-2-carboxylic acid (delta mass: 78.0274 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.093,"smiles":null,"spectrum_id":"CCMSLIB00017254770","spectrum_index":24003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 23.0399 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.074,"smiles":null,"spectrum_id":"CCMSLIB00017254772","spectrum_index":24004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 73.0164 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.088,"smiles":null,"spectrum_id":"CCMSLIB00017254775","spectrum_index":24005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 187.064 Da; putative annotation: N/A; putative formula: C11H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.151,"smiles":null,"spectrum_id":"CCMSLIB00017254777","spectrum_index":24006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methylbutane-1,4-diamine (delta mass: 164.0477 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.171,"smiles":null,"spectrum_id":"CCMSLIB00017254779","spectrum_index":24007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017254782","spectrum_index":24008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 172.0737 Da; putative annotation: N/A; putative formula: C8H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.171,"smiles":null,"spectrum_id":"CCMSLIB00017254784","spectrum_index":24009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 51.9948 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017254787","spectrum_index":24010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 60.9284 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.988,"smiles":null,"spectrum_id":"CCMSLIB00017254789","spectrum_index":24011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 12.9951 Da; putative annotation: N/A; putative formula: C22H32N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.081,"smiles":null,"spectrum_id":"CCMSLIB00017254791","spectrum_index":24012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 218.0943 Da; putative annotation: N/A; putative formula: C13H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.175,"smiles":null,"spectrum_id":"CCMSLIB00017254794","spectrum_index":24013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 220.0849 Da; putative annotation: N/A; putative formula: C11H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.145,"smiles":null,"spectrum_id":"CCMSLIB00017254796","spectrum_index":24014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 100.0162 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.109,"smiles":null,"spectrum_id":"CCMSLIB00017254798","spectrum_index":24015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isonicotinamide (delta mass: 50.0148 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.07,"smiles":null,"spectrum_id":"CCMSLIB00017254801","spectrum_index":24016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 306.1613 Da; putative annotation: N/A; putative formula: C13H26N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.226,"smiles":null,"spectrum_id":"CCMSLIB00017254803","spectrum_index":24017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 17.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.122,"smiles":null,"spectrum_id":"CCMSLIB00017254805","spectrum_index":24018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.101,"smiles":null,"spectrum_id":"CCMSLIB00017254808","spectrum_index":24019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 341.1844 Da; putative annotation: N/A; putative formula: C18H31NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.245,"smiles":null,"spectrum_id":"CCMSLIB00017254809","spectrum_index":24020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 177.0996 Da; putative annotation: N/A; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.16,"smiles":null,"spectrum_id":"CCMSLIB00017254812","spectrum_index":24021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 151.4087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.5,"smiles":null,"spectrum_id":"CCMSLIB00017254815","spectrum_index":24022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 86.9164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.977,"smiles":null,"spectrum_id":"CCMSLIB00017254816","spectrum_index":24023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 100.0313 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.113,"smiles":null,"spectrum_id":"CCMSLIB00017254819","spectrum_index":24024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 430.2095 Da; putative annotation: N/A; putative formula: C25H35O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.28,"smiles":null,"spectrum_id":"CCMSLIB00017254821","spectrum_index":24025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Arabinose (delta mass: 90.0454 Da; putative annotation: N/A; putative formula: CH7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.105,"smiles":null,"spectrum_id":"CCMSLIB00017254823","spectrum_index":24026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 193.1679 Da; putative annotation: N/A; putative formula: C10H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.228,"smiles":null,"spectrum_id":"CCMSLIB00017254826","spectrum_index":24027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 38.0518 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.106,"smiles":null,"spectrum_id":"CCMSLIB00017254827","spectrum_index":24028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 75.057 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017254830","spectrum_index":24029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 132.037 Da; putative annotation: N/A; putative formula: C4H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.104,"smiles":null,"spectrum_id":"CCMSLIB00017254832","spectrum_index":24030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N'-(7-Fluoropyrrolo[1,2-a]quinoxalin-4-yl)pyrazinohydrazide (delta mass: 264.072 Da; putative annotation: N/A; putative formula: C8H8N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.177,"smiles":null,"spectrum_id":"CCMSLIB00017254834","spectrum_index":24031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 35.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.197,"smiles":null,"spectrum_id":"CCMSLIB00017254837","spectrum_index":24032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 271.1061 Da; putative annotation: N/A; putative formula: C13H21NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.177,"smiles":null,"spectrum_id":"CCMSLIB00017254838","spectrum_index":24033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU203708 Chloridazone-methyl-desphenyl|5-Amino-4-chloro-2-methyl-3(2H)-pyridazinone|5-amino-4-chloro-2-methylpyridazin-3-one (delta mass: 90.0209 Da; putative annotation: N/A; putative formula: C5H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.048,"smiles":null,"spectrum_id":"CCMSLIB00017254841","spectrum_index":24034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 78.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.098,"smiles":null,"spectrum_id":"CCMSLIB00017254844","spectrum_index":24035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 70.0138 Da; putative annotation: N/A; putative formula: C2H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.089,"smiles":null,"spectrum_id":"CCMSLIB00017254845","spectrum_index":24036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-hydroxy-1H-pyrimidin-4-one (delta mass: 105.0505 Da; putative annotation: N/A; putative formula: CH7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.096,"smiles":null,"spectrum_id":"CCMSLIB00017254848","spectrum_index":24037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 188.1093 Da; putative annotation: N/A; putative formula: C7H16N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.18,"smiles":null,"spectrum_id":"CCMSLIB00017254850","spectrum_index":24038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 161.0535 Da; putative annotation: N/A; putative formula: C5H12N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.192,"smiles":null,"spectrum_id":"CCMSLIB00017254852","spectrum_index":24039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 443.2789 Da; putative annotation: N/A; putative formula: C26H41N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.396,"smiles":null,"spectrum_id":"CCMSLIB00017254855","spectrum_index":24040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 170.1049 Da; putative annotation: Gly-Ile; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.26,"smiles":null,"spectrum_id":"CCMSLIB00017254857","spectrum_index":24041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 128.0455 Da; putative annotation: 5-Methoxy-5-oxopentanoic acid CollisionEnergy:102040; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.116,"smiles":null,"spectrum_id":"CCMSLIB00017254859","spectrum_index":24042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 184.1092 Da; putative annotation: Methyl hydrogen azelate; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.315,"smiles":null,"spectrum_id":"CCMSLIB00017254862","spectrum_index":24043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 138.0681 Da; putative annotation: Dihydroterrein; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017254865","spectrum_index":24044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 111.0322 Da; putative annotation: PYROGLUTAMIC ACID; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.129,"smiles":null,"spectrum_id":"CCMSLIB00017254867","spectrum_index":24045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 84.0575 Da; putative annotation: Pentanoic acid; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017254869","spectrum_index":24046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 86.0784 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.18,"smiles":null,"spectrum_id":"CCMSLIB00017254872","spectrum_index":24047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 36.036 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.169,"smiles":null,"spectrum_id":"CCMSLIB00017254874","spectrum_index":24048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Streptomycin A (delta mass: 43.0065 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.279,"smiles":null,"spectrum_id":"CCMSLIB00017254876","spectrum_index":24049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 35.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.15,"smiles":null,"spectrum_id":"CCMSLIB00017254879","spectrum_index":24050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 224.0718 Da; putative annotation: N/A; putative formula: C8H16O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.132,"smiles":null,"spectrum_id":"CCMSLIB00017254881","spectrum_index":24051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Valine, N-[[1-(5-fluoropentyl)-1H-indazol-3-yl]carbonyl]-, methyl ester (delta mass: 341.2273 Da; putative annotation: N/A; putative formula: C22H32NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.43,"smiles":null,"spectrum_id":"CCMSLIB00017254883","spectrum_index":24052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-ethyl-2,4-dihydroxy-6-methoxyphenyl)butan-1-one (delta mass: 56.0612 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.189,"smiles":null,"spectrum_id":"CCMSLIB00017254885","spectrum_index":24053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 40.0311 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.07,"smiles":null,"spectrum_id":"CCMSLIB00017254888","spectrum_index":24054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 186.126 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.186,"smiles":null,"spectrum_id":"CCMSLIB00017254891","spectrum_index":24055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 428.2919 Da; putative annotation: N/A; putative formula: C21H41N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":933.468,"smiles":null,"spectrum_id":"CCMSLIB00017254892","spectrum_index":24056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 899.5252 Da; putative annotation: N/A; putative formula: C60H65N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.6,"smiles":null,"spectrum_id":"CCMSLIB00017254895","spectrum_index":24057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-(3,4-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 243.1949 Da; putative annotation: N/A; putative formula: C12H25N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.318,"smiles":null,"spectrum_id":"CCMSLIB00017254898","spectrum_index":24058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00178646-02!2,4-dihydroxyheptadecyl acetate [IIN-based: Match] (delta mass: 108.0934 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.378,"smiles":null,"spectrum_id":"CCMSLIB00017254901","spectrum_index":24059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 148.0486 Da; putative annotation: N/A; putative formula: C4H8N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017254902","spectrum_index":24060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 459.4069 Da; putative annotation: N/A; putative formula: C30H53NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.478,"smiles":null,"spectrum_id":"CCMSLIB00017254905","spectrum_index":24061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 95.0573 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.117,"smiles":null,"spectrum_id":"CCMSLIB00017254906","spectrum_index":24062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 290.0806 Da; putative annotation: N/A; putative formula: C16H10N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.225,"smiles":null,"spectrum_id":"CCMSLIB00017254909","spectrum_index":24063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 216.0638 Da; putative annotation: N/A; putative formula: C10H16OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.202,"smiles":null,"spectrum_id":"CCMSLIB00017254912","spectrum_index":24064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 161.0706 Da; putative annotation: N/A; putative formula: C7H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.25,"smiles":null,"spectrum_id":"CCMSLIB00017254913","spectrum_index":24065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 425.1566 Da; putative annotation: N/A; putative formula: C34H19NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.238,"smiles":null,"spectrum_id":"CCMSLIB00017254916","spectrum_index":24066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 593.4631 Da; putative annotation: N/A; putative formula: C39H63NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.523,"smiles":null,"spectrum_id":"CCMSLIB00017254918","spectrum_index":24067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 169.0515 Da; putative annotation: N/A; putative formula: C5H8N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.138,"smiles":null,"spectrum_id":"CCMSLIB00017254921","spectrum_index":24068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 167.095 Da; putative annotation: N/A; putative formula: C9H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.155,"smiles":null,"spectrum_id":"CCMSLIB00017254923","spectrum_index":24069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 143.0966 Da; putative annotation: N/A; putative formula: C6H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.23,"smiles":null,"spectrum_id":"CCMSLIB00017254926","spectrum_index":24070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 126.1401 Da; putative annotation: N/A; putative formula: C9H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.289,"smiles":null,"spectrum_id":"CCMSLIB00017254928","spectrum_index":24071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 84.0573 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.216,"smiles":null,"spectrum_id":"CCMSLIB00017254930","spectrum_index":24072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 126.0314 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.102,"smiles":null,"spectrum_id":"CCMSLIB00017254933","spectrum_index":24073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 207.1372 Da; putative annotation: N/A; putative formula: C11H17N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.313,"smiles":null,"spectrum_id":"CCMSLIB00017254936","spectrum_index":24074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 27.9943 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.143,"smiles":null,"spectrum_id":"CCMSLIB00017254938","spectrum_index":24075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 308.1627 Da; putative annotation: N/A; putative formula: C10H24N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.332,"smiles":null,"spectrum_id":"CCMSLIB00017254940","spectrum_index":24076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2,2,6,6-tetramethyl-4-[3-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]butyl]cyclohex-4-ene-1,3-dione (delta mass: 410.2106 Da; putative annotation: N/A; putative formula: C26H26N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.448,"smiles":null,"spectrum_id":"CCMSLIB00017254943","spectrum_index":24077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 217.1475 Da; putative annotation: N/A; putative formula: C14H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.197,"smiles":null,"spectrum_id":"CCMSLIB00017254944","spectrum_index":24078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Cyclopropylmethyl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide (delta mass: 71.0473 Da; putative annotation: N/A; putative formula: C2H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.234,"smiles":null,"spectrum_id":"CCMSLIB00017254947","spectrum_index":24079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 121.0488 Da; putative annotation: N/A; putative formula: C2H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.13,"smiles":null,"spectrum_id":"CCMSLIB00017254950","spectrum_index":24080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 39.0469 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.122,"smiles":null,"spectrum_id":"CCMSLIB00017254951","spectrum_index":24081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyridoxal CollisionEnergy:205060 (delta mass: 18.0145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.08,"smiles":null,"spectrum_id":"CCMSLIB00017254954","spectrum_index":24082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 86.0917 Da; putative annotation: N/A; putative formula: C3H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017254955","spectrum_index":24083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-yl)-2-(4-methoxyphenyl)ethanamine (delta mass: 176.0357 Da; putative annotation: N/A; putative formula: C5H9N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.185,"smiles":null,"spectrum_id":"CCMSLIB00017254958","spectrum_index":24084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 35.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.076,"smiles":null,"spectrum_id":"CCMSLIB00017254961","spectrum_index":24085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 161.9822 Da; putative annotation: N/A; putative formula: C5H8P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.069,"smiles":null,"spectrum_id":"CCMSLIB00017254962","spectrum_index":24086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 397.2504 Da; putative annotation: N/A; putative formula: C19H35N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.322,"smiles":null,"spectrum_id":"CCMSLIB00017254965","spectrum_index":24087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 100.0643 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.14,"smiles":null,"spectrum_id":"CCMSLIB00017254968","spectrum_index":24088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 397.2453 Da; putative annotation: N/A; putative formula: C25H37NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.305,"smiles":null,"spectrum_id":"CCMSLIB00017254969","spectrum_index":24089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 289.12 Da; putative annotation: N/A; putative formula: C12H16N7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.238,"smiles":null,"spectrum_id":"CCMSLIB00017254972","spectrum_index":24090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 91.0993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.196,"smiles":null,"spectrum_id":"CCMSLIB00017254974","spectrum_index":24091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 116.0258 Da; putative annotation: N/A; putative formula: C8H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.112,"smiles":null,"spectrum_id":"CCMSLIB00017254976","spectrum_index":24092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vialinin A (delta mass: 253.1103 Da; putative annotation: N/A; putative formula: C16H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.28,"smiles":null,"spectrum_id":"CCMSLIB00017254979","spectrum_index":24093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 102.0833 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017254980","spectrum_index":24094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1116.3573 Da; putative annotation: N/A; putative formula: C81H52N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1459.48,"smiles":null,"spectrum_id":"CCMSLIB00017254983","spectrum_index":24095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 873.7787 Da; putative annotation: N/A; putative formula: C55H103NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1216.9,"smiles":null,"spectrum_id":"CCMSLIB00017254985","spectrum_index":24096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 47.1097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.264,"smiles":null,"spectrum_id":"CCMSLIB00017254987","spectrum_index":24097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1090.6819 Da; putative annotation: N/A; putative formula: C59H82N18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1271.75,"smiles":null,"spectrum_id":"CCMSLIB00017254990","spectrum_index":24098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 37.9736 Da; putative annotation: N/A; putative formula: C2H-1O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.065,"smiles":null,"spectrum_id":"CCMSLIB00017254991","spectrum_index":24099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 49.0645 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.145,"smiles":null,"spectrum_id":"CCMSLIB00017254994","spectrum_index":24100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 47.9992 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.09,"smiles":null,"spectrum_id":"CCMSLIB00017254996","spectrum_index":24101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(5-fluoropentyl)- (delta mass: 51.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.176,"smiles":null,"spectrum_id":"CCMSLIB00017254998","spectrum_index":24102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2-carboxylic acid CollisionEnergy:102040 (delta mass: 36.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.076,"smiles":null,"spectrum_id":"CCMSLIB00017255001","spectrum_index":24103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 276.1703 Da; putative annotation: N/A; putative formula: C13H20N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.23,"smiles":null,"spectrum_id":"CCMSLIB00017255003","spectrum_index":24104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 204.1061 Da; putative annotation: N/A; putative formula: C7H18N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.147,"smiles":null,"spectrum_id":"CCMSLIB00017255005","spectrum_index":24105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trehalose-6-phosphate (delta mass: 79.9664 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.056,"smiles":null,"spectrum_id":"CCMSLIB00017255008","spectrum_index":24106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 211.1659 Da; putative annotation: N/A; putative formula: C7H17N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.257,"smiles":null,"spectrum_id":"CCMSLIB00017255011","spectrum_index":24107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 132.0293 Da; putative annotation: N/A; putative formula: C3N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.12,"smiles":null,"spectrum_id":"CCMSLIB00017255013","spectrum_index":24108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin E (delta mass: 176.0301 Da; putative annotation: N/A; putative formula: C3H8N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.22,"smiles":null,"spectrum_id":"CCMSLIB00017255015","spectrum_index":24109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 426.2545 Da; putative annotation: N/A; putative formula: C24H43PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.403,"smiles":null,"spectrum_id":"CCMSLIB00017255017","spectrum_index":24110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 132.0632 Da; putative annotation: N/A; putative formula: C6H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.134,"smiles":null,"spectrum_id":"CCMSLIB00017255020","spectrum_index":24111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylquinolin-4-amine (delta mass: 42.0098 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.102,"smiles":null,"spectrum_id":"CCMSLIB00017255023","spectrum_index":24112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 196.0475 Da; putative annotation: N/A; putative formula: C10H13PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.134,"smiles":null,"spectrum_id":"CCMSLIB00017255024","spectrum_index":24113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 76.086 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.167,"smiles":null,"spectrum_id":"CCMSLIB00017255027","spectrum_index":24114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 49.0587 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.109,"smiles":null,"spectrum_id":"CCMSLIB00017255030","spectrum_index":24115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 113.09 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.172,"smiles":null,"spectrum_id":"CCMSLIB00017255031","spectrum_index":24116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 25.0608 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.137,"smiles":null,"spectrum_id":"CCMSLIB00017255034","spectrum_index":24117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 85.983 Da; putative annotation: N/A; putative formula: C3H2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.048,"smiles":null,"spectrum_id":"CCMSLIB00017255035","spectrum_index":24118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 117.0663 Da; putative annotation: N/A; putative formula: C2H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.143,"smiles":null,"spectrum_id":"CCMSLIB00017255038","spectrum_index":24119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 56.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.07,"smiles":null,"spectrum_id":"CCMSLIB00017255040","spectrum_index":24120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 84.021 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.102,"smiles":null,"spectrum_id":"CCMSLIB00017255042","spectrum_index":24121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 81.05 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.127,"smiles":null,"spectrum_id":"CCMSLIB00017255045","spectrum_index":24122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Lys (delta mass: 147.0701 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.257,"smiles":null,"spectrum_id":"CCMSLIB00017255047","spectrum_index":24123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 14.9676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.127,"smiles":null,"spectrum_id":"CCMSLIB00017255049","spectrum_index":24124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 73.0522 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.133,"smiles":null,"spectrum_id":"CCMSLIB00017255052","spectrum_index":24125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 68.0481 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.083,"smiles":null,"spectrum_id":"CCMSLIB00017255054","spectrum_index":24126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 208.1467 Da; putative annotation: N/A; putative formula: C13H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.184,"smiles":null,"spectrum_id":"CCMSLIB00017255057","spectrum_index":24127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 77.0714 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.175,"smiles":null,"spectrum_id":"CCMSLIB00017255060","spectrum_index":24128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 274.06 Da; putative annotation: N/A; putative formula: C14H14N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.157,"smiles":null,"spectrum_id":"CCMSLIB00017255061","spectrum_index":24129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 39.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.086,"smiles":null,"spectrum_id":"CCMSLIB00017255064","spectrum_index":24130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 195.0648 Da; putative annotation: N/A; putative formula: C8H9N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.127,"smiles":null,"spectrum_id":"CCMSLIB00017255066","spectrum_index":24131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 25.9224 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.04,"smiles":null,"spectrum_id":"CCMSLIB00017255068","spectrum_index":24132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 88.0393 Da; putative annotation: N/A; putative formula: CH4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.193,"smiles":null,"spectrum_id":"CCMSLIB00017255071","spectrum_index":24133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 66.0473 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.118,"smiles":null,"spectrum_id":"CCMSLIB00017255072","spectrum_index":24134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 60.0165 Da; putative annotation: N/A; putative formula: CH4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.086,"smiles":null,"spectrum_id":"CCMSLIB00017255075","spectrum_index":24135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 148.0193 Da; putative annotation: N/A; putative formula: C5H8O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.121,"smiles":null,"spectrum_id":"CCMSLIB00017255076","spectrum_index":24136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 31.081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.12,"smiles":null,"spectrum_id":"CCMSLIB00017255079","spectrum_index":24137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 131.058 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.129,"smiles":null,"spectrum_id":"CCMSLIB00017255080","spectrum_index":24138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 94.0786 Da; putative annotation: N/A; putative formula: C7H10)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.139,"smiles":null,"spectrum_id":"CCMSLIB00017255083","spectrum_index":24139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 294.168 Da; putative annotation: N/A; putative formula: C13H26O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.228,"smiles":null,"spectrum_id":"CCMSLIB00017255084","spectrum_index":24140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 323.1244 Da; putative annotation: N/A; putative formula: C14H13N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.195,"smiles":null,"spectrum_id":"CCMSLIB00017255087","spectrum_index":24141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 344.0891 Da; putative annotation: N/A; putative formula: C12H17N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.17,"smiles":null,"spectrum_id":"CCMSLIB00017255088","spectrum_index":24142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-1H-indole-2-carboxamide (delta mass: 65.0265 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.144,"smiles":null,"spectrum_id":"CCMSLIB00017255091","spectrum_index":24143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 41.0249 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.106,"smiles":null,"spectrum_id":"CCMSLIB00017255094","spectrum_index":24144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amoxicillin (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.154,"smiles":null,"spectrum_id":"CCMSLIB00017255095","spectrum_index":24145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Quinazolinamine, 7-[3-(dimethylamino)propoxy]-2-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)-6-methoxy-N-(1-methyl-4-piperidinyl)- (delta mass: 36.0244 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.38,"smiles":null,"spectrum_id":"CCMSLIB00017255097","spectrum_index":24146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 66.0351 Da; putative annotation: N/A; putative formula: C2H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.174,"smiles":null,"spectrum_id":"CCMSLIB00017255099","spectrum_index":24147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 50.0 eV (delta mass: 57.97 Da; putative annotation: N/A; putative formula: CH-2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.057,"smiles":null,"spectrum_id":"CCMSLIB00017255102","spectrum_index":24148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 73.0554 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.11,"smiles":null,"spectrum_id":"CCMSLIB00017255103","spectrum_index":24149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroxycarbazepine (delta mass: 61.9459 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.054,"smiles":null,"spectrum_id":"CCMSLIB00017255106","spectrum_index":24150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 99.0325 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.124,"smiles":null,"spectrum_id":"CCMSLIB00017255107","spectrum_index":24151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 18.0828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.247,"smiles":null,"spectrum_id":"CCMSLIB00017255110","spectrum_index":24152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 143.1308 Da; putative annotation: N/A; putative formula: C8H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.207,"smiles":null,"spectrum_id":"CCMSLIB00017255111","spectrum_index":24153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Glutathione, reduced (delta mass: 274.2078 Da; putative annotation: N/A; putative formula: C14H30N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.299,"smiles":null,"spectrum_id":"CCMSLIB00017255114","spectrum_index":24154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 137.2181 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.268,"smiles":null,"spectrum_id":"CCMSLIB00017255115","spectrum_index":24155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 216.1239 Da; putative annotation: N/A; putative formula: C9H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.189,"smiles":null,"spectrum_id":"CCMSLIB00017255118","spectrum_index":24156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 83.0492 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.136,"smiles":null,"spectrum_id":"CCMSLIB00017255119","spectrum_index":24157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 82.0372 Da; putative annotation: N/A; putative formula: CH2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.087,"smiles":null,"spectrum_id":"CCMSLIB00017255122","spectrum_index":24158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000501 5-methoxyindole-3-carbaldehyde (delta mass: 74.0179 Da; putative annotation: N/A; putative formula: C3H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.089,"smiles":null,"spectrum_id":"CCMSLIB00017255123","spectrum_index":24159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 9.0032 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.116,"smiles":null,"spectrum_id":"CCMSLIB00017255126","spectrum_index":24160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 443.2166 Da; putative annotation: N/A; putative formula: C32H30NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.329,"smiles":null,"spectrum_id":"CCMSLIB00017255129","spectrum_index":24161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 651.2553 Da; putative annotation: N/A; putative formula: C33H33N9O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.315,"smiles":null,"spectrum_id":"CCMSLIB00017255130","spectrum_index":24162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 15.9959 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.095,"smiles":null,"spectrum_id":"CCMSLIB00017255133","spectrum_index":24163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1123.7628 Da; putative annotation: N/A; putative formula: C60H101N9O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1345.86,"smiles":null,"spectrum_id":"CCMSLIB00017255134","spectrum_index":24164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 695.507 Da; putative annotation: N/A; putative formula: C50H65NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.578,"smiles":null,"spectrum_id":"CCMSLIB00017255137","spectrum_index":24165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 227.102 Da; putative annotation: N/A; putative formula: C8H13N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.183,"smiles":null,"spectrum_id":"CCMSLIB00017255138","spectrum_index":24166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-acetyl-5-hydroxy-1-(2-hydroxyethyl)-2-methylindole CollisionEnergy:102040 (delta mass: 63.0692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.182,"smiles":null,"spectrum_id":"CCMSLIB00017255141","spectrum_index":24167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 9.0437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.13,"smiles":null,"spectrum_id":"CCMSLIB00017255142","spectrum_index":24168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheptanol (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.164,"smiles":null,"spectrum_id":"CCMSLIB00017255145","spectrum_index":24169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-methoxyphenyl)propylamine CollisionEnergy:102040 (delta mass: 226.1208 Da; putative annotation: N/A; putative formula: C12H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.243,"smiles":null,"spectrum_id":"CCMSLIB00017255148","spectrum_index":24170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 129.2402 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.283,"smiles":null,"spectrum_id":"CCMSLIB00017255149","spectrum_index":24171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxyquinoline-2-carboxylic acid CollisionEnergy:102040 (delta mass: 146.0694 Da; putative annotation: N/A; putative formula: C5H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.135,"smiles":null,"spectrum_id":"CCMSLIB00017255152","spectrum_index":24172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 318.2492 Da; putative annotation: N/A; putative formula: C20H34N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.373,"smiles":null,"spectrum_id":"CCMSLIB00017255155","spectrum_index":24173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 785.7227 Da; putative annotation: N/A; putative formula: C47H91N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1007.82,"smiles":null,"spectrum_id":"CCMSLIB00017255156","spectrum_index":24174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 445.1955 Da; putative annotation: N/A; putative formula: C21H35NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.276,"smiles":null,"spectrum_id":"CCMSLIB00017255159","spectrum_index":24175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 130.136 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.248,"smiles":null,"spectrum_id":"CCMSLIB00017255162","spectrum_index":24176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 5.0033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.044,"smiles":null,"spectrum_id":"CCMSLIB00017255163","spectrum_index":24177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 133.0475 Da; putative annotation: N/A; putative formula: C5H12NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.16,"smiles":null,"spectrum_id":"CCMSLIB00017255166","spectrum_index":24178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 41.9378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017255168","spectrum_index":24179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 403.2358 Da; putative annotation: N/A; putative formula: C23H33NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.364,"smiles":null,"spectrum_id":"CCMSLIB00017255170","spectrum_index":24180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-Hydroxy-4,6-dimethoxyacetophenone\"\" (delta mass: 97.0564 Da; putative annotation: N/A; putative formula: C5H7NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.137,"smiles":null,"spectrum_id":"CCMSLIB00017255173","spectrum_index":24181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 336.2581 Da; putative annotation: N/A; putative formula: C21H37OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.301,"smiles":null,"spectrum_id":"CCMSLIB00017255175","spectrum_index":24182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 205.1013 Da; putative annotation: N/A; putative formula: C6H17N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.271,"smiles":null,"spectrum_id":"CCMSLIB00017255177","spectrum_index":24183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.191,"smiles":null,"spectrum_id":"CCMSLIB00017255180","spectrum_index":24184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 340.1947 Da; putative annotation: N/A; putative formula: C16H30N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.333,"smiles":null,"spectrum_id":"CCMSLIB00017255181","spectrum_index":24185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 337.3339 Da; putative annotation: N/A; putative formula: C22H43NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.446,"smiles":null,"spectrum_id":"CCMSLIB00017255184","spectrum_index":24186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 133.1104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.181,"smiles":null,"spectrum_id":"CCMSLIB00017255187","spectrum_index":24187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 334.0134 Da; putative annotation: N/A; putative formula: C9H19O5PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.1,"smiles":null,"spectrum_id":"CCMSLIB00017255188","spectrum_index":24188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 24.0217 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.061,"smiles":null,"spectrum_id":"CCMSLIB00017255191","spectrum_index":24189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 629.2312 Da; putative annotation: N/A; putative formula: C27H38N9O3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":767.323,"smiles":null,"spectrum_id":"CCMSLIB00017255193","spectrum_index":24190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 79.0518 Da; putative annotation: N/A; putative formula: C4H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.139,"smiles":null,"spectrum_id":"CCMSLIB00017255195","spectrum_index":24191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 257.2448 Da; putative annotation: N/A; putative formula: C10H27N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.31,"smiles":null,"spectrum_id":"CCMSLIB00017255198","spectrum_index":24192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 334.3044 Da; putative annotation: N/A; putative formula: C23H42O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.343,"smiles":null,"spectrum_id":"CCMSLIB00017255199","spectrum_index":24193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 46.0009 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.098,"smiles":null,"spectrum_id":"CCMSLIB00017255202","spectrum_index":24194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 59.0148 Da; putative annotation: N/A; putative formula: C5HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017255205","spectrum_index":24195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 144.0305 Da; putative annotation: N/A; putative formula: C2H5N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.091,"smiles":null,"spectrum_id":"CCMSLIB00017255206","spectrum_index":24196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 189.2142 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.353,"smiles":null,"spectrum_id":"CCMSLIB00017255209","spectrum_index":24197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 218.1931 Da; putative annotation: N/A; putative formula: C13H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.252,"smiles":null,"spectrum_id":"CCMSLIB00017255211","spectrum_index":24198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-7-carboxylic acid (delta mass: 113.0567 Da; putative annotation: N/A; putative formula: H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.12,"smiles":null,"spectrum_id":"CCMSLIB00017255213","spectrum_index":24199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 16.9483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.019,"smiles":null,"spectrum_id":"CCMSLIB00017255216","spectrum_index":24200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 40.0 eV (delta mass: 127.0612 Da; putative annotation: N/A; putative formula: C2H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.148,"smiles":null,"spectrum_id":"CCMSLIB00017255217","spectrum_index":24201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1042.0516 Da; putative annotation: N/A; putative formula: C69H131N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1264.15,"smiles":null,"spectrum_id":"CCMSLIB00017255220","spectrum_index":24202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 492.1601 Da; putative annotation: N/A; putative formula: C20H32N2O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.231,"smiles":null,"spectrum_id":"CCMSLIB00017255223","spectrum_index":24203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 311.2454 Da; putative annotation: N/A; putative formula: C18H33NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.311,"smiles":null,"spectrum_id":"CCMSLIB00017255224","spectrum_index":24204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 316.1087 Da; putative annotation: N/A; putative formula: C15H25OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.189,"smiles":null,"spectrum_id":"CCMSLIB00017255227","spectrum_index":24205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 26.0017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.072,"smiles":null,"spectrum_id":"CCMSLIB00017255228","spectrum_index":24206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 74.0361 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.096,"smiles":null,"spectrum_id":"CCMSLIB00017255231","spectrum_index":24207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 436.1819 Da; putative annotation: N/A; putative formula: C17H24N8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.336,"smiles":null,"spectrum_id":"CCMSLIB00017255234","spectrum_index":24208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-His (delta mass: 147.0709 Da; putative annotation: N/A; putative formula: C6H13NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.2,"smiles":null,"spectrum_id":"CCMSLIB00017255235","spectrum_index":24209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 26.0518 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.159,"smiles":null,"spectrum_id":"CCMSLIB00017255238","spectrum_index":24210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 324.0266 Da; putative annotation: N/A; putative formula: C12H21PS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.098,"smiles":null,"spectrum_id":"CCMSLIB00017255239","spectrum_index":24211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 68.0245 Da; putative annotation: N/A; putative formula: N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.105,"smiles":null,"spectrum_id":"CCMSLIB00017255242","spectrum_index":24212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 48.0033 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.116,"smiles":null,"spectrum_id":"CCMSLIB00017255244","spectrum_index":24213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 85.089 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.149,"smiles":null,"spectrum_id":"CCMSLIB00017255246","spectrum_index":24214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 10.0276 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.098,"smiles":null,"spectrum_id":"CCMSLIB00017255249","spectrum_index":24215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 36.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.143,"smiles":null,"spectrum_id":"CCMSLIB00017255250","spectrum_index":24216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Allylamino)benzoic acid (delta mass: 69.077 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.163,"smiles":null,"spectrum_id":"CCMSLIB00017255253","spectrum_index":24217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-2-carbaldehyde (delta mass: 15.9478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.003,"smiles":null,"spectrum_id":"CCMSLIB00017255256","spectrum_index":24218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 493.2523 Da; putative annotation: N/A; putative formula: C22H39NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.323,"smiles":null,"spectrum_id":"CCMSLIB00017255257","spectrum_index":24219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 308.0329 Da; putative annotation: N/A; putative formula: C18H12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.119,"smiles":null,"spectrum_id":"CCMSLIB00017255260","spectrum_index":24220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 279.169 Da; putative annotation: N/A; putative formula: C13H21N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.24,"smiles":null,"spectrum_id":"CCMSLIB00017255261","spectrum_index":24221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 175.0467 Da; putative annotation: N/A; putative formula: C10H6FNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.186,"smiles":null,"spectrum_id":"CCMSLIB00017255264","spectrum_index":24222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 269.2721 Da; putative annotation: N/A; putative formula: C17H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.343,"smiles":null,"spectrum_id":"CCMSLIB00017255267","spectrum_index":24223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 111.0315 Da; putative annotation: 3-Amino-1,1,1-trifluoro-2-propanol; putative formula: C3H4F3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.112,"smiles":null,"spectrum_id":"CCMSLIB00017255268","spectrum_index":24224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU279606 Indole-3-acetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 113.0844 Da; putative annotation: Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.155,"smiles":null,"spectrum_id":"CCMSLIB00017255271","spectrum_index":24225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-L-.gamma.-Glutamyl-L-leucine (delta mass: 242.1244 Da; putative annotation: Ile-Glu; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.269,"smiles":null,"spectrum_id":"CCMSLIB00017255274","spectrum_index":24226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 166.0991 Da; putative annotation: cis-Pinonic acid; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.18,"smiles":null,"spectrum_id":"CCMSLIB00017255275","spectrum_index":24227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE30; CorrDec (delta mass: 104.0479 Da; putative annotation: L-Threitol; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.108,"smiles":null,"spectrum_id":"CCMSLIB00017255278","spectrum_index":24228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 134.0732 Da; putative annotation: 3-Phenoxy-1-propanol; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017255279","spectrum_index":24229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 264.2453 Da; putative annotation: oleic acid CollisionEnergy:102040; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.321,"smiles":null,"spectrum_id":"CCMSLIB00017255282","spectrum_index":24230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 202.0255 Da; putative annotation: 2-Methoxy-3-(trifluoromethyl)benzoic acid; putative formula: C9H5F3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.096,"smiles":null,"spectrum_id":"CCMSLIB00017255285","spectrum_index":24231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 83.036 Da; putative annotation: 1-Aminocyclopropanecarboxylic acid; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.122,"smiles":null,"spectrum_id":"CCMSLIB00017255287","spectrum_index":24232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 310.0474 Da; putative annotation: Aflatoxin M1; putative formula: C17H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.171,"smiles":null,"spectrum_id":"CCMSLIB00017255289","spectrum_index":24233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 216.115 Da; putative annotation: Massbank:NA000901 Pterosin G|(S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-1H-inden-1-one|(2S)-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-2,3-dihydroinden-1-one; putative formula: C14H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017255292","spectrum_index":24234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 176.0471 Da; putative annotation: 4-hydroxymellein_130076; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.185,"smiles":null,"spectrum_id":"CCMSLIB00017255293","spectrum_index":24235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 271.2492 Da; putative annotation: N/A; putative formula: C12H29N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.377,"smiles":null,"spectrum_id":"CCMSLIB00017255296","spectrum_index":24236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desmethylverapamil (delta mass: 138.0907 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.365,"smiles":null,"spectrum_id":"CCMSLIB00017255299","spectrum_index":24237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 411.1295 Da; putative annotation: N/A; putative formula: C19H29N3O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.221,"smiles":null,"spectrum_id":"CCMSLIB00017255300","spectrum_index":24238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 1179.4548 Da; putative annotation: N/A; putative formula: C90H57N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1473.57,"smiles":null,"spectrum_id":"CCMSLIB00017255303","spectrum_index":24239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 158.1283 Da; putative annotation: N/A; putative formula: C5H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.155,"smiles":null,"spectrum_id":"CCMSLIB00017255305","spectrum_index":24240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 252.8565 Da; putative annotation: N/A; putative formula: H7NO-1P8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.954,"smiles":null,"spectrum_id":"CCMSLIB00017255308","spectrum_index":24241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 357.083 Da; putative annotation: N/A; putative formula: C15H15N7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.17,"smiles":null,"spectrum_id":"CCMSLIB00017255310","spectrum_index":24242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 386.1843 Da; putative annotation: N/A; putative formula: C21H26N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.276,"smiles":null,"spectrum_id":"CCMSLIB00017255313","spectrum_index":24243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 28.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.15,"smiles":null,"spectrum_id":"CCMSLIB00017255315","spectrum_index":24244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 575.4178 Da; putative annotation: N/A; putative formula: C38H59NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.489,"smiles":null,"spectrum_id":"CCMSLIB00017255317","spectrum_index":24245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 25.8958 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.956,"smiles":null,"spectrum_id":"CCMSLIB00017255320","spectrum_index":24246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 279.2768 Da; putative annotation: N/A; putative formula: C16H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.342,"smiles":null,"spectrum_id":"CCMSLIB00017255322","spectrum_index":24247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 260.1212 Da; putative annotation: N/A; putative formula: C12H16N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.28,"smiles":null,"spectrum_id":"CCMSLIB00017255324","spectrum_index":24248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-L-phenylalanine (delta mass: 118.0418 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.118,"smiles":null,"spectrum_id":"CCMSLIB00017255327","spectrum_index":24249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Aminobutyl)hydroxylamine (delta mass: 83.0737 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.176,"smiles":null,"spectrum_id":"CCMSLIB00017255329","spectrum_index":24250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 87.8948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.981,"smiles":null,"spectrum_id":"CCMSLIB00017255331","spectrum_index":24251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 162.0677 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.127,"smiles":null,"spectrum_id":"CCMSLIB00017255334","spectrum_index":24252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 52.9887 Da; putative annotation: N/A; putative formula: C2H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.039,"smiles":null,"spectrum_id":"CCMSLIB00017255336","spectrum_index":24253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 363.3516 Da; putative annotation: N/A; putative formula: C24H45NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.484,"smiles":null,"spectrum_id":"CCMSLIB00017255338","spectrum_index":24254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 26.0157 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017255341","spectrum_index":24255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(5-fluoropentyl)- (delta mass: 114.0852 Da; putative annotation: N/A; putative formula: C7H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.209,"smiles":null,"spectrum_id":"CCMSLIB00017255344","spectrum_index":24256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 56.0873 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.13,"smiles":null,"spectrum_id":"CCMSLIB00017255345","spectrum_index":24257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine D (delta mass: 594.1804 Da; putative annotation: N/A; putative formula: C38H22N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":963.361,"smiles":null,"spectrum_id":"CCMSLIB00017255348","spectrum_index":24258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(1H-1,2,3,4-tetraazol-5-yl)-4-[(4-hydroxy-3-methoxyphenyl)methylene]-3-methy l-1,2-diazolin-5-one CollisionEnergy:205060\"\" (delta mass: 136.061 Da; putative annotation: N/A; putative formula: C3H4N8O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.165,"smiles":null,"spectrum_id":"CCMSLIB00017255351","spectrum_index":24259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Acetylmorphine (delta mass: 43.9984 Da; putative annotation: N/A; putative formula: N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.153,"smiles":null,"spectrum_id":"CCMSLIB00017255352","spectrum_index":24260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 248.0449 Da; putative annotation: N/A; putative formula: C9H13O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.105,"smiles":null,"spectrum_id":"CCMSLIB00017255355","spectrum_index":24261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 66.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.182,"smiles":null,"spectrum_id":"CCMSLIB00017255358","spectrum_index":24262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 249.2452 Da; putative annotation: N/A; putative formula: C17H31N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.336,"smiles":null,"spectrum_id":"CCMSLIB00017255359","spectrum_index":24263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 114.068 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.117,"smiles":null,"spectrum_id":"CCMSLIB00017255362","spectrum_index":24264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 100.0527 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.139,"smiles":null,"spectrum_id":"CCMSLIB00017255364","spectrum_index":24265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 16.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.145,"smiles":null,"spectrum_id":"CCMSLIB00017255366","spectrum_index":24266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 65.061 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017255369","spectrum_index":24267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 53.0716 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.176,"smiles":null,"spectrum_id":"CCMSLIB00017255370","spectrum_index":24268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 23.06 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.141,"smiles":null,"spectrum_id":"CCMSLIB00017255373","spectrum_index":24269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose - 30.0 eV (delta mass: 359.145 Da; putative annotation: N/A; putative formula: C14H25N5O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.268,"smiles":null,"spectrum_id":"CCMSLIB00017255376","spectrum_index":24270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 170.1308 Da; putative annotation: N/A; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.27,"smiles":null,"spectrum_id":"CCMSLIB00017255377","spectrum_index":24271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 546.2319 Da; putative annotation: N/A; putative formula: C28H39N2O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.297,"smiles":null,"spectrum_id":"CCMSLIB00017255380","spectrum_index":24272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 43.9901 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.108,"smiles":null,"spectrum_id":"CCMSLIB00017255383","spectrum_index":24273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017255384","spectrum_index":24274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 320.2388 Da; putative annotation: N/A; putative formula: C19H33N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.424,"smiles":null,"spectrum_id":"CCMSLIB00017255387","spectrum_index":24275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 86.0372 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.108,"smiles":null,"spectrum_id":"CCMSLIB00017255388","spectrum_index":24276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 218.1004 Da; putative annotation: N/A; putative formula: C9H19N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.26,"smiles":null,"spectrum_id":"CCMSLIB00017255391","spectrum_index":24277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 103.0298 Da; putative annotation: N/A; putative formula: C2H6N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.127,"smiles":null,"spectrum_id":"CCMSLIB00017255393","spectrum_index":24278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 36.0717 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.131,"smiles":null,"spectrum_id":"CCMSLIB00017255395","spectrum_index":24279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Skatole - 40.0 eV (delta mass: 25.9464 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.027,"smiles":null,"spectrum_id":"CCMSLIB00017255398","spectrum_index":24280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 135.1043 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.18,"smiles":null,"spectrum_id":"CCMSLIB00017255399","spectrum_index":24281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 675.3058 Da; putative annotation: N/A; putative formula: C39H41N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.47,"smiles":null,"spectrum_id":"CCMSLIB00017255402","spectrum_index":24282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 157.023 Da; putative annotation: N/A; putative formula: C5H8N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.12,"smiles":null,"spectrum_id":"CCMSLIB00017255405","spectrum_index":24283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 176.0294 Da; putative annotation: N/A; putative formula: C2H4N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.095,"smiles":null,"spectrum_id":"CCMSLIB00017255406","spectrum_index":24284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 122.1007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.2,"smiles":null,"spectrum_id":"CCMSLIB00017255409","spectrum_index":24285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 294.1872 Da; putative annotation: N/A; putative formula: C15H26N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.226,"smiles":null,"spectrum_id":"CCMSLIB00017255410","spectrum_index":24286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 542.1772 Da; putative annotation: N/A; putative formula: C25H30N6O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.306,"smiles":null,"spectrum_id":"CCMSLIB00017255413","spectrum_index":24287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 253.0337 Da; putative annotation: N/A; putative formula: C9H7N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.125,"smiles":null,"spectrum_id":"CCMSLIB00017255414","spectrum_index":24288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4-amino-3-indol-3-ylazoline-2,5-dione CollisionEnergy:102040\"\" (delta mass: 26.9993 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.076,"smiles":null,"spectrum_id":"CCMSLIB00017255417","spectrum_index":24289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 265.2249 Da; putative annotation: N/A; putative formula: C14H27N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.306,"smiles":null,"spectrum_id":"CCMSLIB00017255420","spectrum_index":24290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(6-Methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-furaldehyde (delta mass: 27.0666 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.115,"smiles":null,"spectrum_id":"CCMSLIB00017255423","spectrum_index":24291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Omeprazole sulfide (delta mass: 72.033 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.16,"smiles":null,"spectrum_id":"CCMSLIB00017255424","spectrum_index":24292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 453.2567 Da; putative annotation: N/A; putative formula: C33H31N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.327,"smiles":null,"spectrum_id":"CCMSLIB00017255427","spectrum_index":24293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (Z,E)-Tetradeca-9,12-dienol from NIST14 (delta mass: 176.0316 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.237,"smiles":null,"spectrum_id":"CCMSLIB00017255428","spectrum_index":24294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 372.2657 Da; putative annotation: N/A; putative formula: C24H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.399,"smiles":null,"spectrum_id":"CCMSLIB00017255431","spectrum_index":24295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 147.126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.206,"smiles":null,"spectrum_id":"CCMSLIB00017255434","spectrum_index":24296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 206.137 Da; putative annotation: N/A; putative formula: C7H18N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.216,"smiles":null,"spectrum_id":"CCMSLIB00017255435","spectrum_index":24297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100304 N-alpha-Acetyl-L-ornithine|Ac-Orn|AOR|(2S)-2-acetamido-5-aminopentanoic acid|Nalpha-Acetyl-L-ornithine (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.123,"smiles":null,"spectrum_id":"CCMSLIB00017255438","spectrum_index":24298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 139.0633 Da; putative annotation: N/A; putative formula: C7H9NO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.15,"smiles":null,"spectrum_id":"CCMSLIB00017255441","spectrum_index":24299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 112.0883 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.156,"smiles":null,"spectrum_id":"CCMSLIB00017255442","spectrum_index":24300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 142.0955 Da; putative annotation: N/A; putative formula: C4H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.145,"smiles":null,"spectrum_id":"CCMSLIB00017255445","spectrum_index":24301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Amino-2-methylpropyl)urea (delta mass: 42.0184 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.132,"smiles":null,"spectrum_id":"CCMSLIB00017255447","spectrum_index":24302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 43.0133 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.085,"smiles":null,"spectrum_id":"CCMSLIB00017255450","spectrum_index":24303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 358.1271 Da; putative annotation: N/A; putative formula: C17H26O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.166,"smiles":null,"spectrum_id":"CCMSLIB00017255453","spectrum_index":24304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 56.0214 Da; putative annotation: N/A; putative formula: C3H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.097,"smiles":null,"spectrum_id":"CCMSLIB00017255455","spectrum_index":24305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 54.0316 Da; putative annotation: N/A; putative formula: CH2N4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.081,"smiles":null,"spectrum_id":"CCMSLIB00017255457","spectrum_index":24306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 26.0138 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.136,"smiles":null,"spectrum_id":"CCMSLIB00017255460","spectrum_index":24307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 60.0452 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.194,"smiles":null,"spectrum_id":"CCMSLIB00017255462","spectrum_index":24308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 57.0211 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.103,"smiles":null,"spectrum_id":"CCMSLIB00017255464","spectrum_index":24309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 60.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.148,"smiles":null,"spectrum_id":"CCMSLIB00017255467","spectrum_index":24310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 189.1149 Da; putative annotation: N/A; putative formula: C12H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.196,"smiles":null,"spectrum_id":"CCMSLIB00017255469","spectrum_index":24311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 417.1103 Da; putative annotation: N/A; putative formula: C18H27NO4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.181,"smiles":null,"spectrum_id":"CCMSLIB00017255471","spectrum_index":24312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 357.122 Da; putative annotation: N/A; putative formula: C12H19N7O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.245,"smiles":null,"spectrum_id":"CCMSLIB00017255474","spectrum_index":24313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 311.1972 Da; putative annotation: N/A; putative formula: C15H21N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.346,"smiles":null,"spectrum_id":"CCMSLIB00017255475","spectrum_index":24314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 60.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017255478","spectrum_index":24315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 645.5912 Da; putative annotation: N/A; putative formula: C39H75N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1000.72,"smiles":null,"spectrum_id":"CCMSLIB00017255481","spectrum_index":24316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 78.0466 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.174,"smiles":null,"spectrum_id":"CCMSLIB00017255482","spectrum_index":24317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 112.0678 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017255485","spectrum_index":24318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 349.1386 Da; putative annotation: N/A; putative formula: C15H19N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.418,"smiles":null,"spectrum_id":"CCMSLIB00017255486","spectrum_index":24319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylquinolin-4-amine (delta mass: 30.9945 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017255489","spectrum_index":24320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 278.2629 Da; putative annotation: N/A; putative formula: C19H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.331,"smiles":null,"spectrum_id":"CCMSLIB00017255492","spectrum_index":24321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 98.0163 Da; putative annotation: N/A; putative formula: C8H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.06,"smiles":null,"spectrum_id":"CCMSLIB00017255493","spectrum_index":24322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1-(4-Chlorobenzyl)-2-methyl-1H-indol-3-yl]methanol (delta mass: 180.0253 Da; putative annotation: N/A; putative formula: C2N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.125,"smiles":null,"spectrum_id":"CCMSLIB00017255496","spectrum_index":24323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 118.0266 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.129,"smiles":null,"spectrum_id":"CCMSLIB00017255499","spectrum_index":24324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 209.1346 Da; putative annotation: N/A; putative formula: C11H19N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.288,"smiles":null,"spectrum_id":"CCMSLIB00017255500","spectrum_index":24325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 204.0975 Da; putative annotation: N/A; putative formula: C13H16S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.273,"smiles":null,"spectrum_id":"CCMSLIB00017255503","spectrum_index":24326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 122.0735 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.149,"smiles":null,"spectrum_id":"CCMSLIB00017255504","spectrum_index":24327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 32.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.15,"smiles":null,"spectrum_id":"CCMSLIB00017255507","spectrum_index":24328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine - 40.0 eV (delta mass: 61.0717 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.122,"smiles":null,"spectrum_id":"CCMSLIB00017255510","spectrum_index":24329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 107.0577 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.18,"smiles":null,"spectrum_id":"CCMSLIB00017255511","spectrum_index":24330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 56.0273 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.064,"smiles":null,"spectrum_id":"CCMSLIB00017255514","spectrum_index":24331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 72.0199 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.101,"smiles":null,"spectrum_id":"CCMSLIB00017255517","spectrum_index":24332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 55.0229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.088,"smiles":null,"spectrum_id":"CCMSLIB00017255518","spectrum_index":24333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 113.0028 Da; putative annotation: N/A; putative formula: C4H4NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.073,"smiles":null,"spectrum_id":"CCMSLIB00017255521","spectrum_index":24334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 198.0613 Da; putative annotation: N/A; putative formula: C4H6N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.123,"smiles":null,"spectrum_id":"CCMSLIB00017255523","spectrum_index":24335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 352.3357 Da; putative annotation: N/A; putative formula: C23H44O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.412,"smiles":null,"spectrum_id":"CCMSLIB00017255525","spectrum_index":24336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate (delta mass: 242.2022 Da; putative annotation: N/A; putative formula: C12H27N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.471,"smiles":null,"spectrum_id":"CCMSLIB00017255528","spectrum_index":24337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTITOL (delta mass: 46.0115 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.098,"smiles":null,"spectrum_id":"CCMSLIB00017255529","spectrum_index":24338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (2Z)-2-cyano-3-(1H-indol-3-yl)prop-2-enoate (delta mass: 27.9953 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.092,"smiles":null,"spectrum_id":"CCMSLIB00017255532","spectrum_index":24339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 68.974 Da; putative annotation: N/A; putative formula: C2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.113,"smiles":null,"spectrum_id":"CCMSLIB00017255534","spectrum_index":24340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucrose (delta mass: 448.2452 Da; putative annotation: N/A; putative formula: C19H37N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.369,"smiles":null,"spectrum_id":"CCMSLIB00017255536","spectrum_index":24341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 403.3667 Da; putative annotation: N/A; putative formula: C24H45N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.448,"smiles":null,"spectrum_id":"CCMSLIB00017255539","spectrum_index":24342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 280.2409 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.364,"smiles":null,"spectrum_id":"CCMSLIB00017255540","spectrum_index":24343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 100.1076 Da; putative annotation: N/A; putative formula: C4H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.204,"smiles":null,"spectrum_id":"CCMSLIB00017255543","spectrum_index":24344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 242.2249 Da; putative annotation: N/A; putative formula: C15H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.262,"smiles":null,"spectrum_id":"CCMSLIB00017255545","spectrum_index":24345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 488.4282 Da; putative annotation: N/A; putative formula: C30H56N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.509,"smiles":null,"spectrum_id":"CCMSLIB00017255547","spectrum_index":24346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydro-6-hydroxy-.alpha.,2,5,7,8-pentamethyl-2H-1-benzopyran-2-pentanoic acid (delta mass: 207.0745 Da; putative annotation: N/A; putative formula: C7H13NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.281,"smiles":null,"spectrum_id":"CCMSLIB00017255550","spectrum_index":24347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 395.2309 Da; putative annotation: N/A; putative formula: C21H33NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.291,"smiles":null,"spectrum_id":"CCMSLIB00017255552","spectrum_index":24348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Pro from NIST14 (delta mass: 762.4334 Da; putative annotation: N/A; putative formula: C37H66N2O12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1025.57,"smiles":null,"spectrum_id":"CCMSLIB00017255554","spectrum_index":24349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 32.0302 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.18,"smiles":null,"spectrum_id":"CCMSLIB00017255557","spectrum_index":24350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311109 Strictosidinic acid (delta mass: 516.2082 Da; putative annotation: N/A; putative formula: C30H32N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1033.43,"smiles":null,"spectrum_id":"CCMSLIB00017255559","spectrum_index":24351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 779.4443 Da; putative annotation: N/A; putative formula: C46H61N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1062.55,"smiles":null,"spectrum_id":"CCMSLIB00017255561","spectrum_index":24352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 880.4637 Da; putative annotation: N/A; putative formula: C51H60N8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1043.52,"smiles":null,"spectrum_id":"CCMSLIB00017255563","spectrum_index":24353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 42.0468 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.107,"smiles":null,"spectrum_id":"CCMSLIB00017255566","spectrum_index":24354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.108,"smiles":null,"spectrum_id":"CCMSLIB00017255569","spectrum_index":24355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 104.0626 Da; putative annotation: N/A; putative formula: C8H8)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017255571","spectrum_index":24356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.143,"smiles":null,"spectrum_id":"CCMSLIB00017255574","spectrum_index":24357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 419.189 Da; putative annotation: N/A; putative formula: C21H31N3O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.338,"smiles":null,"spectrum_id":"CCMSLIB00017255576","spectrum_index":24358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 42.0085 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.126,"smiles":null,"spectrum_id":"CCMSLIB00017255579","spectrum_index":24359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1089.5352 Da; putative annotation: N/A; putative formula: C65H75N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1432.66,"smiles":null,"spectrum_id":"CCMSLIB00017255580","spectrum_index":24360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380167-01!3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015] (delta mass: 98.0521 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.206,"smiles":null,"spectrum_id":"CCMSLIB00017255583","spectrum_index":24361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 114.0686 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.155,"smiles":null,"spectrum_id":"CCMSLIB00017255586","spectrum_index":24362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 65.0492 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.135,"smiles":null,"spectrum_id":"CCMSLIB00017255587","spectrum_index":24363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match] (delta mass: 439.2936 Da; putative annotation: N/A; putative formula: C24H41NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.562,"smiles":null,"spectrum_id":"CCMSLIB00017255590","spectrum_index":24364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 211.1037 Da; putative annotation: N/A; putative formula: C11H19NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.143,"smiles":null,"spectrum_id":"CCMSLIB00017255591","spectrum_index":24365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 815.2649 Da; putative annotation: N/A; putative formula: C40H41N5O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1482.49,"smiles":null,"spectrum_id":"CCMSLIB00017255594","spectrum_index":24366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 378.2038 Da; putative annotation: N/A; putative formula: C21H30O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.274,"smiles":null,"spectrum_id":"CCMSLIB00017255595","spectrum_index":24367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 159.053 Da; putative annotation: N/A; putative formula: C6H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.186,"smiles":null,"spectrum_id":"CCMSLIB00017255598","spectrum_index":24368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 228.1491 Da; putative annotation: N/A; putative formula: C12H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.293,"smiles":null,"spectrum_id":"CCMSLIB00017255600","spectrum_index":24369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 148.0888 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.17,"smiles":null,"spectrum_id":"CCMSLIB00017255602","spectrum_index":24370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.113,"smiles":null,"spectrum_id":"CCMSLIB00017255605","spectrum_index":24371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 262.1141 Da; putative annotation: N/A; putative formula: C14H18N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.155,"smiles":null,"spectrum_id":"CCMSLIB00017255606","spectrum_index":24372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 246.2351 Da; putative annotation: N/A; putative formula: C18H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.332,"smiles":null,"spectrum_id":"CCMSLIB00017255609","spectrum_index":24373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 82.0781 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017255611","spectrum_index":24374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 257.0891 Da; putative annotation: N/A; putative formula: C15H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.153,"smiles":null,"spectrum_id":"CCMSLIB00017255613","spectrum_index":24375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 893.2878 Da; putative annotation: N/A; putative formula: C50H37N15O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1115.39,"smiles":null,"spectrum_id":"CCMSLIB00017255616","spectrum_index":24376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 883.496 Da; putative annotation: N/A; putative formula: C55H69N3O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.56,"smiles":null,"spectrum_id":"CCMSLIB00017255617","spectrum_index":24377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 182.1678 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.276,"smiles":null,"spectrum_id":"CCMSLIB00017255620","spectrum_index":24378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 798.1758 Da; putative annotation: N/A; putative formula: C49H36O5P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1020.27,"smiles":null,"spectrum_id":"CCMSLIB00017255623","spectrum_index":24379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 306.2496 Da; putative annotation: N/A; putative formula: C19H34N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.525,"smiles":null,"spectrum_id":"CCMSLIB00017255624","spectrum_index":24380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 196.0739 Da; putative annotation: N/A; putative formula: C10H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.155,"smiles":null,"spectrum_id":"CCMSLIB00017255627","spectrum_index":24381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 231.1259 Da; putative annotation: N/A; putative formula: C14H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.254,"smiles":null,"spectrum_id":"CCMSLIB00017255628","spectrum_index":24382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 187.1211 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.181,"smiles":null,"spectrum_id":"CCMSLIB00017255631","spectrum_index":24383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 389.3506 Da; putative annotation: N/A; putative formula: C23H43N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.411,"smiles":null,"spectrum_id":"CCMSLIB00017255634","spectrum_index":24384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 431.361 Da; putative annotation: N/A; putative formula: C24H49NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.421,"smiles":null,"spectrum_id":"CCMSLIB00017255635","spectrum_index":24385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1054.1639 Da; putative annotation: N/A; putative formula: C50H38O26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1276.26,"smiles":null,"spectrum_id":"CCMSLIB00017255638","spectrum_index":24386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 826.9738 Da; putative annotation: N/A; putative formula: C27H21N7O14S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1049.07,"smiles":null,"spectrum_id":"CCMSLIB00017255640","spectrum_index":24387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 736.6 Da; putative annotation: N/A; putative formula: C48H80O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":877.727,"smiles":null,"spectrum_id":"CCMSLIB00017255642","spectrum_index":24388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 312.262 Da; putative annotation: N/A; putative formula: C11H28N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.305,"smiles":null,"spectrum_id":"CCMSLIB00017255645","spectrum_index":24389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 104.0627 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.154,"smiles":null,"spectrum_id":"CCMSLIB00017255646","spectrum_index":24390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 23.9994 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.127,"smiles":null,"spectrum_id":"CCMSLIB00017255649","spectrum_index":24391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 106.0478 Da; putative annotation: N/A; putative formula: CH6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.128,"smiles":null,"spectrum_id":"CCMSLIB00017255651","spectrum_index":24392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 118.042 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.118,"smiles":null,"spectrum_id":"CCMSLIB00017255653","spectrum_index":24393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_prop_2_en_1_yl__1H_indole_3_carboxylic_acid (delta mass: 236.1412 Da; putative annotation: N/A; putative formula: C14H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.228,"smiles":null,"spectrum_id":"CCMSLIB00017255656","spectrum_index":24394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 575.2949 Da; putative annotation: N/A; putative formula: C38H42NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.366,"smiles":null,"spectrum_id":"CCMSLIB00017255657","spectrum_index":24395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harman (delta mass: 94.0859 Da; putative annotation: N/A; putative formula: C6H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.178,"smiles":null,"spectrum_id":"CCMSLIB00017255660","spectrum_index":24396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 1190.7758 Da; putative annotation: N/A; putative formula: C73H102N6O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1328.87,"smiles":null,"spectrum_id":"CCMSLIB00017255662","spectrum_index":24397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 42.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017255664","spectrum_index":24398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 10.0564 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.137,"smiles":null,"spectrum_id":"CCMSLIB00017255667","spectrum_index":24399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 531.1732 Da; putative annotation: N/A; putative formula: C20H30N5O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.244,"smiles":null,"spectrum_id":"CCMSLIB00017255668","spectrum_index":24400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Valine, N-[(1-pentyl-1H-indol-3-yl)carbonyl]-, methyl ester (delta mass: 43.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.255,"smiles":null,"spectrum_id":"CCMSLIB00017255671","spectrum_index":24401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 294.1063 Da; putative annotation: N/A; putative formula: C10H18N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.143,"smiles":null,"spectrum_id":"CCMSLIB00017255673","spectrum_index":24402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole; LC-tDDA; CE30 (delta mass: 90.069 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.129,"smiles":null,"spectrum_id":"CCMSLIB00017255675","spectrum_index":24403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 59.034 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.132,"smiles":null,"spectrum_id":"CCMSLIB00017255678","spectrum_index":24404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180823-02!(3R,4R,5R)-5-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4-dihydroxycyclohexene-1-carboxylic acid (delta mass: 163.0355 Da; putative annotation: N/A; putative formula: C7H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.127,"smiles":null,"spectrum_id":"CCMSLIB00017255680","spectrum_index":24405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 249.0297 Da; putative annotation: N/A; putative formula: C10H8N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.121,"smiles":null,"spectrum_id":"CCMSLIB00017255682","spectrum_index":24406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 423.6469 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1098.89,"smiles":null,"spectrum_id":"CCMSLIB00017255685","spectrum_index":24407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 68.8893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.986,"smiles":null,"spectrum_id":"CCMSLIB00017255686","spectrum_index":24408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 27.1204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.186,"smiles":null,"spectrum_id":"CCMSLIB00017255689","spectrum_index":24409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 333.118 Da; putative annotation: N/A; putative formula: C13H23N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.189,"smiles":null,"spectrum_id":"CCMSLIB00017255692","spectrum_index":24410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 189.0355 Da; putative annotation: N/A; putative formula: C9H7N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.153,"smiles":null,"spectrum_id":"CCMSLIB00017255693","spectrum_index":24411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 52.0277 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.155,"smiles":null,"spectrum_id":"CCMSLIB00017255696","spectrum_index":24412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 45.0216 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.082,"smiles":null,"spectrum_id":"CCMSLIB00017255698","spectrum_index":24413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 42.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.128,"smiles":null,"spectrum_id":"CCMSLIB00017255700","spectrum_index":24414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 128.0469 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.107,"smiles":null,"spectrum_id":"CCMSLIB00017255703","spectrum_index":24415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Nitroso-6-quinolinol (delta mass: 167.0835 Da; putative annotation: N/A; putative formula: C11H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.134,"smiles":null,"spectrum_id":"CCMSLIB00017255704","spectrum_index":24416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 115.0633 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.144,"smiles":null,"spectrum_id":"CCMSLIB00017255707","spectrum_index":24417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 222.1067 Da; putative annotation: N/A; putative formula: C16H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.182,"smiles":null,"spectrum_id":"CCMSLIB00017255710","spectrum_index":24418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 62.0009 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.061,"smiles":null,"spectrum_id":"CCMSLIB00017255711","spectrum_index":24419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 139.0631 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017255713","spectrum_index":24420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 24.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.123,"smiles":null,"spectrum_id":"CCMSLIB00017255715","spectrum_index":24421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 57.0828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.17,"smiles":null,"spectrum_id":"CCMSLIB00017255718","spectrum_index":24422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 440.2471 Da; putative annotation: N/A; putative formula: C22H32N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.338,"smiles":null,"spectrum_id":"CCMSLIB00017255719","spectrum_index":24423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 113.0838 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017255722","spectrum_index":24424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 224.0701 Da; putative annotation: lumichrome CollisionEnergy:102040; putative formula: C12H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.13,"smiles":null,"spectrum_id":"CCMSLIB00017255725","spectrum_index":24425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(2-methoxybenzyl)ethanamine (delta mass: 102.0453 Da; putative annotation: 4-Vinylphenol; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.19,"smiles":null,"spectrum_id":"CCMSLIB00017255726","spectrum_index":24426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 83.0376 Da; putative annotation: L-Homoserine lactone; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017255729","spectrum_index":24427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 322.1054 Da; putative annotation: Linocinnamarin; putative formula: C16H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.186,"smiles":null,"spectrum_id":"CCMSLIB00017255731","spectrum_index":24428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Leu (delta mass: 186.097 Da; putative annotation: Ser-Val; putative formula: C8H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.278,"smiles":null,"spectrum_id":"CCMSLIB00017255733","spectrum_index":24429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 147.066 Da; putative annotation: 1,2,3,4-Tetrahydro-6,7-isoquinolinediol; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.152,"smiles":null,"spectrum_id":"CCMSLIB00017255736","spectrum_index":24430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 176.1053 Da; putative annotation: Tetraethylene glycol; putative formula: C8H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.155,"smiles":null,"spectrum_id":"CCMSLIB00017255737","spectrum_index":24431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Leu-DL-Val (delta mass: 113.0898 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.26,"smiles":null,"spectrum_id":"CCMSLIB00017255740","spectrum_index":24432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 84.1068 Da; putative annotation: N/A; putative formula: C5H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.187,"smiles":null,"spectrum_id":"CCMSLIB00017255743","spectrum_index":24433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 210.0517 Da; putative annotation: N/A; putative formula: C4H11N4O4P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.169,"smiles":null,"spectrum_id":"CCMSLIB00017255744","spectrum_index":24434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 141.0777 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.227,"smiles":null,"spectrum_id":"CCMSLIB00017255747","spectrum_index":24435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 24.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.145,"smiles":null,"spectrum_id":"CCMSLIB00017255748","spectrum_index":24436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 338.2826 Da; putative annotation: N/A; putative formula: C21H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.374,"smiles":null,"spectrum_id":"CCMSLIB00017255751","spectrum_index":24437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 62.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.29,"smiles":null,"spectrum_id":"CCMSLIB00017255754","spectrum_index":24438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 244.9709 Da; putative annotation: N/A; putative formula: C5H7N5O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.057,"smiles":null,"spectrum_id":"CCMSLIB00017255755","spectrum_index":24439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 40.9983 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.111,"smiles":null,"spectrum_id":"CCMSLIB00017255758","spectrum_index":24440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethyleneberberine (delta mass: 348.0939 Da; putative annotation: N/A; putative formula: C12H22N4O2P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.217,"smiles":null,"spectrum_id":"CCMSLIB00017255761","spectrum_index":24441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 523.1957 Da; putative annotation: N/A; putative formula: C27H29N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.261,"smiles":null,"spectrum_id":"CCMSLIB00017255762","spectrum_index":24442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 9.8905 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.977,"smiles":null,"spectrum_id":"CCMSLIB00017255765","spectrum_index":24443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 156.0674 Da; putative annotation: N/A; putative formula: C10H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017255768","spectrum_index":24444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 95.0736 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.16,"smiles":null,"spectrum_id":"CCMSLIB00017255769","spectrum_index":24445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 458.1937 Da; putative annotation: N/A; putative formula: C25H30O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.254,"smiles":null,"spectrum_id":"CCMSLIB00017255772","spectrum_index":24446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 263.0342 Da; putative annotation: N/A; putative formula: C15HN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.147,"smiles":null,"spectrum_id":"CCMSLIB00017255775","spectrum_index":24447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 481.3052 Da; putative annotation: N/A; putative formula: C27H39N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.365,"smiles":null,"spectrum_id":"CCMSLIB00017255776","spectrum_index":24448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 650.1688 Da; putative annotation: N/A; putative formula: C39H26N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.229,"smiles":null,"spectrum_id":"CCMSLIB00017255779","spectrum_index":24449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 268.0374 Da; putative annotation: N/A; putative formula: C8H16N2O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.161,"smiles":null,"spectrum_id":"CCMSLIB00017255780","spectrum_index":24450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 36.9141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.98,"smiles":null,"spectrum_id":"CCMSLIB00017255783","spectrum_index":24451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Benz[g]indole-2-carboxylic acid (delta mass: 49.0644 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.135,"smiles":null,"spectrum_id":"CCMSLIB00017255786","spectrum_index":24452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 323.3032 Da; putative annotation: N/A; putative formula: C18H37N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.405,"smiles":null,"spectrum_id":"CCMSLIB00017255787","spectrum_index":24453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 131.0406 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.164,"smiles":null,"spectrum_id":"CCMSLIB00017255790","spectrum_index":24454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 102.0855 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.193,"smiles":null,"spectrum_id":"CCMSLIB00017255791","spectrum_index":24455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 72.0574 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.185,"smiles":null,"spectrum_id":"CCMSLIB00017255794","spectrum_index":24456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 408.2869 Da; putative annotation: N/A; putative formula: C24H40O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.368,"smiles":null,"spectrum_id":"CCMSLIB00017255797","spectrum_index":24457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 283.1268 Da; putative annotation: N/A; putative formula: C10H21NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.197,"smiles":null,"spectrum_id":"CCMSLIB00017255798","spectrum_index":24458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 566.1257 Da; putative annotation: N/A; putative formula: C23H38N2O2S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":827.163,"smiles":null,"spectrum_id":"CCMSLIB00017255801","spectrum_index":24459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 372.1266 Da; putative annotation: N/A; putative formula: C13H24O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.197,"smiles":null,"spectrum_id":"CCMSLIB00017255803","spectrum_index":24460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 654.2306 Da; putative annotation: N/A; putative formula: C26H42N2O15S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":835.271,"smiles":null,"spectrum_id":"CCMSLIB00017255805","spectrum_index":24461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic LL-D253.alpha. (delta mass: 202.0418 Da; putative annotation: N/A; putative formula: C15H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.149,"smiles":null,"spectrum_id":"CCMSLIB00017255808","spectrum_index":24462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 138.0272 Da; putative annotation: N/A; putative formula: C2H6N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.129,"smiles":null,"spectrum_id":"CCMSLIB00017255811","spectrum_index":24463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371603 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 42.0459 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.116,"smiles":null,"spectrum_id":"CCMSLIB00017255813","spectrum_index":24464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 165.0754 Da; putative annotation: N/A; putative formula: C4H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.162,"smiles":null,"spectrum_id":"CCMSLIB00017255815","spectrum_index":24465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 116.0296 Da; putative annotation: N/A; putative formula: C5H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.1,"smiles":null,"spectrum_id":"CCMSLIB00017255818","spectrum_index":24466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.096,"smiles":null,"spectrum_id":"CCMSLIB00017255820","spectrum_index":24467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 210.0889 Da; putative annotation: N/A; putative formula: C11H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.222,"smiles":null,"spectrum_id":"CCMSLIB00017255822","spectrum_index":24468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Debromohymenialdisine (delta mass: 254.224 Da; putative annotation: N/A; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.323,"smiles":null,"spectrum_id":"CCMSLIB00017255825","spectrum_index":24469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 64.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.087,"smiles":null,"spectrum_id":"CCMSLIB00017255828","spectrum_index":24470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenol (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.102,"smiles":null,"spectrum_id":"CCMSLIB00017255829","spectrum_index":24471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1012.2423 Da; putative annotation: N/A; putative formula: C32H64N6O16S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1234.34,"smiles":null,"spectrum_id":"CCMSLIB00017255832","spectrum_index":24472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole (delta mass: 28.9154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.98,"smiles":null,"spectrum_id":"CCMSLIB00017255835","spectrum_index":24473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 190.1493 Da; putative annotation: N/A; putative formula: C12H18N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.22,"smiles":null,"spectrum_id":"CCMSLIB00017255836","spectrum_index":24474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 508.1386 Da; putative annotation: N/A; putative formula: C21H28N6O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1481.46,"smiles":null,"spectrum_id":"CCMSLIB00017255839","spectrum_index":24475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 89.0475 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.124,"smiles":null,"spectrum_id":"CCMSLIB00017255842","spectrum_index":24476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 250.1133 Da; putative annotation: N/A; putative formula: C13H18N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.154,"smiles":null,"spectrum_id":"CCMSLIB00017255843","spectrum_index":24477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 114.0427 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.192,"smiles":null,"spectrum_id":"CCMSLIB00017255846","spectrum_index":24478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 236.2114 Da; putative annotation: N/A; putative formula: C12H24N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.308,"smiles":null,"spectrum_id":"CCMSLIB00017255848","spectrum_index":24479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 118.0846 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.26,"smiles":null,"spectrum_id":"CCMSLIB00017255850","spectrum_index":24480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 252.1209 Da; putative annotation: N/A; putative formula: C10H20O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.207,"smiles":null,"spectrum_id":"CCMSLIB00017255853","spectrum_index":24481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 152.0468 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.092,"smiles":null,"spectrum_id":"CCMSLIB00017255855","spectrum_index":24482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 171.0377 Da; putative annotation: N/A; putative formula: C6H10N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.124,"smiles":null,"spectrum_id":"CCMSLIB00017255857","spectrum_index":24483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 126.0935 Da; putative annotation: N/A; putative formula: C8H15O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.201,"smiles":null,"spectrum_id":"CCMSLIB00017255860","spectrum_index":24484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 88.0523 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017255862","spectrum_index":24485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 125.0485 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.127,"smiles":null,"spectrum_id":"CCMSLIB00017255865","spectrum_index":24486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 13.9858 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.181,"smiles":null,"spectrum_id":"CCMSLIB00017255867","spectrum_index":24487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 193.058 Da; putative annotation: N/A; putative formula: C10H13NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.129,"smiles":null,"spectrum_id":"CCMSLIB00017255870","spectrum_index":24488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 102.9356 Da; putative annotation: N/A; putative formula: CH-1NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.975,"smiles":null,"spectrum_id":"CCMSLIB00017255872","spectrum_index":24489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-1H-indole-3-carbaldehyde (delta mass: 196.1347 Da; putative annotation: N/A; putative formula: C14H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.156,"smiles":null,"spectrum_id":"CCMSLIB00017255875","spectrum_index":24490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 96.0935 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.185,"smiles":null,"spectrum_id":"CCMSLIB00017255877","spectrum_index":24491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 72.0271 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.131,"smiles":null,"spectrum_id":"CCMSLIB00017255880","spectrum_index":24492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 173.0471 Da; putative annotation: N/A; putative formula: C4H8N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.133,"smiles":null,"spectrum_id":"CCMSLIB00017255881","spectrum_index":24493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 271.149 Da; putative annotation: N/A; putative formula: C17H22NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.24,"smiles":null,"spectrum_id":"CCMSLIB00017255884","spectrum_index":24494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 40.9767 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.105,"smiles":null,"spectrum_id":"CCMSLIB00017255887","spectrum_index":24495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 89.0638 Da; putative annotation: N/A; putative formula: C7H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.124,"smiles":null,"spectrum_id":"CCMSLIB00017255888","spectrum_index":24496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 271.178 Da; putative annotation: N/A; putative formula: C14H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.249,"smiles":null,"spectrum_id":"CCMSLIB00017255891","spectrum_index":24497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 96.059 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.182,"smiles":null,"spectrum_id":"CCMSLIB00017255893","spectrum_index":24498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 29.9888 Da; putative annotation: N/A; putative formula: C4H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.09,"smiles":null,"spectrum_id":"CCMSLIB00017255895","spectrum_index":24499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 68.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.145,"smiles":null,"spectrum_id":"CCMSLIB00017255898","spectrum_index":24500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 486.167 Da; putative annotation: N/A; putative formula: C21H30N2O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.253,"smiles":null,"spectrum_id":"CCMSLIB00017255899","spectrum_index":24501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 747.5858 Da; putative annotation: N/A; putative formula: C54H73N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.646,"smiles":null,"spectrum_id":"CCMSLIB00017255902","spectrum_index":24502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 194.0764 Da; putative annotation: N/A; putative formula: C3H10N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.23,"smiles":null,"spectrum_id":"CCMSLIB00017255904","spectrum_index":24503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexanoic acid, 5-(acetylamino)-4-oxo- (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.076,"smiles":null,"spectrum_id":"CCMSLIB00017255907","spectrum_index":24504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-7-hydroxy-8-(2-hydroxyethyl)-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 18.0008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.108,"smiles":null,"spectrum_id":"CCMSLIB00017255909","spectrum_index":24505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 274.2385 Da; putative annotation: N/A; putative formula: C12H31N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.279,"smiles":null,"spectrum_id":"CCMSLIB00017255911","spectrum_index":24506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 262.1458 Da; putative annotation: N/A; putative formula: C12H19N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.285,"smiles":null,"spectrum_id":"CCMSLIB00017255914","spectrum_index":24507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 44.0019 Da; putative annotation: N/A; putative formula: N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.079,"smiles":null,"spectrum_id":"CCMSLIB00017255917","spectrum_index":24508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 192.1883 Da; putative annotation: N/A; putative formula: C14H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017255918","spectrum_index":24509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 263.1009 Da; putative annotation: N/A; putative formula: C13H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.203,"smiles":null,"spectrum_id":"CCMSLIB00017255921","spectrum_index":24510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.087,"smiles":null,"spectrum_id":"CCMSLIB00017255923","spectrum_index":24511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.123,"smiles":null,"spectrum_id":"CCMSLIB00017255925","spectrum_index":24512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 303.1893 Da; putative annotation: N/A; putative formula: C16H25N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.26,"smiles":null,"spectrum_id":"CCMSLIB00017255928","spectrum_index":24513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 24.0353 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.19,"smiles":null,"spectrum_id":"CCMSLIB00017255929","spectrum_index":24514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 162.0388 Da; putative annotation: N/A; putative formula: C3H6N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.165,"smiles":null,"spectrum_id":"CCMSLIB00017255932","spectrum_index":24515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT106523 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole|2-(4-methyl-1,3-thiazol-5-yl)ethanol (delta mass: 25.0193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.067,"smiles":null,"spectrum_id":"CCMSLIB00017255934","spectrum_index":24516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 242.0333 Da; putative annotation: N/A; putative formula: C5H6N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.07,"smiles":null,"spectrum_id":"CCMSLIB00017255936","spectrum_index":24517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trehalose-6-phosphate (delta mass: 648.2121 Da; putative annotation: N/A; putative formula: C38H28N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1071.3,"smiles":null,"spectrum_id":"CCMSLIB00017255939","spectrum_index":24518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 352.198 Da; putative annotation: N/A; putative formula: C15H20N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.239,"smiles":null,"spectrum_id":"CCMSLIB00017255940","spectrum_index":24519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine (delta mass: 23.9998 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.112,"smiles":null,"spectrum_id":"CCMSLIB00017255943","spectrum_index":24520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydro-6-hydroxy-.alpha.,2,5,7,8-pentamethyl-2H-1-benzopyran-2-pentanoic acid (delta mass: 376.1883 Da; putative annotation: N/A; putative formula: C21H28O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.394,"smiles":null,"spectrum_id":"CCMSLIB00017255946","spectrum_index":24521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.112,"smiles":null,"spectrum_id":"CCMSLIB00017255947","spectrum_index":24522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 704.329 Da; putative annotation: N/A; putative formula: C51H44O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":999.462,"smiles":null,"spectrum_id":"CCMSLIB00017255950","spectrum_index":24523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 414.2336 Da; putative annotation: N/A; putative formula: C26H31N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.372,"smiles":null,"spectrum_id":"CCMSLIB00017255953","spectrum_index":24524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 58.0212 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.133,"smiles":null,"spectrum_id":"CCMSLIB00017255954","spectrum_index":24525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 327.1684 Da; putative annotation: N/A; putative formula: C16H25NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.239,"smiles":null,"spectrum_id":"CCMSLIB00017255957","spectrum_index":24526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 210.0668 Da; putative annotation: N/A; putative formula: C8H11N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.142,"smiles":null,"spectrum_id":"CCMSLIB00017255960","spectrum_index":24527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 85.0304 Da; putative annotation: N/A; putative formula: C7H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.112,"smiles":null,"spectrum_id":"CCMSLIB00017255961","spectrum_index":24528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 521.0426 Da; putative annotation: N/A; putative formula: C26H19NO5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.103,"smiles":null,"spectrum_id":"CCMSLIB00017255964","spectrum_index":24529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 96.0573 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.155,"smiles":null,"spectrum_id":"CCMSLIB00017255967","spectrum_index":24530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 165.1518 Da; putative annotation: N/A; putative formula: C11H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.342,"smiles":null,"spectrum_id":"CCMSLIB00017255968","spectrum_index":24531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(4-Ethyl-1-piperazinyl)carbonyl]-1H-indole (delta mass: 70.0444 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.204,"smiles":null,"spectrum_id":"CCMSLIB00017255971","spectrum_index":24532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 97.9998 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.139,"smiles":null,"spectrum_id":"CCMSLIB00017255974","spectrum_index":24533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 282.2563 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.353,"smiles":null,"spectrum_id":"CCMSLIB00017255975","spectrum_index":24534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 448.3177 Da; putative annotation: N/A; putative formula: C24H36N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.441,"smiles":null,"spectrum_id":"CCMSLIB00017255978","spectrum_index":24535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 134.0254 Da; putative annotation: N/A; putative formula: C2H6N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.164,"smiles":null,"spectrum_id":"CCMSLIB00017255981","spectrum_index":24536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 436.3487 Da; putative annotation: N/A; putative formula: C26H48N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.409,"smiles":null,"spectrum_id":"CCMSLIB00017255982","spectrum_index":24537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PAR_146.0966_8.3 (delta mass: 238.177 Da; putative annotation: N/A; putative formula: C8H18N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.273,"smiles":null,"spectrum_id":"CCMSLIB00017255985","spectrum_index":24538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-cysteine (delta mass: 69.0908 Da; putative annotation: N/A; putative formula: C5H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017255987","spectrum_index":24539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 97.8485 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.899,"smiles":null,"spectrum_id":"CCMSLIB00017255989","spectrum_index":24540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-Tyr-Arg (delta mass: 71.0372 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.283,"smiles":null,"spectrum_id":"CCMSLIB00017255992","spectrum_index":24541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 197.0782 Da; putative annotation: N/A; putative formula: C4H7N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.119,"smiles":null,"spectrum_id":"CCMSLIB00017255995","spectrum_index":24542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 266.2318 Da; putative annotation: N/A; putative formula: C12H26N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.312,"smiles":null,"spectrum_id":"CCMSLIB00017255998","spectrum_index":24543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 50.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.191,"smiles":null,"spectrum_id":"CCMSLIB00017255999","spectrum_index":24544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 433.2166 Da; putative annotation: N/A; putative formula: C19H36N3O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.313,"smiles":null,"spectrum_id":"CCMSLIB00017256002","spectrum_index":24545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 196.1832 Da; putative annotation: N/A; putative formula: C13H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.291,"smiles":null,"spectrum_id":"CCMSLIB00017256004","spectrum_index":24546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 769.966 Da; putative annotation: N/A; putative formula: C14H32O24P6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1080.08,"smiles":null,"spectrum_id":"CCMSLIB00017256006","spectrum_index":24547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 304.4029 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.679,"smiles":null,"spectrum_id":"CCMSLIB00017256009","spectrum_index":24548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 212.0346 Da; putative annotation: N/A; putative formula: C10H14O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.168,"smiles":null,"spectrum_id":"CCMSLIB00017256012","spectrum_index":24549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 233.0919 Da; putative annotation: N/A; putative formula: C10H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.157,"smiles":null,"spectrum_id":"CCMSLIB00017256013","spectrum_index":24550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 390.0542 Da; putative annotation: N/A; putative formula: C26H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.151,"smiles":null,"spectrum_id":"CCMSLIB00017256016","spectrum_index":24551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 45.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.229,"smiles":null,"spectrum_id":"CCMSLIB00017256019","spectrum_index":24552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 373.2827 Da; putative annotation: N/A; putative formula: C20H39NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.343,"smiles":null,"spectrum_id":"CCMSLIB00017256020","spectrum_index":24553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 204.1506 Da; putative annotation: N/A; putative formula: C14H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.205,"smiles":null,"spectrum_id":"CCMSLIB00017256023","spectrum_index":24554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 221.1263 Da; putative annotation: N/A; putative formula: C9H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.181,"smiles":null,"spectrum_id":"CCMSLIB00017256025","spectrum_index":24555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 286.218 Da; putative annotation: N/A; putative formula: C15H31N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.286,"smiles":null,"spectrum_id":"CCMSLIB00017256027","spectrum_index":24556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 247.0696 Da; putative annotation: N/A; putative formula: C12H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.156,"smiles":null,"spectrum_id":"CCMSLIB00017256030","spectrum_index":24557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 70.0054 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.139,"smiles":null,"spectrum_id":"CCMSLIB00017256032","spectrum_index":24558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 156.0422 Da; putative annotation: N/A; putative formula: C7H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.155,"smiles":null,"spectrum_id":"CCMSLIB00017256034","spectrum_index":24559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 605.4297 Da; putative annotation: N/A; putative formula: C30H56N9O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.5,"smiles":null,"spectrum_id":"CCMSLIB00017256037","spectrum_index":24560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 27.0118 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.135,"smiles":null,"spectrum_id":"CCMSLIB00017256038","spectrum_index":24561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 62.8964 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.956,"smiles":null,"spectrum_id":"CCMSLIB00017256041","spectrum_index":24562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 27.0163 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.191,"smiles":null,"spectrum_id":"CCMSLIB00017256044","spectrum_index":24563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 486.2263 Da; putative annotation: N/A; putative formula: C28H38O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.35,"smiles":null,"spectrum_id":"CCMSLIB00017256045","spectrum_index":24564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 208.0731 Da; putative annotation: N/A; putative formula: C11H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.155,"smiles":null,"spectrum_id":"CCMSLIB00017256048","spectrum_index":24565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vibriobactin (delta mass: 58.0523 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.324,"smiles":null,"spectrum_id":"CCMSLIB00017256050","spectrum_index":24566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 420.3425 Da; putative annotation: N/A; putative formula: C19H44N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1393.67,"smiles":null,"spectrum_id":"CCMSLIB00017256052","spectrum_index":24567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 220.2242 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.414,"smiles":null,"spectrum_id":"CCMSLIB00017256055","spectrum_index":24568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 284.2744 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.402,"smiles":null,"spectrum_id":"CCMSLIB00017256056","spectrum_index":24569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 287.143 Da; putative annotation: N/A; putative formula: C19H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.229,"smiles":null,"spectrum_id":"CCMSLIB00017256059","spectrum_index":24570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017256062","spectrum_index":24571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 118.0058 Da; putative annotation: N/A; putative formula: H2N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.123,"smiles":null,"spectrum_id":"CCMSLIB00017256063","spectrum_index":24572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 271.0826 Da; putative annotation: N/A; putative formula: C8H18NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.147,"smiles":null,"spectrum_id":"CCMSLIB00017256066","spectrum_index":24573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 42.0509 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.185,"smiles":null,"spectrum_id":"CCMSLIB00017256069","spectrum_index":24574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 478.3299 Da; putative annotation: N/A; putative formula: C28H46O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.411,"smiles":null,"spectrum_id":"CCMSLIB00017256070","spectrum_index":24575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 120.0936 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.174,"smiles":null,"spectrum_id":"CCMSLIB00017256073","spectrum_index":24576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 158.0835 Da; putative annotation: N/A; putative formula: C4H11N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.159,"smiles":null,"spectrum_id":"CCMSLIB00017256074","spectrum_index":24577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Helonioside A (delta mass: 108.0191 Da; putative annotation: 5-(Hydroxymethyl)-2-furaldehyde; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.237,"smiles":null,"spectrum_id":"CCMSLIB00017256077","spectrum_index":24578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 129.0429 Da; putative annotation: O-acetyl-L-serine CollisionEnergy:102040; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.144,"smiles":null,"spectrum_id":"CCMSLIB00017256079","spectrum_index":24579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 136.053 Da; putative annotation: 4-Hydroxy-3-methoxybenzenemethanol; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.218,"smiles":null,"spectrum_id":"CCMSLIB00017256081","spectrum_index":24580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 324.1081 Da; putative annotation: ?-Gentiobiose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1297.43,"smiles":null,"spectrum_id":"CCMSLIB00017256084","spectrum_index":24581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 127.1001 Da; putative annotation: 7-Aminoheptanoic acid; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.171,"smiles":null,"spectrum_id":"CCMSLIB00017256086","spectrum_index":24582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 148.052 Da; putative annotation: Tropic acid; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017256088","spectrum_index":24583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3S,4S,21R)-14-Ethyl-9-(hydroxymethyl)-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid (delta mass: 352.2548 Da; putative annotation: N/A; putative formula: C20H36N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":949.526,"smiles":null,"spectrum_id":"CCMSLIB00017256091","spectrum_index":24584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 571.2908 Da; putative annotation: N/A; putative formula: C31H37N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.404,"smiles":null,"spectrum_id":"CCMSLIB00017256092","spectrum_index":24585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 39.9949 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.055,"smiles":null,"spectrum_id":"CCMSLIB00017256095","spectrum_index":24586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Lys (delta mass: 266.0654 Da; putative annotation: N/A; putative formula: C11H22O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.262,"smiles":null,"spectrum_id":"CCMSLIB00017256098","spectrum_index":24587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 155.0459 Da; putative annotation: N/A; putative formula: C4H5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.143,"smiles":null,"spectrum_id":"CCMSLIB00017256099","spectrum_index":24588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 104.0623 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.138,"smiles":null,"spectrum_id":"CCMSLIB00017256102","spectrum_index":24589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 44.1193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.221,"smiles":null,"spectrum_id":"CCMSLIB00017256104","spectrum_index":24590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 582.3734 Da; putative annotation: N/A; putative formula: C27H54N2O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.46,"smiles":null,"spectrum_id":"CCMSLIB00017256106","spectrum_index":24591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 373.2478 Da; putative annotation: N/A; putative formula: C20H31N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.318,"smiles":null,"spectrum_id":"CCMSLIB00017256109","spectrum_index":24592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 168.0494 Da; putative annotation: N/A; putative formula: C2H8N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.188,"smiles":null,"spectrum_id":"CCMSLIB00017256111","spectrum_index":24593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 224.07 Da; putative annotation: N/A; putative formula: C12H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.13,"smiles":null,"spectrum_id":"CCMSLIB00017256114","spectrum_index":24594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 46.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017256116","spectrum_index":24595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 218.1653 Da; putative annotation: N/A; putative formula: C9H23N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.236,"smiles":null,"spectrum_id":"CCMSLIB00017256119","spectrum_index":24596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine 4-.beta.-D-glucuronide (delta mass: 18.0717 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.19,"smiles":null,"spectrum_id":"CCMSLIB00017256121","spectrum_index":24597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-(2-fluorophenoxy)ethanamine (delta mass: 46.0044 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.133,"smiles":null,"spectrum_id":"CCMSLIB00017256124","spectrum_index":24598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 191.0331 Da; putative annotation: N/A; putative formula: C8H5N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.104,"smiles":null,"spectrum_id":"CCMSLIB00017256125","spectrum_index":24599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-.alpha.-Tocopherol succinate (delta mass: 82.0523 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.457,"smiles":null,"spectrum_id":"CCMSLIB00017256128","spectrum_index":24600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-methoxybenzyl)ethanamine (delta mass: 76.035 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.18,"smiles":null,"spectrum_id":"CCMSLIB00017256131","spectrum_index":24601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE0; CorrDec (delta mass: 407.2424 Da; putative annotation: N/A; putative formula: C21H33N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.318,"smiles":null,"spectrum_id":"CCMSLIB00017256132","spectrum_index":24602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3S)-3-Hydroxyquinidine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.197,"smiles":null,"spectrum_id":"CCMSLIB00017256135","spectrum_index":24603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 78.0509 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.13,"smiles":null,"spectrum_id":"CCMSLIB00017256138","spectrum_index":24604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 135.0178 Da; putative annotation: N/A; putative formula: C4H9NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.068,"smiles":null,"spectrum_id":"CCMSLIB00017256139","spectrum_index":24605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 214.7046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.775,"smiles":null,"spectrum_id":"CCMSLIB00017256142","spectrum_index":24606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 168.0777 Da; putative annotation: N/A; putative formula: C9H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.18,"smiles":null,"spectrum_id":"CCMSLIB00017256145","spectrum_index":24607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 363.1894 Da; putative annotation: N/A; putative formula: C16H29NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.26,"smiles":null,"spectrum_id":"CCMSLIB00017256146","spectrum_index":24608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 158.1052 Da; putative annotation: N/A; putative formula: C7H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.171,"smiles":null,"spectrum_id":"CCMSLIB00017256149","spectrum_index":24609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 55.0786 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.191,"smiles":null,"spectrum_id":"CCMSLIB00017256150","spectrum_index":24610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 206.1195 Da; putative annotation: N/A; putative formula: C7H18N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.259,"smiles":null,"spectrum_id":"CCMSLIB00017256153","spectrum_index":24611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML01812 3,4-Dihydroxy-L-phenylalanine (delta mass: 54.9272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.003,"smiles":null,"spectrum_id":"CCMSLIB00017256156","spectrum_index":24612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methylquinolin-2(1H)-one (delta mass: 153.0639 Da; putative annotation: N/A; putative formula: C5H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.14,"smiles":null,"spectrum_id":"CCMSLIB00017256157","spectrum_index":24613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 503.1668 Da; putative annotation: N/A; putative formula: C20H30N3O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.248,"smiles":null,"spectrum_id":"CCMSLIB00017256160","spectrum_index":24614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 420.3378 Da; putative annotation: N/A; putative formula: C24H45N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.461,"smiles":null,"spectrum_id":"CCMSLIB00017256163","spectrum_index":24615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 522.181 Da; putative annotation: N/A; putative formula: C25H22N12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.222,"smiles":null,"spectrum_id":"CCMSLIB00017256164","spectrum_index":24616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 96.0292 Da; putative annotation: N/A; putative formula: N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.1,"smiles":null,"spectrum_id":"CCMSLIB00017256167","spectrum_index":24617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 182.9408 Da; putative annotation: N/A; putative formula: CHN3O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.038,"smiles":null,"spectrum_id":"CCMSLIB00017256169","spectrum_index":24618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 90.0766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.164,"smiles":null,"spectrum_id":"CCMSLIB00017256171","spectrum_index":24619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 43.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.131,"smiles":null,"spectrum_id":"CCMSLIB00017256174","spectrum_index":24620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 714.3832 Da; putative annotation: N/A; putative formula: C50H46N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.454,"smiles":null,"spectrum_id":"CCMSLIB00017256177","spectrum_index":24621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 372.266 Da; putative annotation: N/A; putative formula: C24H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.331,"smiles":null,"spectrum_id":"CCMSLIB00017256178","spectrum_index":24622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 121.0526 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017256181","spectrum_index":24623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 119.0457 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.117,"smiles":null,"spectrum_id":"CCMSLIB00017256184","spectrum_index":24624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 132.0516 Da; putative annotation: N/A; putative formula: C6H13O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.123,"smiles":null,"spectrum_id":"CCMSLIB00017256185","spectrum_index":24625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 144.0899 Da; putative annotation: N/A; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.135,"smiles":null,"spectrum_id":"CCMSLIB00017256188","spectrum_index":24626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.123,"smiles":null,"spectrum_id":"CCMSLIB00017256190","spectrum_index":24627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 54.8904 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.998,"smiles":null,"spectrum_id":"CCMSLIB00017256192","spectrum_index":24628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 25.0201 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.111,"smiles":null,"spectrum_id":"CCMSLIB00017256195","spectrum_index":24629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitol-6-phosphate (delta mass: 36.0089 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.061,"smiles":null,"spectrum_id":"CCMSLIB00017256196","spectrum_index":24630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 14.03 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.21,"smiles":null,"spectrum_id":"CCMSLIB00017256199","spectrum_index":24631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 284.2139 Da; putative annotation: N/A; putative formula: C20H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.267,"smiles":null,"spectrum_id":"CCMSLIB00017256202","spectrum_index":24632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 292.2581 Da; putative annotation: N/A; putative formula: C20H36O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.329,"smiles":null,"spectrum_id":"CCMSLIB00017256203","spectrum_index":24633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 110.0183 Da; putative annotation: N/A; putative formula: C6H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.067,"smiles":null,"spectrum_id":"CCMSLIB00017256206","spectrum_index":24634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-homoectoine (delta mass: 74.0409 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017256208","spectrum_index":24635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Corypalmine (delta mass: 422.33 Da; putative annotation: N/A; putative formula: C28H42N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.5,"smiles":null,"spectrum_id":"CCMSLIB00017256210","spectrum_index":24636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 72.0312 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.221,"smiles":null,"spectrum_id":"CCMSLIB00017256213","spectrum_index":24637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 106.0672 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.206,"smiles":null,"spectrum_id":"CCMSLIB00017256216","spectrum_index":24638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 265.1321 Da; putative annotation: N/A; putative formula: C15H23NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.203,"smiles":null,"spectrum_id":"CCMSLIB00017256217","spectrum_index":24639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentianose (delta mass: 184.0351 Da; putative annotation: N/A; putative formula: C12H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.211,"smiles":null,"spectrum_id":"CCMSLIB00017256220","spectrum_index":24640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 157.975 Da; putative annotation: N/A; putative formula: CH-1N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.077,"smiles":null,"spectrum_id":"CCMSLIB00017256222","spectrum_index":24641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Tyr (delta mass: 94.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.197,"smiles":null,"spectrum_id":"CCMSLIB00017256225","spectrum_index":24642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 186.0227 Da; putative annotation: N/A; putative formula: C5H8N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.104,"smiles":null,"spectrum_id":"CCMSLIB00017256227","spectrum_index":24643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 17.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.202,"smiles":null,"spectrum_id":"CCMSLIB00017256230","spectrum_index":24644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 28.9879 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017256232","spectrum_index":24645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(4-Chlorophenyl)-5-nitro-2-piperidinone (delta mass: 256.0416 Da; putative annotation: N/A; putative formula: C14H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.095,"smiles":null,"spectrum_id":"CCMSLIB00017256235","spectrum_index":24646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 204.0909 Da; putative annotation: N/A; putative formula: C9H17O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.225,"smiles":null,"spectrum_id":"CCMSLIB00017256237","spectrum_index":24647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 17.0347 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.089,"smiles":null,"spectrum_id":"CCMSLIB00017256240","spectrum_index":24648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 181.2009 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.266,"smiles":null,"spectrum_id":"CCMSLIB00017256243","spectrum_index":24649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 785.3404 Da; putative annotation: N/A; putative formula: C36H55N3O14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":940.411,"smiles":null,"spectrum_id":"CCMSLIB00017256245","spectrum_index":24650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 109.0405 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.142,"smiles":null,"spectrum_id":"CCMSLIB00017256247","spectrum_index":24651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 273.1348 Da; putative annotation: N/A; putative formula: C10H20N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.233,"smiles":null,"spectrum_id":"CCMSLIB00017256250","spectrum_index":24652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 213.0717 Da; putative annotation: N/A; putative formula: C4H7N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.225,"smiles":null,"spectrum_id":"CCMSLIB00017256253","spectrum_index":24653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 782.4735 Da; putative annotation: N/A; putative formula: C42H71O11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.57,"smiles":null,"spectrum_id":"CCMSLIB00017256254","spectrum_index":24654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 222.1613 Da; putative annotation: N/A; putative formula: C14H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.226,"smiles":null,"spectrum_id":"CCMSLIB00017256257","spectrum_index":24655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 15.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.091,"smiles":null,"spectrum_id":"CCMSLIB00017256258","spectrum_index":24656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 101.0259 Da; putative annotation: N/A; putative formula: CH4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.091,"smiles":null,"spectrum_id":"CCMSLIB00017256261","spectrum_index":24657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 160.0192 Da; putative annotation: N/A; putative formula: C8H5N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.142,"smiles":null,"spectrum_id":"CCMSLIB00017256264","spectrum_index":24658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 463.3501 Da; putative annotation: N/A; putative formula: C28H51NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.41,"smiles":null,"spectrum_id":"CCMSLIB00017256265","spectrum_index":24659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 671.5037 Da; putative annotation: N/A; putative formula: C44H61N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.575,"smiles":null,"spectrum_id":"CCMSLIB00017256268","spectrum_index":24660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 61.9443 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.031,"smiles":null,"spectrum_id":"CCMSLIB00017256271","spectrum_index":24661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 63.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.165,"smiles":null,"spectrum_id":"CCMSLIB00017256274","spectrum_index":24662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 131.1045 Da; putative annotation: N/A; putative formula: CH9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.196,"smiles":null,"spectrum_id":"CCMSLIB00017256276","spectrum_index":24663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 149.0471 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.086,"smiles":null,"spectrum_id":"CCMSLIB00017256278","spectrum_index":24664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 51.0472 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.144,"smiles":null,"spectrum_id":"CCMSLIB00017256281","spectrum_index":24665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 110.0576 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017256284","spectrum_index":24666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 41.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017256286","spectrum_index":24667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 31.0426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.123,"smiles":null,"spectrum_id":"CCMSLIB00017256289","spectrum_index":24668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 49.122 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.224,"smiles":null,"spectrum_id":"CCMSLIB00017256291","spectrum_index":24669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 39.0513 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.185,"smiles":null,"spectrum_id":"CCMSLIB00017256294","spectrum_index":24670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017256295","spectrum_index":24671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-tetrahydro-6-methoxy-1-oxo-beta-carboline (delta mass: 42.018 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.115,"smiles":null,"spectrum_id":"CCMSLIB00017256298","spectrum_index":24672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 318.2555 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.326,"smiles":null,"spectrum_id":"CCMSLIB00017256300","spectrum_index":24673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 41.0264 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.097,"smiles":null,"spectrum_id":"CCMSLIB00017256302","spectrum_index":24674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 45.0293 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.105,"smiles":null,"spectrum_id":"CCMSLIB00017256305","spectrum_index":24675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 70.0325 Da; putative annotation: N/A; putative formula: C4H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.147,"smiles":null,"spectrum_id":"CCMSLIB00017256308","spectrum_index":24676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 126.1043 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017256310","spectrum_index":24677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 131.0585 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017256312","spectrum_index":24678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 304.1681 Da; putative annotation: N/A; putative formula: C19H28O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.317,"smiles":null,"spectrum_id":"CCMSLIB00017256315","spectrum_index":24679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 506.3402 Da; putative annotation: N/A; putative formula: C25H52N2O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.4,"smiles":null,"spectrum_id":"CCMSLIB00017256317","spectrum_index":24680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-Deoxyguanosine 5'-monophosphate (delta mass: 327.0366 Da; putative annotation: N/A; putative formula: C10H10N5O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.107,"smiles":null,"spectrum_id":"CCMSLIB00017256319","spectrum_index":24681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 194.1252 Da; putative annotation: N/A; putative formula: C11H18N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.321,"smiles":null,"spectrum_id":"CCMSLIB00017256321","spectrum_index":24682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 294.353 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.487,"smiles":null,"spectrum_id":"CCMSLIB00017256324","spectrum_index":24683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.092,"smiles":null,"spectrum_id":"CCMSLIB00017256325","spectrum_index":24684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-6-ol, 1-(4-methoxyphenyl)-2-methyl-3-nitro- (delta mass: 237.062 Da; putative annotation: N/A; putative formula: C8H3N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.165,"smiles":null,"spectrum_id":"CCMSLIB00017256328","spectrum_index":24685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydro-6-hydroxy-.alpha.,2,5,7,8-pentamethyl-2H-1-benzopyran-2-pentanoic acid (delta mass: 391.199 Da; putative annotation: N/A; putative formula: C21H29NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.405,"smiles":null,"spectrum_id":"CCMSLIB00017256331","spectrum_index":24686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 454.4506 Da; putative annotation: N/A; putative formula: C28H58N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.521,"smiles":null,"spectrum_id":"CCMSLIB00017256333","spectrum_index":24687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 17.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.133,"smiles":null,"spectrum_id":"CCMSLIB00017256335","spectrum_index":24688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 58.0432 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.245,"smiles":null,"spectrum_id":"CCMSLIB00017256337","spectrum_index":24689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 253.0475 Da; putative annotation: N/A; putative formula: C7H8N7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.103,"smiles":null,"spectrum_id":"CCMSLIB00017256340","spectrum_index":24690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 131.0956 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.176,"smiles":null,"spectrum_id":"CCMSLIB00017256342","spectrum_index":24691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 127.0875 Da; putative annotation: N/A; putative formula: C4H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.154,"smiles":null,"spectrum_id":"CCMSLIB00017256344","spectrum_index":24692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 110.037 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.086,"smiles":null,"spectrum_id":"CCMSLIB00017256347","spectrum_index":24693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 200.1516 Da; putative annotation: N/A; putative formula: C10H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.27,"smiles":null,"spectrum_id":"CCMSLIB00017256348","spectrum_index":24694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 621.3258 Da; putative annotation: N/A; putative formula: C44H39N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.423,"smiles":null,"spectrum_id":"CCMSLIB00017256351","spectrum_index":24695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 144.0049 Da; putative annotation: N/A; putative formula: C5H4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.07,"smiles":null,"spectrum_id":"CCMSLIB00017256353","spectrum_index":24696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 141.9253 Da; putative annotation: N/A; putative formula: O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.049,"smiles":null,"spectrum_id":"CCMSLIB00017256355","spectrum_index":24697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 318.1787 Da; putative annotation: N/A; putative formula: C16H31O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.27,"smiles":null,"spectrum_id":"CCMSLIB00017256357","spectrum_index":24698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 253.346 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.5,"smiles":null,"spectrum_id":"CCMSLIB00017256360","spectrum_index":24699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Emetine N-oxide (delta mass: 43.0042 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.305,"smiles":null,"spectrum_id":"CCMSLIB00017256362","spectrum_index":24700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 76.016 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017256364","spectrum_index":24701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole (delta mass: 45.0482 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.117,"smiles":null,"spectrum_id":"CCMSLIB00017256367","spectrum_index":24702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 76.0541 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.156,"smiles":null,"spectrum_id":"CCMSLIB00017256369","spectrum_index":24703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 27.0467 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.144,"smiles":null,"spectrum_id":"CCMSLIB00017256371","spectrum_index":24704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 515.1917 Da; putative annotation: N/A; putative formula: C26H25N7O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1020.37,"smiles":null,"spectrum_id":"CCMSLIB00017256374","spectrum_index":24705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 53.062 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.159,"smiles":null,"spectrum_id":"CCMSLIB00017256376","spectrum_index":24706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 588.505 Da; putative annotation: N/A; putative formula: C37H68N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.602,"smiles":null,"spectrum_id":"CCMSLIB00017256378","spectrum_index":24707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 276.061 Da; putative annotation: N/A; putative formula: C18H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.132,"smiles":null,"spectrum_id":"CCMSLIB00017256380","spectrum_index":24708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 179.0857 Da; putative annotation: N/A; putative formula: C10H14NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.203,"smiles":null,"spectrum_id":"CCMSLIB00017256383","spectrum_index":24709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.118,"smiles":null,"spectrum_id":"CCMSLIB00017256384","spectrum_index":24710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 230.0888 Da; putative annotation: N/A; putative formula: C6H6N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.175,"smiles":null,"spectrum_id":"CCMSLIB00017256387","spectrum_index":24711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:205060 (delta mass: 26.9403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.0,"smiles":null,"spectrum_id":"CCMSLIB00017256390","spectrum_index":24712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grevillic acid (delta mass: 104.0261 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.076,"smiles":null,"spectrum_id":"CCMSLIB00017256392","spectrum_index":24713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 59.071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.2,"smiles":null,"spectrum_id":"CCMSLIB00017256395","spectrum_index":24714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 11.0048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":121.065,"smiles":null,"spectrum_id":"CCMSLIB00017256397","spectrum_index":24715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 74.045 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.167,"smiles":null,"spectrum_id":"CCMSLIB00017256400","spectrum_index":24716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 22.0509 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.1,"smiles":null,"spectrum_id":"CCMSLIB00017256403","spectrum_index":24717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 817.907 Da; putative annotation: N/A; putative formula: C41H22O-1S10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1040.0,"smiles":null,"spectrum_id":"CCMSLIB00017256406","spectrum_index":24718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 617.3409 Da; putative annotation: N/A; putative formula: C30H51NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.401,"smiles":null,"spectrum_id":"CCMSLIB00017256408","spectrum_index":24719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylchromone-2-carboxylic acid (delta mass: 120.0576 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.107,"smiles":null,"spectrum_id":"CCMSLIB00017256410","spectrum_index":24720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 393.2742 Da; putative annotation: N/A; putative formula: C20H35N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.36,"smiles":null,"spectrum_id":"CCMSLIB00017256413","spectrum_index":24721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 172.0668 Da; putative annotation: N/A; putative formula: C10H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.122,"smiles":null,"spectrum_id":"CCMSLIB00017256416","spectrum_index":24722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 604.1424 Da; putative annotation: N/A; putative formula: C26H24N10O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":767.203,"smiles":null,"spectrum_id":"CCMSLIB00017256417","spectrum_index":24723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Keto-L-gulonic acid (delta mass: 117.0619 Da; putative annotation: N/A; putative formula: C5H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.112,"smiles":null,"spectrum_id":"CCMSLIB00017256420","spectrum_index":24724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 387.2474 Da; putative annotation: N/A; putative formula: C27H34NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.302,"smiles":null,"spectrum_id":"CCMSLIB00017256422","spectrum_index":24725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 145.5987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.67,"smiles":null,"spectrum_id":"CCMSLIB00017256424","spectrum_index":24726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 438.2074 Da; putative annotation: N/A; putative formula: C15H30N6O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.383,"smiles":null,"spectrum_id":"CCMSLIB00017256426","spectrum_index":24727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 242.1268 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.266,"smiles":null,"spectrum_id":"CCMSLIB00017256428","spectrum_index":24728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decoyinine (delta mass: 9.9866 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.091,"smiles":null,"spectrum_id":"CCMSLIB00017256431","spectrum_index":24729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 316.2081 Da; putative annotation: N/A; putative formula: C17H34OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.268,"smiles":null,"spectrum_id":"CCMSLIB00017256433","spectrum_index":24730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-tetrahydro-6-methoxy-1-oxo-beta-carboline (delta mass: 71.0364 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.134,"smiles":null,"spectrum_id":"CCMSLIB00017256435","spectrum_index":24731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 59.1316 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.19,"smiles":null,"spectrum_id":"CCMSLIB00017256438","spectrum_index":24732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 18.9944 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.07,"smiles":null,"spectrum_id":"CCMSLIB00017256440","spectrum_index":24733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 600.4031 Da; putative annotation: N/A; putative formula: C29H56N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.463,"smiles":null,"spectrum_id":"CCMSLIB00017256444","spectrum_index":24734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 145.0744 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.182,"smiles":null,"spectrum_id":"CCMSLIB00017256446","spectrum_index":24735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 162.5839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.644,"smiles":null,"spectrum_id":"CCMSLIB00017256449","spectrum_index":24736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-5-(1H-pyrrol-2-yl)-1,3-dihydro-1,4-benzodiazepin-2-one (delta mass: 68.0592 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.118,"smiles":null,"spectrum_id":"CCMSLIB00017256451","spectrum_index":24737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine (delta mass: 135.0302 Da; putative annotation: N/A; putative formula: C3HN7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.134,"smiles":null,"spectrum_id":"CCMSLIB00017256454","spectrum_index":24738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 166.0774 Da; putative annotation: N/A; putative formula: C7H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.158,"smiles":null,"spectrum_id":"CCMSLIB00017256456","spectrum_index":24739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 86.0447 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.194,"smiles":null,"spectrum_id":"CCMSLIB00017256459","spectrum_index":24740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 118.0418 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017256461","spectrum_index":24741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 285.1455 Da; putative annotation: N/A; putative formula: C12H15N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.216,"smiles":null,"spectrum_id":"CCMSLIB00017256464","spectrum_index":24742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 180.2473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.349,"smiles":null,"spectrum_id":"CCMSLIB00017256465","spectrum_index":24743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 72.0345 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.126,"smiles":null,"spectrum_id":"CCMSLIB00017256468","spectrum_index":24744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00015088-09_C12H14N2O_N-[2-(1H-Indol-3-yl)ethyl]acetamide (delta mass: 202.1141 Da; putative annotation: N/A; putative formula: C9H18N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.232,"smiles":null,"spectrum_id":"CCMSLIB00017256471","spectrum_index":24745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 52.0684 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.311,"smiles":null,"spectrum_id":"CCMSLIB00017256473","spectrum_index":24746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 194.293 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.341,"smiles":null,"spectrum_id":"CCMSLIB00017256475","spectrum_index":24747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 56.0481 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.128,"smiles":null,"spectrum_id":"CCMSLIB00017256478","spectrum_index":24748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 117.0253 Da; putative annotation: N/A; putative formula: C4H7NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.066,"smiles":null,"spectrum_id":"CCMSLIB00017256480","spectrum_index":24749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 140.0608 Da; putative annotation: N/A; putative formula: C6H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.137,"smiles":null,"spectrum_id":"CCMSLIB00017256482","spectrum_index":24750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE10; CorrDec (delta mass: 87.0326 Da; putative annotation: L-Serine; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.093,"smiles":null,"spectrum_id":"CCMSLIB00017256485","spectrum_index":24751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 126.1044 Da; putative annotation: 2-Ethyl-2-methylpentanoic acid; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.238,"smiles":null,"spectrum_id":"CCMSLIB00017256488","spectrum_index":24752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 112.0524 Da; putative annotation: (4E)-3-Hydroxyhex-4-enoic acid; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017256491","spectrum_index":24753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 97.0537 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.23,"smiles":null,"spectrum_id":"CCMSLIB00017256492","spectrum_index":24754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 294.1541 Da; putative annotation: 6-(Hydroxymethyl)exemestane; putative formula: C20H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.229,"smiles":null,"spectrum_id":"CCMSLIB00017256495","spectrum_index":24755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 170.0947 Da; putative annotation: Spectral Match to Azelaic acid from NIST14; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.16,"smiles":null,"spectrum_id":"CCMSLIB00017256497","spectrum_index":24756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 406.1867 Da; putative annotation: Phe-Cys-Arg; putative formula: C18H26N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.278,"smiles":null,"spectrum_id":"CCMSLIB00017256499","spectrum_index":24757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 152.0832 Da; putative annotation: 3-(2-Oxocyclohexyl)propanoic acid; putative formula: C9H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.148,"smiles":null,"spectrum_id":"CCMSLIB00017256502","spectrum_index":24758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Norepinephrine from NIST14 (delta mass: 119.0487 Da; putative annotation: 3-Pyridylamidoxime; putative formula: C6H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.13,"smiles":null,"spectrum_id":"CCMSLIB00017256505","spectrum_index":24759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 179.0947 Da; putative annotation: Tenuazonic acid; putative formula: C10H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.165,"smiles":null,"spectrum_id":"CCMSLIB00017256508","spectrum_index":24760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 368.1838 Da; putative annotation: NCGC00380268-01_C19H30O8_2-Cyclohexen-1-one, 4-[(1E)-3-(beta-D-glucopyranosyloxy)-4-hydroxy-1-buten-1-yl]-3,5,5-trimethyl-, (4R)-; putative formula: C19H28O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.244,"smiles":null,"spectrum_id":"CCMSLIB00017256511","spectrum_index":24761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Cyclohexyl-1-propanol (delta mass: 270.1615 Da; putative annotation: N/A; putative formula: C12H23N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017256512","spectrum_index":24762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 135.1073 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.178,"smiles":null,"spectrum_id":"CCMSLIB00017256515","spectrum_index":24763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 126.0491 Da; putative annotation: N/A; putative formula: C7H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.172,"smiles":null,"spectrum_id":"CCMSLIB00017256518","spectrum_index":24764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 88.089 Da; putative annotation: N/A; putative formula: CH8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.191,"smiles":null,"spectrum_id":"CCMSLIB00017256519","spectrum_index":24765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 60.0239 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.128,"smiles":null,"spectrum_id":"CCMSLIB00017256522","spectrum_index":24766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid (delta mass: 28.0239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.082,"smiles":null,"spectrum_id":"CCMSLIB00017256525","spectrum_index":24767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 97.0896 Da; putative annotation: N/A; putative formula: C6H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.191,"smiles":null,"spectrum_id":"CCMSLIB00017256526","spectrum_index":24768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 107.0739 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.139,"smiles":null,"spectrum_id":"CCMSLIB00017256529","spectrum_index":24769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 98.0433 Da; putative annotation: N/A; putative formula: H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.11,"smiles":null,"spectrum_id":"CCMSLIB00017256532","spectrum_index":24770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 178.0377 Da; putative annotation: N/A; putative formula: C8H6N2O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.129,"smiles":null,"spectrum_id":"CCMSLIB00017256533","spectrum_index":24771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 556.1998 Da; putative annotation: N/A; putative formula: C35H28N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.328,"smiles":null,"spectrum_id":"CCMSLIB00017256536","spectrum_index":24772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 207.1985 Da; putative annotation: N/A; putative formula: C14H25N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.29,"smiles":null,"spectrum_id":"CCMSLIB00017256538","spectrum_index":24773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-RIBOSE 5-PHOSPHATE (delta mass: 298.251 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.277,"smiles":null,"spectrum_id":"CCMSLIB00017256540","spectrum_index":24774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 459.4082 Da; putative annotation: N/A; putative formula: C30H53NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.479,"smiles":null,"spectrum_id":"CCMSLIB00017256543","spectrum_index":24775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 89.9468 Da; putative annotation: N/A; putative formula: CH-1O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.026,"smiles":null,"spectrum_id":"CCMSLIB00017256546","spectrum_index":24776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 369.2152 Da; putative annotation: N/A; putative formula: C19H31NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.286,"smiles":null,"spectrum_id":"CCMSLIB00017256548","spectrum_index":24777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 304.1886 Da; putative annotation: N/A; putative formula: C15H28O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.358,"smiles":null,"spectrum_id":"CCMSLIB00017256550","spectrum_index":24778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 111.0685 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.128,"smiles":null,"spectrum_id":"CCMSLIB00017256553","spectrum_index":24779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 60.0586 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.124,"smiles":null,"spectrum_id":"CCMSLIB00017256555","spectrum_index":24780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 180.1881 Da; putative annotation: N/A; putative formula: C13H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.269,"smiles":null,"spectrum_id":"CCMSLIB00017256557","spectrum_index":24781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 158.1161 Da; putative annotation: N/A; putative formula: C6H14N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.213,"smiles":null,"spectrum_id":"CCMSLIB00017256560","spectrum_index":24782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 111.0322 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.111,"smiles":null,"spectrum_id":"CCMSLIB00017256562","spectrum_index":24783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 156.1147 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.169,"smiles":null,"spectrum_id":"CCMSLIB00017256565","spectrum_index":24784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 42.0092 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.111,"smiles":null,"spectrum_id":"CCMSLIB00017256567","spectrum_index":24785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 316.1521 Da; putative annotation: N/A; putative formula: C15H24O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.316,"smiles":null,"spectrum_id":"CCMSLIB00017256570","spectrum_index":24786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 145.0201 Da; putative annotation: N/A; putative formula: C5H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.122,"smiles":null,"spectrum_id":"CCMSLIB00017256571","spectrum_index":24787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 47.9287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.0,"smiles":null,"spectrum_id":"CCMSLIB00017256574","spectrum_index":24788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 4.4083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017256575","spectrum_index":24789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 214.0839 Da; putative annotation: N/A; putative formula: C10H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.144,"smiles":null,"spectrum_id":"CCMSLIB00017256578","spectrum_index":24790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 27.141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.221,"smiles":null,"spectrum_id":"CCMSLIB00017256581","spectrum_index":24791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 112.0527 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017256582","spectrum_index":24792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 354.1543 Da; putative annotation: N/A; putative formula: C15H22N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.308,"smiles":null,"spectrum_id":"CCMSLIB00017256585","spectrum_index":24793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 164.0404 Da; putative annotation: N/A; putative formula: C8H8N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.08,"smiles":null,"spectrum_id":"CCMSLIB00017256588","spectrum_index":24794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 233.1417 Da; putative annotation: N/A; putative formula: C14H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.192,"smiles":null,"spectrum_id":"CCMSLIB00017256589","spectrum_index":24795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 532.161 Da; putative annotation: N/A; putative formula: C25H29N2O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.232,"smiles":null,"spectrum_id":"CCMSLIB00017256592","spectrum_index":24796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:205060\"\" (delta mass: 154.0634 Da; putative annotation: N/A; putative formula: C8H10O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.155,"smiles":null,"spectrum_id":"CCMSLIB00017256595","spectrum_index":24797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-n-benzoyl-2-hydroxy-2-phenylethylamine (delta mass: 152.0507 Da; putative annotation: N/A; putative formula: C7H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.168,"smiles":null,"spectrum_id":"CCMSLIB00017256596","spectrum_index":24798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 163.0691 Da; putative annotation: N/A; putative formula: C5H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.166,"smiles":null,"spectrum_id":"CCMSLIB00017256599","spectrum_index":24799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 129.1496 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.278,"smiles":null,"spectrum_id":"CCMSLIB00017256602","spectrum_index":24800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 100.0252 Da; putative annotation: N/A; putative formula: C3H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.127,"smiles":null,"spectrum_id":"CCMSLIB00017256605","spectrum_index":24801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 138.0694 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.148,"smiles":null,"spectrum_id":"CCMSLIB00017256606","spectrum_index":24802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 162.036 Da; putative annotation: N/A; putative formula: C6H12OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.106,"smiles":null,"spectrum_id":"CCMSLIB00017256609","spectrum_index":24803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ellipticine CollisionEnergy:205060 (delta mass: 181.0868 Da; putative annotation: N/A; putative formula: C7H12N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.21,"smiles":null,"spectrum_id":"CCMSLIB00017256611","spectrum_index":24804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 27.0119 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.088,"smiles":null,"spectrum_id":"CCMSLIB00017256613","spectrum_index":24805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 238.2307 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.342,"smiles":null,"spectrum_id":"CCMSLIB00017256616","spectrum_index":24806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 61.0167 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.067,"smiles":null,"spectrum_id":"CCMSLIB00017256618","spectrum_index":24807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 330.095 Da; putative annotation: N/A; putative formula: C14H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.166,"smiles":null,"spectrum_id":"CCMSLIB00017256621","spectrum_index":24808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 820.4091 Da; putative annotation: N/A; putative formula: C37H52N14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1001.48,"smiles":null,"spectrum_id":"CCMSLIB00017256623","spectrum_index":24809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311078 Coumaroyl putrescin (delta mass: 245.1051 Da; putative annotation: N/A; putative formula: C14H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.249,"smiles":null,"spectrum_id":"CCMSLIB00017256626","spectrum_index":24810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 1104.5336 Da; putative annotation: N/A; putative formula: C56H76N14O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1285.6,"smiles":null,"spectrum_id":"CCMSLIB00017256628","spectrum_index":24811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 97.0167 Da; putative annotation: N/A; putative formula: C4H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.092,"smiles":null,"spectrum_id":"CCMSLIB00017256631","spectrum_index":24812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 193.0607 Da; putative annotation: N/A; putative formula: C7H7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.132,"smiles":null,"spectrum_id":"CCMSLIB00017256633","spectrum_index":24813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 147.056 Da; putative annotation: N/A; putative formula: C4H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.153,"smiles":null,"spectrum_id":"CCMSLIB00017256636","spectrum_index":24814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 138.0433 Da; putative annotation: N/A; putative formula: C6H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.124,"smiles":null,"spectrum_id":"CCMSLIB00017256638","spectrum_index":24815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 50.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017256640","spectrum_index":24816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 179.0792 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.15,"smiles":null,"spectrum_id":"CCMSLIB00017256643","spectrum_index":24817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 188.1787 Da; putative annotation: N/A; putative formula: C7H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.249,"smiles":null,"spectrum_id":"CCMSLIB00017256645","spectrum_index":24818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 270.3456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":863.621,"smiles":null,"spectrum_id":"CCMSLIB00017256648","spectrum_index":24819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 733.4618 Da; putative annotation: N/A; putative formula: C43H59N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.537,"smiles":null,"spectrum_id":"CCMSLIB00017256650","spectrum_index":24820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 728.7484 Da; putative annotation: N/A; putative formula: C45H92N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1395.98,"smiles":null,"spectrum_id":"CCMSLIB00017256653","spectrum_index":24821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhistamine (delta mass: 55.042 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.145,"smiles":null,"spectrum_id":"CCMSLIB00017256656","spectrum_index":24822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxobenzo[cd]indol-1(2H)-yl)acetic acid (delta mass: 90.066 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.132,"smiles":null,"spectrum_id":"CCMSLIB00017256657","spectrum_index":24823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-Isopropoxy-5-(trifluoromethyl)phenyl]amine (delta mass: 16.0714 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.166,"smiles":null,"spectrum_id":"CCMSLIB00017256660","spectrum_index":24824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 208.1246 Da; putative annotation: N/A; putative formula: C10H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.2,"smiles":null,"spectrum_id":"CCMSLIB00017256663","spectrum_index":24825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1065.5372 Da; putative annotation: N/A; putative formula: C65H67N11O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1228.6,"smiles":null,"spectrum_id":"CCMSLIB00017256665","spectrum_index":24826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 109.0783 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.217,"smiles":null,"spectrum_id":"CCMSLIB00017256667","spectrum_index":24827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 121.0182 Da; putative annotation: N/A; putative formula: C5H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.13,"smiles":null,"spectrum_id":"CCMSLIB00017256670","spectrum_index":24828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 230.0998 Da; putative annotation: N/A; putative formula: C10H19N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.139,"smiles":null,"spectrum_id":"CCMSLIB00017256673","spectrum_index":24829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 44.0261 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.123,"smiles":null,"spectrum_id":"CCMSLIB00017256676","spectrum_index":24830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 124.037 Da; putative annotation: N/A; putative formula: N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.076,"smiles":null,"spectrum_id":"CCMSLIB00017256679","spectrum_index":24831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 165.0797 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.16,"smiles":null,"spectrum_id":"CCMSLIB00017256682","spectrum_index":24832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 165.0789 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.145,"smiles":null,"spectrum_id":"CCMSLIB00017256685","spectrum_index":24833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 737.3472 Da; putative annotation: N/A; putative formula: C39H47N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.407,"smiles":null,"spectrum_id":"CCMSLIB00017256686","spectrum_index":24834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 142.078 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017256689","spectrum_index":24835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 52.0208 Da; putative annotation: N/A; putative formula: CN4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.071,"smiles":null,"spectrum_id":"CCMSLIB00017256692","spectrum_index":24836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 51.0397 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.106,"smiles":null,"spectrum_id":"CCMSLIB00017256695","spectrum_index":24837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000737174-01! (delta mass: 46.0061 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.077,"smiles":null,"spectrum_id":"CCMSLIB00017256696","spectrum_index":24838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 55.0856 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.136,"smiles":null,"spectrum_id":"CCMSLIB00017256699","spectrum_index":24839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE\"\" (delta mass: 359.2841 Da; putative annotation: N/A; putative formula: C22H38N3O-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.386,"smiles":null,"spectrum_id":"CCMSLIB00017256702","spectrum_index":24840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.18,"smiles":null,"spectrum_id":"CCMSLIB00017256705","spectrum_index":24841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 458.2547 Da; putative annotation: N/A; putative formula: C22H39N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.388,"smiles":null,"spectrum_id":"CCMSLIB00017256706","spectrum_index":24842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 137.0237 Da; putative annotation: N/A; putative formula: C3H8NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.292,"smiles":null,"spectrum_id":"CCMSLIB00017256709","spectrum_index":24843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminobenzoic acid (delta mass: 57.0214 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.076,"smiles":null,"spectrum_id":"CCMSLIB00017256712","spectrum_index":24844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101905 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 70.0417 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.128,"smiles":null,"spectrum_id":"CCMSLIB00017256714","spectrum_index":24845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 90.0471 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.154,"smiles":null,"spectrum_id":"CCMSLIB00017256716","spectrum_index":24846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 16.0305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.127,"smiles":null,"spectrum_id":"CCMSLIB00017256719","spectrum_index":24847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 200.1199 Da; putative annotation: N/A; putative formula: C14H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017256722","spectrum_index":24848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gelsemine (delta mass: 132.042 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.217,"smiles":null,"spectrum_id":"CCMSLIB00017256724","spectrum_index":24849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 66.0464 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.273,"smiles":null,"spectrum_id":"CCMSLIB00017256726","spectrum_index":24850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Allylamino)benzoic acid (delta mass: 107.0736 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.16,"smiles":null,"spectrum_id":"CCMSLIB00017256729","spectrum_index":24851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 63.13 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.17,"smiles":null,"spectrum_id":"CCMSLIB00017256732","spectrum_index":24852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 274.2178 Da; putative annotation: N/A; putative formula: C14H31N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.357,"smiles":null,"spectrum_id":"CCMSLIB00017256734","spectrum_index":24853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.058,"smiles":null,"spectrum_id":"CCMSLIB00017256737","spectrum_index":24854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 31.9226 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.962,"smiles":null,"spectrum_id":"CCMSLIB00017256739","spectrum_index":24855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 166.053 Da; putative annotation: N/A; putative formula: C11H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.171,"smiles":null,"spectrum_id":"CCMSLIB00017256742","spectrum_index":24856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023102 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 482.3025 Da; putative annotation: N/A; putative formula: C22H46N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.479,"smiles":null,"spectrum_id":"CCMSLIB00017256744","spectrum_index":24857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 50.0 eV (delta mass: 155.0472 Da; putative annotation: N/A; putative formula: C9H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017256747","spectrum_index":24858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-O-Methylvisamminol (delta mass: 46.0349 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.158,"smiles":null,"spectrum_id":"CCMSLIB00017256750","spectrum_index":24859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 427.1954 Da; putative annotation: N/A; putative formula: C19H29N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.318,"smiles":null,"spectrum_id":"CCMSLIB00017256752","spectrum_index":24860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norboldine (delta mass: 71.0797 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.218,"smiles":null,"spectrum_id":"CCMSLIB00017256754","spectrum_index":24861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 17.1207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.28,"smiles":null,"spectrum_id":"CCMSLIB00017256757","spectrum_index":24862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM823401 N-Butylbenzenesulfonamide (delta mass: 40.1218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.211,"smiles":null,"spectrum_id":"CCMSLIB00017256759","spectrum_index":24863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM823401 N-Butylbenzenesulfonamide (delta mass: 41.1533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.243,"smiles":null,"spectrum_id":"CCMSLIB00017256762","spectrum_index":24864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 162.0682 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.233,"smiles":null,"spectrum_id":"CCMSLIB00017256764","spectrum_index":24865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017256767","spectrum_index":24866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 216.166 Da; putative annotation: N/A; putative formula: C11H24N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.262,"smiles":null,"spectrum_id":"CCMSLIB00017256770","spectrum_index":24867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 42.0832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.18,"smiles":null,"spectrum_id":"CCMSLIB00017256772","spectrum_index":24868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 304.1156 Da; putative annotation: N/A; putative formula: C13H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.265,"smiles":null,"spectrum_id":"CCMSLIB00017256775","spectrum_index":24869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 731.4608 Da; putative annotation: N/A; putative formula: C41H65NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.531,"smiles":null,"spectrum_id":"CCMSLIB00017256778","spectrum_index":24870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 180.1113 Da; putative annotation: N/A; putative formula: C7H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.307,"smiles":null,"spectrum_id":"CCMSLIB00017256780","spectrum_index":24871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 71.0371 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.108,"smiles":null,"spectrum_id":"CCMSLIB00017256782","spectrum_index":24872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-formyl-1H-indole-2-carboxylate (delta mass: 88.051 Da; putative annotation: N/A; putative formula: H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.132,"smiles":null,"spectrum_id":"CCMSLIB00017256785","spectrum_index":24873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 17.9277 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.003,"smiles":null,"spectrum_id":"CCMSLIB00017256788","spectrum_index":24874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 124.1253 Da; putative annotation: N/A; putative formula: C9H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.206,"smiles":null,"spectrum_id":"CCMSLIB00017256789","spectrum_index":24875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 176.096 Da; putative annotation: N/A; putative formula: C8H17O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.188,"smiles":null,"spectrum_id":"CCMSLIB00017256792","spectrum_index":24876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydro-6-hydroxy-.alpha.,2,5,7,8-pentamethyl-2H-1-benzopyran-2-pentanoic acid (delta mass: 393.2138 Da; putative annotation: N/A; putative formula: C18H23N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.42,"smiles":null,"spectrum_id":"CCMSLIB00017256795","spectrum_index":24877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 222.1262 Da; putative annotation: N/A; putative formula: C13H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.238,"smiles":null,"spectrum_id":"CCMSLIB00017256797","spectrum_index":24878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 132.0594 Da; putative annotation: N/A; putative formula: C2H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.119,"smiles":null,"spectrum_id":"CCMSLIB00017256799","spectrum_index":24879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 121.0523 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.123,"smiles":null,"spectrum_id":"CCMSLIB00017256802","spectrum_index":24880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 406.1482 Da; putative annotation: N/A; putative formula: C20H27N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.24,"smiles":null,"spectrum_id":"CCMSLIB00017256805","spectrum_index":24881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 113.0854 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.14,"smiles":null,"spectrum_id":"CCMSLIB00017256807","spectrum_index":24882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 95.0372 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017256810","spectrum_index":24883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 225.1003 Da; putative annotation: N/A; putative formula: C11H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.187,"smiles":null,"spectrum_id":"CCMSLIB00017256812","spectrum_index":24884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 43.2005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.173,"smiles":null,"spectrum_id":"CCMSLIB00017256815","spectrum_index":24885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-O-((2Z)-3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoyl)-.beta.-D-fructofuranosyl 6-O-acetyl-.alpha.-D-glucopyranoside (delta mass: 158.0356 Da; putative annotation: N/A; putative formula: C4H7N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.217,"smiles":null,"spectrum_id":"CCMSLIB00017256817","spectrum_index":24886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 445.1848 Da; putative annotation: N/A; putative formula: C22H27N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.334,"smiles":null,"spectrum_id":"CCMSLIB00017256820","spectrum_index":24887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 207.0889 Da; putative annotation: N/A; putative formula: C11H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.128,"smiles":null,"spectrum_id":"CCMSLIB00017256823","spectrum_index":24888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 151.0629 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.134,"smiles":null,"spectrum_id":"CCMSLIB00017256824","spectrum_index":24889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 181.0725 Da; putative annotation: N/A; putative formula: C5H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.205,"smiles":null,"spectrum_id":"CCMSLIB00017256827","spectrum_index":24890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301020 Aristolochic acid B (delta mass: 46.0053 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.056,"smiles":null,"spectrum_id":"CCMSLIB00017256830","spectrum_index":24891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 143.0585 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.129,"smiles":null,"spectrum_id":"CCMSLIB00017256831","spectrum_index":24892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 186.1741 Da; putative annotation: N/A; putative formula: C10H22N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.233,"smiles":null,"spectrum_id":"CCMSLIB00017256834","spectrum_index":24893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 82.0184 Da; putative annotation: N/A; putative formula: C3H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.105,"smiles":null,"spectrum_id":"CCMSLIB00017256837","spectrum_index":24894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-cysteine (delta mass: 71.0451 Da; putative annotation: N/A; putative formula: C2H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.083,"smiles":null,"spectrum_id":"CCMSLIB00017256840","spectrum_index":24895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 516.3003 Da; putative annotation: N/A; putative formula: C30H45O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.449,"smiles":null,"spectrum_id":"CCMSLIB00017256842","spectrum_index":24896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 164.1516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.264,"smiles":null,"spectrum_id":"CCMSLIB00017256844","spectrum_index":24897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 170.167 Da; putative annotation: N/A; putative formula: C11H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.248,"smiles":null,"spectrum_id":"CCMSLIB00017256847","spectrum_index":24898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 247.0692 Da; putative annotation: N/A; putative formula: C9H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.202,"smiles":null,"spectrum_id":"CCMSLIB00017256849","spectrum_index":24899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 15.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.107,"smiles":null,"spectrum_id":"CCMSLIB00017256851","spectrum_index":24900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 186.0823 Da; putative annotation: N/A; putative formula: C8H14N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.179,"smiles":null,"spectrum_id":"CCMSLIB00017256854","spectrum_index":24901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 445.1603 Da; putative annotation: N/A; putative formula: C21H35NOS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.231,"smiles":null,"spectrum_id":"CCMSLIB00017256857","spectrum_index":24902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C5:0 (delta mass: 84.0573 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.222,"smiles":null,"spectrum_id":"CCMSLIB00017256859","spectrum_index":24903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 192.1373 Da; putative annotation: N/A; putative formula: C10H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.239,"smiles":null,"spectrum_id":"CCMSLIB00017256861","spectrum_index":24904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 110.0365 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.096,"smiles":null,"spectrum_id":"CCMSLIB00017256864","spectrum_index":24905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 65.0268 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017256866","spectrum_index":24906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-2,5-Dimethoxyphenethylamine (delta mass: 42.0009 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.079,"smiles":null,"spectrum_id":"CCMSLIB00017256868","spectrum_index":24907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 512.7586 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.819,"smiles":null,"spectrum_id":"CCMSLIB00017256871","spectrum_index":24908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 182.0777 Da; putative annotation: N/A; putative formula: C3H6N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.158,"smiles":null,"spectrum_id":"CCMSLIB00017256874","spectrum_index":24909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 156.0255 Da; putative annotation: N/A; putative formula: N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.116,"smiles":null,"spectrum_id":"CCMSLIB00017256875","spectrum_index":24910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 669.4052 Da; putative annotation: N/A; putative formula: C30H59N3O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":891.502,"smiles":null,"spectrum_id":"CCMSLIB00017256878","spectrum_index":24911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 176.0561 Da; putative annotation: N/A; putative formula: C5H4N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.097,"smiles":null,"spectrum_id":"CCMSLIB00017256881","spectrum_index":24912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 236.0831 Da; putative annotation: N/A; putative formula: C16H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.154,"smiles":null,"spectrum_id":"CCMSLIB00017256882","spectrum_index":24913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(1H-Imidazol-4-yl)ethyl]-N'-(2-phenylethyl)thiourea (delta mass: 128.1066 Da; putative annotation: N/A; putative formula: C5H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.239,"smiles":null,"spectrum_id":"CCMSLIB00017256885","spectrum_index":24914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 93.9897 Da; putative annotation: N/A; putative formula: CH2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.097,"smiles":null,"spectrum_id":"CCMSLIB00017256888","spectrum_index":24915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 13.0285 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.104,"smiles":null,"spectrum_id":"CCMSLIB00017256890","spectrum_index":24916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 233.1015 Da; putative annotation: N/A; putative formula: C8H15N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.252,"smiles":null,"spectrum_id":"CCMSLIB00017256892","spectrum_index":24917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-2-phenylpropan-1-amine (delta mass: 392.1388 Da; putative annotation: N/A; putative formula: C20H25O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.266,"smiles":null,"spectrum_id":"CCMSLIB00017256895","spectrum_index":24918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 487.191 Da; putative annotation: N/A; putative formula: C32H21N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.262,"smiles":null,"spectrum_id":"CCMSLIB00017256898","spectrum_index":24919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 45.0282 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.08,"smiles":null,"spectrum_id":"CCMSLIB00017256899","spectrum_index":24920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 84.8777 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.964,"smiles":null,"spectrum_id":"CCMSLIB00017256902","spectrum_index":24921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 322.0911 Da; putative annotation: N/A; putative formula: C23H15P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.156,"smiles":null,"spectrum_id":"CCMSLIB00017256905","spectrum_index":24922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Venalstonine (delta mass: 45.0312 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.222,"smiles":null,"spectrum_id":"CCMSLIB00017256907","spectrum_index":24923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 561.2557 Da; putative annotation: N/A; putative formula: C26H39N7O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.524,"smiles":null,"spectrum_id":"CCMSLIB00017256909","spectrum_index":24924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 230.1298 Da; putative annotation: N/A; putative formula: C9H19N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.242,"smiles":null,"spectrum_id":"CCMSLIB00017256912","spectrum_index":24925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 53.0711 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.108,"smiles":null,"spectrum_id":"CCMSLIB00017256915","spectrum_index":24926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.17,"smiles":null,"spectrum_id":"CCMSLIB00017256918","spectrum_index":24927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 84.0235 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.128,"smiles":null,"spectrum_id":"CCMSLIB00017256920","spectrum_index":24928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Pro from NIST14 (delta mass: 116.048 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.151,"smiles":null,"spectrum_id":"CCMSLIB00017256922","spectrum_index":24929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 82.0422 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.113,"smiles":null,"spectrum_id":"CCMSLIB00017256925","spectrum_index":24930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 133.0604 Da; putative annotation: N/A; putative formula: C2H7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.147,"smiles":null,"spectrum_id":"CCMSLIB00017256928","spectrum_index":24931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-yl)-N-(4-methoxyphenyl)acetamide (delta mass: 45.0612 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.19,"smiles":null,"spectrum_id":"CCMSLIB00017256931","spectrum_index":24932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 441.0894 Da; putative annotation: N/A; putative formula: C16H31N3O-1S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.132,"smiles":null,"spectrum_id":"CCMSLIB00017256933","spectrum_index":24933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 109.9963 Da; putative annotation: N/A; putative formula: H2N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.075,"smiles":null,"spectrum_id":"CCMSLIB00017256936","spectrum_index":24934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 73.0566 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017256938","spectrum_index":24935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 501.5021 Da; putative annotation: N/A; putative formula: C33H63N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.61,"smiles":null,"spectrum_id":"CCMSLIB00017256941","spectrum_index":24936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 214.1162 Da; putative annotation: N/A; putative formula: C10H20N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.218,"smiles":null,"spectrum_id":"CCMSLIB00017256944","spectrum_index":24937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 157.1824 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.253,"smiles":null,"spectrum_id":"CCMSLIB00017256946","spectrum_index":24938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 185.2133 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.284,"smiles":null,"spectrum_id":"CCMSLIB00017256950","spectrum_index":24939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 250.0974 Da; putative annotation: N/A; putative formula: C10H19O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.21,"smiles":null,"spectrum_id":"CCMSLIB00017256952","spectrum_index":24940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 57.0604 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.126,"smiles":null,"spectrum_id":"CCMSLIB00017256955","spectrum_index":24941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 78.0313 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.112,"smiles":null,"spectrum_id":"CCMSLIB00017256958","spectrum_index":24942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-3-ylmethanamine (delta mass: 10.9845 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.071,"smiles":null,"spectrum_id":"CCMSLIB00017256961","spectrum_index":24943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 178.1176 Da; putative annotation: N/A; putative formula: C12H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.165,"smiles":null,"spectrum_id":"CCMSLIB00017256963","spectrum_index":24944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 180.0491 Da; putative annotation: N/A; putative formula: C13H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.109,"smiles":null,"spectrum_id":"CCMSLIB00017256966","spectrum_index":24945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 203.0848 Da; putative annotation: N/A; putative formula: C14H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.162,"smiles":null,"spectrum_id":"CCMSLIB00017256969","spectrum_index":24946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 58.0422 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.228,"smiles":null,"spectrum_id":"CCMSLIB00017256971","spectrum_index":24947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 59.1153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.197,"smiles":null,"spectrum_id":"CCMSLIB00017256974","spectrum_index":24948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 270.261 Da; putative annotation: N/A; putative formula: C16H35N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.333,"smiles":null,"spectrum_id":"CCMSLIB00017256976","spectrum_index":24949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 126.0317 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.171,"smiles":null,"spectrum_id":"CCMSLIB00017256979","spectrum_index":24950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017256982","spectrum_index":24951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 213.0399 Da; putative annotation: N/A; putative formula: C8H3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.1,"smiles":null,"spectrum_id":"CCMSLIB00017256984","spectrum_index":24952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 297.1933 Da; putative annotation: N/A; putative formula: C16H27NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.264,"smiles":null,"spectrum_id":"CCMSLIB00017256987","spectrum_index":24953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000901 Harman|1-methyl-9H-pyrido[3,4-b]indole (delta mass: 34.0148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017256990","spectrum_index":24954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 27.0115 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.072,"smiles":null,"spectrum_id":"CCMSLIB00017256992","spectrum_index":24955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 63.9966 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.156,"smiles":null,"spectrum_id":"CCMSLIB00017256995","spectrum_index":24956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 134.1127 Da; putative annotation: N/A; putative formula: H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.34,"smiles":null,"spectrum_id":"CCMSLIB00017256998","spectrum_index":24957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 172.1622 Da; putative annotation: N/A; putative formula: C14H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.243,"smiles":null,"spectrum_id":"CCMSLIB00017257000","spectrum_index":24958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 52.0745 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.214,"smiles":null,"spectrum_id":"CCMSLIB00017257002","spectrum_index":24959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 46.9847 Da; putative annotation: N/A; putative formula: HNS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.123,"smiles":null,"spectrum_id":"CCMSLIB00017257005","spectrum_index":24960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 106.0419 Da; putative annotation: Orcinol; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017257008","spectrum_index":24961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 143.0583 Da; putative annotation: .alpha.-Aminoadipic acid - 30.0 eV; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017257009","spectrum_index":24962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 147.0683 Da; putative annotation: DL-Phenylalanine; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017257012","spectrum_index":24963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethylene glycol (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.123,"smiles":null,"spectrum_id":"CCMSLIB00017257015","spectrum_index":24964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 161.0696 Da; putative annotation: 2-((2H-pyrazolo[3,4-d]pyrimidin-4-yl)amino)ethanol; putative formula: C7H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.14,"smiles":null,"spectrum_id":"CCMSLIB00017257017","spectrum_index":24965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 115.0642 Da; putative annotation: (1S,2S,3R,4R)-4-Amino-1,2,3-cyclopentanetriol; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.104,"smiles":null,"spectrum_id":"CCMSLIB00017257020","spectrum_index":24966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 257.126 Da; putative annotation: L-Glutarylcarnitine; putative formula: C12H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.186,"smiles":null,"spectrum_id":"CCMSLIB00017257022","spectrum_index":24967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 126.0313 Da; putative annotation: 3-(Methoxycarbonyl)but-3-enoic acid; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.102,"smiles":null,"spectrum_id":"CCMSLIB00017257025","spectrum_index":24968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 264.2081 Da; putative annotation: 16-Heptadecyn-4-one, 1,2-dihydroxy-; putative formula: C17H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.294,"smiles":null,"spectrum_id":"CCMSLIB00017257028","spectrum_index":24969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 188.0684 Da; putative annotation: 4,6-O-Ethylidene-.alpha.-D-glucopyranoside; putative formula: C8H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.129,"smiles":null,"spectrum_id":"CCMSLIB00017257030","spectrum_index":24970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 576.2554 Da; putative annotation: (2R,3S,4S,5R,6R)-6-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)oxane-3,4-diol; putative formula: C30H40O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.373,"smiles":null,"spectrum_id":"CCMSLIB00017257032","spectrum_index":24971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 118.099 Da; putative annotation: N/A; putative formula: C2H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017257035","spectrum_index":24972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Chloro-9H-carbazole (delta mass: 18.0186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.06,"smiles":null,"spectrum_id":"CCMSLIB00017257038","spectrum_index":24973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.191,"smiles":null,"spectrum_id":"CCMSLIB00017257041","spectrum_index":24974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 29.0064 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.094,"smiles":null,"spectrum_id":"CCMSLIB00017257044","spectrum_index":24975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 97.9685 Da; putative annotation: N/A; putative formula: CH-2N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.092,"smiles":null,"spectrum_id":"CCMSLIB00017257046","spectrum_index":24976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 248.8604 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.958,"smiles":null,"spectrum_id":"CCMSLIB00017257048","spectrum_index":24977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Phe (delta mass: 355.173 Da; putative annotation: N/A; putative formula: C20H27N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.302,"smiles":null,"spectrum_id":"CCMSLIB00017257051","spectrum_index":24978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 35.0452 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.126,"smiles":null,"spectrum_id":"CCMSLIB00017257054","spectrum_index":24979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 40.0901 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.171,"smiles":null,"spectrum_id":"CCMSLIB00017257056","spectrum_index":24980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 693.3923 Da; putative annotation: N/A; putative formula: C38H55N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.463,"smiles":null,"spectrum_id":"CCMSLIB00017257058","spectrum_index":24981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyluridine (delta mass: 72.0615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.154,"smiles":null,"spectrum_id":"CCMSLIB00017257061","spectrum_index":24982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 139.0251 Da; putative annotation: N/A; putative formula: C2HN7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.138,"smiles":null,"spectrum_id":"CCMSLIB00017257064","spectrum_index":24983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 102.0296 Da; putative annotation: N/A; putative formula: H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017257067","spectrum_index":24984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-chloro-5-fluoro-1H-indole-2-carboxylate (delta mass: 18.0878 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.11,"smiles":null,"spectrum_id":"CCMSLIB00017257069","spectrum_index":24985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 881.5136 Da; putative annotation: N/A; putative formula: C44H63N15O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1074.58,"smiles":null,"spectrum_id":"CCMSLIB00017257071","spectrum_index":24986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 74.001 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.124,"smiles":null,"spectrum_id":"CCMSLIB00017257074","spectrum_index":24987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 240.0704 Da; putative annotation: N/A; putative formula: C15H13OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.235,"smiles":null,"spectrum_id":"CCMSLIB00017257076","spectrum_index":24988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 446.2082 Da; putative annotation: N/A; putative formula: C22H31N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.341,"smiles":null,"spectrum_id":"CCMSLIB00017257079","spectrum_index":24989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 89.394 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.5,"smiles":null,"spectrum_id":"CCMSLIB00017257081","spectrum_index":24990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 14.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.238,"smiles":null,"spectrum_id":"CCMSLIB00017257084","spectrum_index":24991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 316.1147 Da; putative annotation: N/A; putative formula: C19H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.154,"smiles":null,"spectrum_id":"CCMSLIB00017257087","spectrum_index":24992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 720.0539 Da; putative annotation: N/A; putative formula: C40H16O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.109,"smiles":null,"spectrum_id":"CCMSLIB00017257089","spectrum_index":24993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 53.0267 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.113,"smiles":null,"spectrum_id":"CCMSLIB00017257092","spectrum_index":24994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 41.9483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017257094","spectrum_index":24995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 50.0397 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.144,"smiles":null,"spectrum_id":"CCMSLIB00017257097","spectrum_index":24996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 82.0057 Da; putative annotation: N/A; putative formula: C4H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.182,"smiles":null,"spectrum_id":"CCMSLIB00017257100","spectrum_index":24997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 262.2667 Da; putative annotation: N/A; putative formula: C19H34)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.348,"smiles":null,"spectrum_id":"CCMSLIB00017257102","spectrum_index":24998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.149,"smiles":null,"spectrum_id":"CCMSLIB00017257104","spectrum_index":24999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 85.0887 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.222,"smiles":null,"spectrum_id":"CCMSLIB00017257107","spectrum_index":25000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 53.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.154,"smiles":null,"spectrum_id":"CCMSLIB00017257110","spectrum_index":25001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 16.0619 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.127,"smiles":null,"spectrum_id":"CCMSLIB00017257112","spectrum_index":25002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ033508 Norfluoxetine|Norfluoxetin|3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine (delta mass: 113.0621 Da; putative annotation: N/A; putative formula: C9H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.188,"smiles":null,"spectrum_id":"CCMSLIB00017257115","spectrum_index":25003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of phenylethanolamine - 40.0 eV (delta mass: 230.1506 Da; putative annotation: N/A; putative formula: C12H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.242,"smiles":null,"spectrum_id":"CCMSLIB00017257117","spectrum_index":25004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 632.3949 Da; putative annotation: N/A; putative formula: C38H48N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.466,"smiles":null,"spectrum_id":"CCMSLIB00017257120","spectrum_index":25005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 598.388 Da; putative annotation: N/A; putative formula: C37H58O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.459,"smiles":null,"spectrum_id":"CCMSLIB00017257123","spectrum_index":25006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 649.4187 Da; putative annotation: N/A; putative formula: C36H59NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":976.547,"smiles":null,"spectrum_id":"CCMSLIB00017257125","spectrum_index":25007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 14.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.079,"smiles":null,"spectrum_id":"CCMSLIB00017257128","spectrum_index":25008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 125.8583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.918,"smiles":null,"spectrum_id":"CCMSLIB00017257131","spectrum_index":25009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 186.1255 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.206,"smiles":null,"spectrum_id":"CCMSLIB00017257134","spectrum_index":25010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 837.4391 Da; putative annotation: N/A; putative formula: C57H59NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1164.57,"smiles":null,"spectrum_id":"CCMSLIB00017257136","spectrum_index":25011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 420.3379 Da; putative annotation: N/A; putative formula: C24H45N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.461,"smiles":null,"spectrum_id":"CCMSLIB00017257138","spectrum_index":25012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 389.1419 Da; putative annotation: N/A; putative formula: C20H27N3O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.239,"smiles":null,"spectrum_id":"CCMSLIB00017257141","spectrum_index":25013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 73.9999 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.087,"smiles":null,"spectrum_id":"CCMSLIB00017257143","spectrum_index":25014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 244.1223 Da; putative annotation: N/A; putative formula: C12H21O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.276,"smiles":null,"spectrum_id":"CCMSLIB00017257147","spectrum_index":25015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 26.9873 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.074,"smiles":null,"spectrum_id":"CCMSLIB00017257149","spectrum_index":25016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 208.9865 Da; putative annotation: N/A; putative formula: C3H7N5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.042,"smiles":null,"spectrum_id":"CCMSLIB00017257151","spectrum_index":25017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 133.0859 Da; putative annotation: N/A; putative formula: C4H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.215,"smiles":null,"spectrum_id":"CCMSLIB00017257154","spectrum_index":25018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 481.2158 Da; putative annotation: N/A; putative formula: C20H35NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.286,"smiles":null,"spectrum_id":"CCMSLIB00017257156","spectrum_index":25019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 723.5495 Da; putative annotation: N/A; putative formula: C38H77NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":904.62,"smiles":null,"spectrum_id":"CCMSLIB00017257159","spectrum_index":25020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 626.3138 Da; putative annotation: N/A; putative formula: C33H46N4O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":807.385,"smiles":null,"spectrum_id":"CCMSLIB00017257162","spectrum_index":25021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 79.0507 Da; putative annotation: N/A; putative formula: C4H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.163,"smiles":null,"spectrum_id":"CCMSLIB00017257164","spectrum_index":25022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 56.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.13,"smiles":null,"spectrum_id":"CCMSLIB00017257166","spectrum_index":25023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100300 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole (delta mass: 16.025 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.073,"smiles":null,"spectrum_id":"CCMSLIB00017257169","spectrum_index":25024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 381.2932 Da; putative annotation: N/A; putative formula: C20H39N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.365,"smiles":null,"spectrum_id":"CCMSLIB00017257171","spectrum_index":25025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 174.073 Da; putative annotation: N/A; putative formula: C8H16P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.18,"smiles":null,"spectrum_id":"CCMSLIB00017257174","spectrum_index":25026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 510.4625 Da; putative annotation: N/A; putative formula: C36H62O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.544,"smiles":null,"spectrum_id":"CCMSLIB00017257176","spectrum_index":25027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 603.5379 Da; putative annotation: N/A; putative formula: C42H69NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":789.609,"smiles":null,"spectrum_id":"CCMSLIB00017257179","spectrum_index":25028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 27.0106 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.098,"smiles":null,"spectrum_id":"CCMSLIB00017257182","spectrum_index":25029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 22.0205 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.092,"smiles":null,"spectrum_id":"CCMSLIB00017257184","spectrum_index":25030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 106.0623 Da; putative annotation: N/A; putative formula: H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.128,"smiles":null,"spectrum_id":"CCMSLIB00017257187","spectrum_index":25031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 301.1529 Da; putative annotation: N/A; putative formula: C14H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.213,"smiles":null,"spectrum_id":"CCMSLIB00017257189","spectrum_index":25032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 254.1922 Da; putative annotation: N/A; putative formula: C13H26N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.331,"smiles":null,"spectrum_id":"CCMSLIB00017257191","spectrum_index":25033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 163.0631 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.108,"smiles":null,"spectrum_id":"CCMSLIB00017257194","spectrum_index":25034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE0; MS2Dec (delta mass: 120.115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.191,"smiles":null,"spectrum_id":"CCMSLIB00017257195","spectrum_index":25035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 141.1446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.185,"smiles":null,"spectrum_id":"CCMSLIB00017257198","spectrum_index":25036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 1-methyl-9H-beta-carbolin-7-yl ether (delta mass: 105.1379 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.24,"smiles":null,"spectrum_id":"CCMSLIB00017257200","spectrum_index":25037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Streptomycin A (delta mass: 213.9451 Da; putative annotation: N/A; putative formula: H-2N4O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.218,"smiles":null,"spectrum_id":"CCMSLIB00017257202","spectrum_index":25038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 23.8981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017257205","spectrum_index":25039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017257208","spectrum_index":25040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S-Carboxymethyl-L-cysteine CollisionEnergy:102040 (delta mass: 103.0075 Da; putative annotation: N/A; putative formula: C6HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.04,"smiles":null,"spectrum_id":"CCMSLIB00017257211","spectrum_index":25041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 105.0429 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.124,"smiles":null,"spectrum_id":"CCMSLIB00017257213","spectrum_index":25042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:102040 (delta mass: 128.0475 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.128,"smiles":null,"spectrum_id":"CCMSLIB00017257216","spectrum_index":25043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 144.0209 Da; putative annotation: N/A; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.138,"smiles":null,"spectrum_id":"CCMSLIB00017257219","spectrum_index":25044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 58.0496 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.127,"smiles":null,"spectrum_id":"CCMSLIB00017257221","spectrum_index":25045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 12.0229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.13,"smiles":null,"spectrum_id":"CCMSLIB00017257223","spectrum_index":25046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 70.0539 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.134,"smiles":null,"spectrum_id":"CCMSLIB00017257226","spectrum_index":25047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmane (delta mass: 2.0282 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.12,"smiles":null,"spectrum_id":"CCMSLIB00017257228","spectrum_index":25048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 40.0325 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.129,"smiles":null,"spectrum_id":"CCMSLIB00017257231","spectrum_index":25049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 70.0387 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.078,"smiles":null,"spectrum_id":"CCMSLIB00017257233","spectrum_index":25050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 71.0071 Da; putative annotation: N/A; putative formula: CH2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.083,"smiles":null,"spectrum_id":"CCMSLIB00017257236","spectrum_index":25051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 55.0423 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.165,"smiles":null,"spectrum_id":"CCMSLIB00017257239","spectrum_index":25052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 86.0719 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.148,"smiles":null,"spectrum_id":"CCMSLIB00017257241","spectrum_index":25053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 180.1156 Da; putative annotation: N/A; putative formula: C11H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.212,"smiles":null,"spectrum_id":"CCMSLIB00017257244","spectrum_index":25054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 573.2639 Da; putative annotation: N/A; putative formula: C37H31N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.335,"smiles":null,"spectrum_id":"CCMSLIB00017257246","spectrum_index":25055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 549.2175 Da; putative annotation: N/A; putative formula: C22H35N3O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":729.304,"smiles":null,"spectrum_id":"CCMSLIB00017257248","spectrum_index":25056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 17.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.139,"smiles":null,"spectrum_id":"CCMSLIB00017257251","spectrum_index":25057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 327.2751 Da; putative annotation: N/A; putative formula: C15H33N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.339,"smiles":null,"spectrum_id":"CCMSLIB00017257253","spectrum_index":25058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 18.0023 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.095,"smiles":null,"spectrum_id":"CCMSLIB00017257255","spectrum_index":25059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 112.0374 Da; putative annotation: N/A; putative formula: C3H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.145,"smiles":null,"spectrum_id":"CCMSLIB00017257258","spectrum_index":25060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1178) (delta mass: 354.1116 Da; putative annotation: N/A; putative formula: C21H14N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.266,"smiles":null,"spectrum_id":"CCMSLIB00017257260","spectrum_index":25061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 77.0841 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.149,"smiles":null,"spectrum_id":"CCMSLIB00017257262","spectrum_index":25062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-Methyl-DL-serine (delta mass: 298.2509 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.316,"smiles":null,"spectrum_id":"CCMSLIB00017257265","spectrum_index":25063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 395.3547 Da; putative annotation: N/A; putative formula: C28H45N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.425,"smiles":null,"spectrum_id":"CCMSLIB00017257268","spectrum_index":25064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01042 Hexahydrocurcumin (delta mass: 118.0266 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.207,"smiles":null,"spectrum_id":"CCMSLIB00017257270","spectrum_index":25065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 178.9673 Da; putative annotation: N/A; putative formula: C7HNO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.059,"smiles":null,"spectrum_id":"CCMSLIB00017257272","spectrum_index":25066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 103.035 Da; putative annotation: N/A; putative formula: C2H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.074,"smiles":null,"spectrum_id":"CCMSLIB00017257275","spectrum_index":25067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Cyclopropylmethyl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide (delta mass: 70.0459 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.233,"smiles":null,"spectrum_id":"CCMSLIB00017257277","spectrum_index":25068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 84.0754 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017257279","spectrum_index":25069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of fMet CollisionEnergy:205060 (delta mass: 84.0209 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.074,"smiles":null,"spectrum_id":"CCMSLIB00017257282","spectrum_index":25070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 450.314 Da; putative annotation: N/A; putative formula: C22H48N2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":793.438,"smiles":null,"spectrum_id":"CCMSLIB00017257284","spectrum_index":25071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 461.1896 Da; putative annotation: N/A; putative formula: C20H31NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.276,"smiles":null,"spectrum_id":"CCMSLIB00017257286","spectrum_index":25072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 148.0813 Da; putative annotation: N/A; putative formula: C10H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.141,"smiles":null,"spectrum_id":"CCMSLIB00017257289","spectrum_index":25073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 45.1206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.187,"smiles":null,"spectrum_id":"CCMSLIB00017257292","spectrum_index":25074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7,8,9,10,11-Hexahydro-5H-cycloocta[b]indole (delta mass: 116.0661 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.21,"smiles":null,"spectrum_id":"CCMSLIB00017257293","spectrum_index":25075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 130.0625 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.149,"smiles":null,"spectrum_id":"CCMSLIB00017257296","spectrum_index":25076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C9:0 (delta mass: 46.0608 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.267,"smiles":null,"spectrum_id":"CCMSLIB00017257299","spectrum_index":25077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 375.3076 Da; putative annotation: N/A; putative formula: C23H41N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.388,"smiles":null,"spectrum_id":"CCMSLIB00017257302","spectrum_index":25078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 446.1001 Da; putative annotation: N/A; putative formula: C25H18O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.181,"smiles":null,"spectrum_id":"CCMSLIB00017257304","spectrum_index":25079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 380.1418 Da; putative annotation: N/A; putative formula: C18H26N2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.265,"smiles":null,"spectrum_id":"CCMSLIB00017257306","spectrum_index":25080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000528 4-methoxy-1H-indole-3-carbaldehyde (delta mass: 81.1132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.184,"smiles":null,"spectrum_id":"CCMSLIB00017257309","spectrum_index":25081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 513.1702 Da; putative annotation: N/A; putative formula: C33H19N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.246,"smiles":null,"spectrum_id":"CCMSLIB00017257311","spectrum_index":25082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 482.1282 Da; putative annotation: N/A; putative formula: C29H23O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.199,"smiles":null,"spectrum_id":"CCMSLIB00017257314","spectrum_index":25083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 97.0528 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.176,"smiles":null,"spectrum_id":"CCMSLIB00017257316","spectrum_index":25084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 306.0956 Da; putative annotation: N/A; putative formula: C15H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.219,"smiles":null,"spectrum_id":"CCMSLIB00017257319","spectrum_index":25085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 194.0738 Da; putative annotation: N/A; putative formula: C6H16N2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.197,"smiles":null,"spectrum_id":"CCMSLIB00017257321","spectrum_index":25086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 332.2562 Da; putative annotation: N/A; putative formula: C18H36O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.295,"smiles":null,"spectrum_id":"CCMSLIB00017257324","spectrum_index":25087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 163.1308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.165,"smiles":null,"spectrum_id":"CCMSLIB00017257325","spectrum_index":25088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 516.0564 Da; putative annotation: N/A; putative formula: C17H30N2O4P2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.205,"smiles":null,"spectrum_id":"CCMSLIB00017257328","spectrum_index":25089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 100.0307 Da; putative annotation: N/A; putative formula: C2H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.106,"smiles":null,"spectrum_id":"CCMSLIB00017257331","spectrum_index":25090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 178.0523 Da; putative annotation: N/A; putative formula: C4H10N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.207,"smiles":null,"spectrum_id":"CCMSLIB00017257332","spectrum_index":25091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 201.1366 Da; putative annotation: N/A; putative formula: C10H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.197,"smiles":null,"spectrum_id":"CCMSLIB00017257335","spectrum_index":25092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 79.9648 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.088,"smiles":null,"spectrum_id":"CCMSLIB00017257338","spectrum_index":25093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Allylphenoxy)acetic acid (delta mass: 40.0313 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017257339","spectrum_index":25094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopentylacetic acid (delta mass: 46.0081 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.11,"smiles":null,"spectrum_id":"CCMSLIB00017257342","spectrum_index":25095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 42.0099 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.07,"smiles":null,"spectrum_id":"CCMSLIB00017257345","spectrum_index":25096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 105.0572 Da; putative annotation: N/A; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.17,"smiles":null,"spectrum_id":"CCMSLIB00017257346","spectrum_index":25097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 125.0903 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.213,"smiles":null,"spectrum_id":"CCMSLIB00017257349","spectrum_index":25098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 194.0668 Da; putative annotation: N/A; putative formula: C5H6N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.153,"smiles":null,"spectrum_id":"CCMSLIB00017257350","spectrum_index":25099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Octylsulfonyl)ethanol (delta mass: 17.0234 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.16,"smiles":null,"spectrum_id":"CCMSLIB00017257353","spectrum_index":25100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 896.0992 Da; putative annotation: N/A; putative formula: C35H32N10O9S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1206.21,"smiles":null,"spectrum_id":"CCMSLIB00017257356","spectrum_index":25101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 769.6025 Da; putative annotation: N/A; putative formula: C52H75N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1079.72,"smiles":null,"spectrum_id":"CCMSLIB00017257357","spectrum_index":25102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylhistamine CollisionEnergy:102040 (delta mass: 69.9943 Da; putative annotation: N/A; putative formula: C5H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017257360","spectrum_index":25103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 776.1169 Da; putative annotation: N/A; putative formula: C37H32N2O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":998.214,"smiles":null,"spectrum_id":"CCMSLIB00017257363","spectrum_index":25104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 753.7423 Da; putative annotation: N/A; putative formula: C45H95N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":975.839,"smiles":null,"spectrum_id":"CCMSLIB00017257364","spectrum_index":25105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 249.1822 Da; putative annotation: N/A; putative formula: C10H19N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.253,"smiles":null,"spectrum_id":"CCMSLIB00017257367","spectrum_index":25106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 434.1423 Da; putative annotation: N/A; putative formula: C18H26O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.213,"smiles":null,"spectrum_id":"CCMSLIB00017257369","spectrum_index":25107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 72.0591 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.093,"smiles":null,"spectrum_id":"CCMSLIB00017257372","spectrum_index":25108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 87.0684 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.191,"smiles":null,"spectrum_id":"CCMSLIB00017257374","spectrum_index":25109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2,3-dihydro-1H-indole (delta mass: 57.0186 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.09,"smiles":null,"spectrum_id":"CCMSLIB00017257377","spectrum_index":25110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 129.1509 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.222,"smiles":null,"spectrum_id":"CCMSLIB00017257379","spectrum_index":25111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl .alpha.-D-mannopyranoside (delta mass: 179.0786 Da; putative annotation: N/A; putative formula: C3H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.165,"smiles":null,"spectrum_id":"CCMSLIB00017257381","spectrum_index":25112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 585.3509 Da; putative annotation: N/A; putative formula: C43H43N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.422,"smiles":null,"spectrum_id":"CCMSLIB00017257384","spectrum_index":25113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 79.9302 Da; putative annotation: N/A; putative formula: HO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.99,"smiles":null,"spectrum_id":"CCMSLIB00017257387","spectrum_index":25114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 17.4987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.57,"smiles":null,"spectrum_id":"CCMSLIB00017257388","spectrum_index":25115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 2.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.112,"smiles":null,"spectrum_id":"CCMSLIB00017257391","spectrum_index":25116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 66.0508 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.19,"smiles":null,"spectrum_id":"CCMSLIB00017257394","spectrum_index":25117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 172.0852 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.235,"smiles":null,"spectrum_id":"CCMSLIB00017257395","spectrum_index":25118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 439.2743 Da; putative annotation: N/A; putative formula: C28H33N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.37,"smiles":null,"spectrum_id":"CCMSLIB00017257398","spectrum_index":25119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 186.0528 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.113,"smiles":null,"spectrum_id":"CCMSLIB00017257401","spectrum_index":25120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 86.0728 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.133,"smiles":null,"spectrum_id":"CCMSLIB00017257403","spectrum_index":25121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 56.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.148,"smiles":null,"spectrum_id":"CCMSLIB00017257405","spectrum_index":25122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 31.0403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.142,"smiles":null,"spectrum_id":"CCMSLIB00017257408","spectrum_index":25123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Mannitol from NIST14 (delta mass: 264.2464 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.333,"smiles":null,"spectrum_id":"CCMSLIB00017257411","spectrum_index":25124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 584.4082 Da; putative annotation: N/A; putative formula: C36H56O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.468,"smiles":null,"spectrum_id":"CCMSLIB00017257413","spectrum_index":25125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-2-ol (delta mass: 25.9329 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.993,"smiles":null,"spectrum_id":"CCMSLIB00017257416","spectrum_index":25126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 299.1371 Da; putative annotation: N/A; putative formula: C9H18N9OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.213,"smiles":null,"spectrum_id":"CCMSLIB00017257418","spectrum_index":25127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 27.8879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.953,"smiles":null,"spectrum_id":"CCMSLIB00017257420","spectrum_index":25128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 27.0377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.103,"smiles":null,"spectrum_id":"CCMSLIB00017257422","spectrum_index":25129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HAPLAMINE CollisionEnergy:102040 (delta mass: 256.1702 Da; putative annotation: N/A; putative formula: C13H25N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.283,"smiles":null,"spectrum_id":"CCMSLIB00017257425","spectrum_index":25130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 136.0371 Da; putative annotation: N/A; putative formula: C4H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.097,"smiles":null,"spectrum_id":"CCMSLIB00017257427","spectrum_index":25131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 38.0155 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.091,"smiles":null,"spectrum_id":"CCMSLIB00017257430","spectrum_index":25132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 78.0142 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.095,"smiles":null,"spectrum_id":"CCMSLIB00017257432","spectrum_index":25133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 96.0376 Da; putative annotation: N/A; putative formula: C9H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.118,"smiles":null,"spectrum_id":"CCMSLIB00017257435","spectrum_index":25134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GLUCOSE 1-PHOSPHATE (delta mass: 88.034 Da; putative annotation: N/A; putative formula: C4H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.071,"smiles":null,"spectrum_id":"CCMSLIB00017257437","spectrum_index":25135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 146.0579 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.099,"smiles":null,"spectrum_id":"CCMSLIB00017257439","spectrum_index":25136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 106.0086 Da; putative annotation: N/A; putative formula: C5H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.121,"smiles":null,"spectrum_id":"CCMSLIB00017257442","spectrum_index":25137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 113.0833 Da; putative annotation: L-Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.228,"smiles":null,"spectrum_id":"CCMSLIB00017257444","spectrum_index":25138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNITOL (delta mass: 258.1978 Da; putative annotation: 19-Norepiandrosterone; putative formula: C18H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.284,"smiles":null,"spectrum_id":"CCMSLIB00017257446","spectrum_index":25139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 262.2296 Da; putative annotation: Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.295,"smiles":null,"spectrum_id":"CCMSLIB00017257449","spectrum_index":25140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 574.1321 Da; putative annotation: 5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl 6-O-(4-carboxy-3-hydroxy-3-methylbutanoyl)-.beta.-D-galactopyranoside; putative formula: C27H26O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.192,"smiles":null,"spectrum_id":"CCMSLIB00017257452","spectrum_index":25141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 310.106 Da; putative annotation: 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside; putative formula: C15H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.177,"smiles":null,"spectrum_id":"CCMSLIB00017257454","spectrum_index":25142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 158.0218 Da; putative annotation: D(+)-Glucuronic acid .gamma.-lactone; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.082,"smiles":null,"spectrum_id":"CCMSLIB00017257456","spectrum_index":25143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 333.2685 Da; putative annotation: Gly-C19:2; putative formula: C21H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.349,"smiles":null,"spectrum_id":"CCMSLIB00017257459","spectrum_index":25144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Capsazepine (delta mass: 296.1756 Da; putative annotation: N/A; putative formula: C16H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.284,"smiles":null,"spectrum_id":"CCMSLIB00017257461","spectrum_index":25145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 86.0494 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.145,"smiles":null,"spectrum_id":"CCMSLIB00017257463","spectrum_index":25146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 18.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.139,"smiles":null,"spectrum_id":"CCMSLIB00017257466","spectrum_index":25147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 50.0269 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.119,"smiles":null,"spectrum_id":"CCMSLIB00017257469","spectrum_index":25148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 229.1752 Da; putative annotation: N/A; putative formula: C10H23N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.277,"smiles":null,"spectrum_id":"CCMSLIB00017257471","spectrum_index":25149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 27.9922 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.083,"smiles":null,"spectrum_id":"CCMSLIB00017257473","spectrum_index":25150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-hydroxy-1H-pyrimidin-4-one (delta mass: 72.9281 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.974,"smiles":null,"spectrum_id":"CCMSLIB00017257476","spectrum_index":25151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 172.11 Da; putative annotation: N/A; putative formula: C9H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017257478","spectrum_index":25152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 533.414 Da; putative annotation: N/A; putative formula: C38H51N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.509,"smiles":null,"spectrum_id":"CCMSLIB00017257480","spectrum_index":25153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dichloro-1H-indole-2-carboxylic acid (delta mass: 23.025 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.002,"smiles":null,"spectrum_id":"CCMSLIB00017257483","spectrum_index":25154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 116.0837 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.164,"smiles":null,"spectrum_id":"CCMSLIB00017257486","spectrum_index":25155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 425.2783 Da; putative annotation: N/A; putative formula: C24H43NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.349,"smiles":null,"spectrum_id":"CCMSLIB00017257488","spectrum_index":25156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate (delta mass: 74.073 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.165,"smiles":null,"spectrum_id":"CCMSLIB00017257490","spectrum_index":25157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetanine (delta mass: 15.9946 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.133,"smiles":null,"spectrum_id":"CCMSLIB00017257493","spectrum_index":25158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 115.1384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.24,"smiles":null,"spectrum_id":"CCMSLIB00017257494","spectrum_index":25159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 339.0669 Da; putative annotation: N/A; putative formula: C11H22N3OPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.132,"smiles":null,"spectrum_id":"CCMSLIB00017257497","spectrum_index":25160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 939.4822 Da; putative annotation: N/A; putative formula: C60H65N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1120.55,"smiles":null,"spectrum_id":"CCMSLIB00017257500","spectrum_index":25161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 764.4339 Da; putative annotation: N/A; putative formula: C54H56N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.505,"smiles":null,"spectrum_id":"CCMSLIB00017257501","spectrum_index":25162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 48.0388 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.087,"smiles":null,"spectrum_id":"CCMSLIB00017257504","spectrum_index":25163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminophenol (delta mass: 30.0095 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.07,"smiles":null,"spectrum_id":"CCMSLIB00017257507","spectrum_index":25164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1-pentanamine (delta mass: 197.14 Da; putative annotation: N/A; putative formula: C7H15N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.315,"smiles":null,"spectrum_id":"CCMSLIB00017257509","spectrum_index":25165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 13.9341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.969,"smiles":null,"spectrum_id":"CCMSLIB00017257511","spectrum_index":25166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 24.0458 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.105,"smiles":null,"spectrum_id":"CCMSLIB00017257514","spectrum_index":25167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 49.0507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.236,"smiles":null,"spectrum_id":"CCMSLIB00017257516","spectrum_index":25168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PRENOL (delta mass: 24.036 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":111.116,"smiles":null,"spectrum_id":"CCMSLIB00017257518","spectrum_index":25169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 32.2709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.5,"smiles":null,"spectrum_id":"CCMSLIB00017257521","spectrum_index":25170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 24.0954 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.16,"smiles":null,"spectrum_id":"CCMSLIB00017257523","spectrum_index":25171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 103.0266 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.129,"smiles":null,"spectrum_id":"CCMSLIB00017257525","spectrum_index":25172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 159.0164 Da; putative annotation: N/A; putative formula: C5H5NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.077,"smiles":null,"spectrum_id":"CCMSLIB00017257528","spectrum_index":25173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 363.1893 Da; putative annotation: N/A; putative formula: C16H29NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.26,"smiles":null,"spectrum_id":"CCMSLIB00017257531","spectrum_index":25174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 686.2414 Da; putative annotation: N/A; putative formula: C44H34N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":892.323,"smiles":null,"spectrum_id":"CCMSLIB00017257532","spectrum_index":25175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 112.0514 Da; putative annotation: N/A; putative formula: C6H8O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017257535","spectrum_index":25176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 170.127 Da; putative annotation: N/A; putative formula: C6H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.207,"smiles":null,"spectrum_id":"CCMSLIB00017257538","spectrum_index":25177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-5-Hydroxylysine (delta mass: 180.1512 Da; putative annotation: N/A; putative formula: C12H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.259,"smiles":null,"spectrum_id":"CCMSLIB00017257540","spectrum_index":25178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 411.2985 Da; putative annotation: N/A; putative formula: C23H41NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.369,"smiles":null,"spectrum_id":"CCMSLIB00017257543","spectrum_index":25179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 71.9687 Da; putative annotation: N/A; putative formula: C2H2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017257545","spectrum_index":25180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 56.0051 Da; putative annotation: N/A; putative formula: C6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.149,"smiles":null,"spectrum_id":"CCMSLIB00017257547","spectrum_index":25181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 129.0515 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.153,"smiles":null,"spectrum_id":"CCMSLIB00017257550","spectrum_index":25182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 278.1995 Da; putative annotation: N/A; putative formula: C16H26N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.249,"smiles":null,"spectrum_id":"CCMSLIB00017257553","spectrum_index":25183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 233.0475 Da; putative annotation: N/A; putative formula: C15H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.093,"smiles":null,"spectrum_id":"CCMSLIB00017257555","spectrum_index":25184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 18.9944 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.081,"smiles":null,"spectrum_id":"CCMSLIB00017257557","spectrum_index":25185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 246.0136 Da; putative annotation: N/A; putative formula: C8H2N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.11,"smiles":null,"spectrum_id":"CCMSLIB00017257560","spectrum_index":25186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltopentaose from NIST14 (delta mass: 307.1028 Da; putative annotation: N/A; putative formula: C11H13N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1136.38,"smiles":null,"spectrum_id":"CCMSLIB00017257562","spectrum_index":25187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 72.0475 Da; putative annotation: N/A; putative formula: C4H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.128,"smiles":null,"spectrum_id":"CCMSLIB00017257564","spectrum_index":25188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 399.1161 Da; putative annotation: N/A; putative formula: C30H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.245,"smiles":null,"spectrum_id":"CCMSLIB00017257567","spectrum_index":25189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.165,"smiles":null,"spectrum_id":"CCMSLIB00017257571","spectrum_index":25190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 78.0282 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.139,"smiles":null,"spectrum_id":"CCMSLIB00017257573","spectrum_index":25191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 138.0571 Da; putative annotation: N/A; putative formula: C10H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.207,"smiles":null,"spectrum_id":"CCMSLIB00017257576","spectrum_index":25192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 100.0245 Da; putative annotation: N/A; putative formula: C3H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.124,"smiles":null,"spectrum_id":"CCMSLIB00017257578","spectrum_index":25193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 28.005 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.113,"smiles":null,"spectrum_id":"CCMSLIB00017257581","spectrum_index":25194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 137.0841 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.16,"smiles":null,"spectrum_id":"CCMSLIB00017257582","spectrum_index":25195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 144.1136 Da; putative annotation: N/A; putative formula: C4H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.263,"smiles":null,"spectrum_id":"CCMSLIB00017257585","spectrum_index":25196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 224.1513 Da; putative annotation: N/A; putative formula: C12H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.227,"smiles":null,"spectrum_id":"CCMSLIB00017257588","spectrum_index":25197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 135.103 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.179,"smiles":null,"spectrum_id":"CCMSLIB00017257590","spectrum_index":25198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 190.0312 Da; putative annotation: N/A; putative formula: C7H12O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.102,"smiles":null,"spectrum_id":"CCMSLIB00017257592","spectrum_index":25199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 144.115 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.18,"smiles":null,"spectrum_id":"CCMSLIB00017257594","spectrum_index":25200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 84.0196 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.143,"smiles":null,"spectrum_id":"CCMSLIB00017257597","spectrum_index":25201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 162.1257 Da; putative annotation: N/A; putative formula: C9H14N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.248,"smiles":null,"spectrum_id":"CCMSLIB00017257599","spectrum_index":25202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 270.0955 Da; putative annotation: N/A; putative formula: C12H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.134,"smiles":null,"spectrum_id":"CCMSLIB00017257601","spectrum_index":25203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 110.0577 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.107,"smiles":null,"spectrum_id":"CCMSLIB00017257604","spectrum_index":25204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 92.0292 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.1,"smiles":null,"spectrum_id":"CCMSLIB00017257606","spectrum_index":25205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 5.0586 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.07,"smiles":null,"spectrum_id":"CCMSLIB00017257608","spectrum_index":25206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-indol-3-yl)ethanamine (delta mass: 28.9327 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.04,"smiles":null,"spectrum_id":"CCMSLIB00017257611","spectrum_index":25207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 185.1666 Da; putative annotation: N/A; putative formula: C8H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.253,"smiles":null,"spectrum_id":"CCMSLIB00017257614","spectrum_index":25208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.097,"smiles":null,"spectrum_id":"CCMSLIB00017257617","spectrum_index":25209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 253.0082 Da; putative annotation: N/A; putative formula: C7H3N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.157,"smiles":null,"spectrum_id":"CCMSLIB00017257620","spectrum_index":25210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 180.1304 Da; putative annotation: N/A; putative formula: C15H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.211,"smiles":null,"spectrum_id":"CCMSLIB00017257621","spectrum_index":25211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 238.1319 Da; putative annotation: N/A; putative formula: C12H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.18,"smiles":null,"spectrum_id":"CCMSLIB00017257624","spectrum_index":25212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 84.067 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.102,"smiles":null,"spectrum_id":"CCMSLIB00017257625","spectrum_index":25213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 65.0823 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.117,"smiles":null,"spectrum_id":"CCMSLIB00017257629","spectrum_index":25214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 60.0 eV (delta mass: 56.0274 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.13,"smiles":null,"spectrum_id":"CCMSLIB00017257631","spectrum_index":25215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 93.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.128,"smiles":null,"spectrum_id":"CCMSLIB00017257634","spectrum_index":25216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 202.1294 Da; putative annotation: N/A; putative formula: C5H14N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.279,"smiles":null,"spectrum_id":"CCMSLIB00017257636","spectrum_index":25217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.029,"smiles":null,"spectrum_id":"CCMSLIB00017257638","spectrum_index":25218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 170.1132 Da; putative annotation: N/A; putative formula: C10H18S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.215,"smiles":null,"spectrum_id":"CCMSLIB00017257641","spectrum_index":25219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 23.9993 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.075,"smiles":null,"spectrum_id":"CCMSLIB00017257644","spectrum_index":25220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 374.2812 Da; putative annotation: N/A; putative formula: C18H39N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.347,"smiles":null,"spectrum_id":"CCMSLIB00017257645","spectrum_index":25221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 59.0103 Da; putative annotation: N/A; putative formula: HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017257648","spectrum_index":25222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 119.0379 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.135,"smiles":null,"spectrum_id":"CCMSLIB00017257651","spectrum_index":25223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 120.0414 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.154,"smiles":null,"spectrum_id":"CCMSLIB00017257652","spectrum_index":25224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)ethylamine (delta mass: 89.073 Da; putative annotation: N/A; putative formula: CH7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.155,"smiles":null,"spectrum_id":"CCMSLIB00017257655","spectrum_index":25225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Difluoro-1H-indole-2-carboxylic acid (delta mass: 179.0826 Da; putative annotation: N/A; putative formula: C5H14N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.119,"smiles":null,"spectrum_id":"CCMSLIB00017257658","spectrum_index":25226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 15.9952 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.118,"smiles":null,"spectrum_id":"CCMSLIB00017257659","spectrum_index":25227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methylquinolin-2(1H)-one (delta mass: 151.1342 Da; putative annotation: N/A; putative formula: C10H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.21,"smiles":null,"spectrum_id":"CCMSLIB00017257662","spectrum_index":25228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 145.0736 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.144,"smiles":null,"spectrum_id":"CCMSLIB00017257665","spectrum_index":25229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 218.0923 Da; putative annotation: N/A; putative formula: C9H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.282,"smiles":null,"spectrum_id":"CCMSLIB00017257666","spectrum_index":25230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300507 Hordenine (delta mass: 311.1191 Da; putative annotation: N/A; putative formula: C15H21NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.242,"smiles":null,"spectrum_id":"CCMSLIB00017257669","spectrum_index":25231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(4-Ethyl-1-piperazinyl)carbonyl]-1H-indole (delta mass: 71.0466 Da; putative annotation: N/A; putative formula: C2H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.207,"smiles":null,"spectrum_id":"CCMSLIB00017257672","spectrum_index":25232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-1H-indole-2-carboxamide (delta mass: 64.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.144,"smiles":null,"spectrum_id":"CCMSLIB00017257674","spectrum_index":25233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 256.2077 Da; putative annotation: N/A; putative formula: C14H29N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.347,"smiles":null,"spectrum_id":"CCMSLIB00017257676","spectrum_index":25234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Chloro-9H-carbazole (delta mass: 188.1246 Da; putative annotation: N/A; putative formula: C10H22O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.166,"smiles":null,"spectrum_id":"CCMSLIB00017257679","spectrum_index":25235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 254.2261 Da; putative annotation: N/A; putative formula: C15H31N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.334,"smiles":null,"spectrum_id":"CCMSLIB00017257680","spectrum_index":25236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 64.0306 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.091,"smiles":null,"spectrum_id":"CCMSLIB00017257683","spectrum_index":25237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meropenem (delta mass: 176.0326 Da; putative annotation: N/A; putative formula: C7H12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.191,"smiles":null,"spectrum_id":"CCMSLIB00017257686","spectrum_index":25238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 368.0987 Da; putative annotation: N/A; putative formula: C31H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.159,"smiles":null,"spectrum_id":"CCMSLIB00017257689","spectrum_index":25239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 260.0814 Da; putative annotation: N/A; putative formula: C11H17O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.215,"smiles":null,"spectrum_id":"CCMSLIB00017257690","spectrum_index":25240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 27.0112 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.134,"smiles":null,"spectrum_id":"CCMSLIB00017257693","spectrum_index":25241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 202.11 Da; putative annotation: N/A; putative formula: C6H15N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.244,"smiles":null,"spectrum_id":"CCMSLIB00017257696","spectrum_index":25242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 31.9302 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.021,"smiles":null,"spectrum_id":"CCMSLIB00017257698","spectrum_index":25243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 971.3336 Da; putative annotation: N/A; putative formula: C71H45N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1152.4,"smiles":null,"spectrum_id":"CCMSLIB00017257700","spectrum_index":25244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 79.051 Da; putative annotation: N/A; putative formula: C4H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.122,"smiles":null,"spectrum_id":"CCMSLIB00017257703","spectrum_index":25245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 423.1882 Da; putative annotation: N/A; putative formula: C15H30N5O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.259,"smiles":null,"spectrum_id":"CCMSLIB00017257705","spectrum_index":25246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 117.057 Da; putative annotation: N/A; putative formula: C2H8N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.148,"smiles":null,"spectrum_id":"CCMSLIB00017257707","spectrum_index":25247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 292.2396 Da; putative annotation: N/A; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.363,"smiles":null,"spectrum_id":"CCMSLIB00017257710","spectrum_index":25248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 895.8708 Da; putative annotation: N/A; putative formula: C60H113NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1117.97,"smiles":null,"spectrum_id":"CCMSLIB00017257713","spectrum_index":25249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 36.0113 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.098,"smiles":null,"spectrum_id":"CCMSLIB00017257715","spectrum_index":25250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 101.0471 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017257717","spectrum_index":25251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 42.0141 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.08,"smiles":null,"spectrum_id":"CCMSLIB00017257720","spectrum_index":25252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 26.9083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.958,"smiles":null,"spectrum_id":"CCMSLIB00017257722","spectrum_index":25253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 102.0319 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.097,"smiles":null,"spectrum_id":"CCMSLIB00017257724","spectrum_index":25254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 76.0742 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017257727","spectrum_index":25255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 658.2948 Da; putative annotation: N/A; putative formula: C30H46N2O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.386,"smiles":null,"spectrum_id":"CCMSLIB00017257730","spectrum_index":25256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 124.04 Da; putative annotation: N/A; putative formula: C4H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.1,"smiles":null,"spectrum_id":"CCMSLIB00017257732","spectrum_index":25257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 32.0463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017257734","spectrum_index":25258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 895.7881 Da; putative annotation: N/A; putative formula: C55H101N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1205.9,"smiles":null,"spectrum_id":"CCMSLIB00017257737","spectrum_index":25259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 261.158 Da; putative annotation: N/A; putative formula: C12H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.218,"smiles":null,"spectrum_id":"CCMSLIB00017257739","spectrum_index":25260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 269.3078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.378,"smiles":null,"spectrum_id":"CCMSLIB00017257741","spectrum_index":25261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 373.2825 Da; putative annotation: N/A; putative formula: C20H39NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.353,"smiles":null,"spectrum_id":"CCMSLIB00017257744","spectrum_index":25262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxyamphetamine (delta mass: 54.0462 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.19,"smiles":null,"spectrum_id":"CCMSLIB00017257747","spectrum_index":25263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 144.1658 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.237,"smiles":null,"spectrum_id":"CCMSLIB00017257749","spectrum_index":25264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 873.3781 Da; putative annotation: N/A; putative formula: C42H47N15O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1095.48,"smiles":null,"spectrum_id":"CCMSLIB00017257751","spectrum_index":25265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 872.6263 Da; putative annotation: N/A; putative formula: C51H76N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1094.72,"smiles":null,"spectrum_id":"CCMSLIB00017257754","spectrum_index":25266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-3-{1H-pyrrolo[3,2-b]pyridin-3-yl}propanoic acid (delta mass: 47.0157 Da; putative annotation: N/A; putative formula: C4HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.108,"smiles":null,"spectrum_id":"CCMSLIB00017257756","spectrum_index":25267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 93.346 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.5,"smiles":null,"spectrum_id":"CCMSLIB00017257759","spectrum_index":25268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydrazinobenzoic acid (delta mass: 46.0304 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017257761","spectrum_index":25269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 162.0455 Da; putative annotation: N/A; putative formula: C7H7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.093,"smiles":null,"spectrum_id":"CCMSLIB00017257764","spectrum_index":25270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Bromo-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 15.1939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.212,"smiles":null,"spectrum_id":"CCMSLIB00017257766","spectrum_index":25271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 76.0648 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.13,"smiles":null,"spectrum_id":"CCMSLIB00017257768","spectrum_index":25272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 45.0209 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.112,"smiles":null,"spectrum_id":"CCMSLIB00017257771","spectrum_index":25273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 99.9998 Da; putative annotation: N/A; putative formula: C4H6O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.039,"smiles":null,"spectrum_id":"CCMSLIB00017257773","spectrum_index":25274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 126.0688 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.08,"smiles":null,"spectrum_id":"CCMSLIB00017257776","spectrum_index":25275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 106.0434 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.13,"smiles":null,"spectrum_id":"CCMSLIB00017257778","spectrum_index":25276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxindole; LC-tDDA; CE10 (delta mass: 150.089 Da; putative annotation: N/A; putative formula: C7H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.165,"smiles":null,"spectrum_id":"CCMSLIB00017257781","spectrum_index":25277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 78.0698 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017257783","spectrum_index":25278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 267.1829 Da; putative annotation: N/A; putative formula: C15H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.263,"smiles":null,"spectrum_id":"CCMSLIB00017257786","spectrum_index":25279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 178.1569 Da; putative annotation: N/A; putative formula: C10H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.269,"smiles":null,"spectrum_id":"CCMSLIB00017257788","spectrum_index":25280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 45.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.118,"smiles":null,"spectrum_id":"CCMSLIB00017257790","spectrum_index":25281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 39.0468 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.197,"smiles":null,"spectrum_id":"CCMSLIB00017257793","spectrum_index":25282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 308.3441 Da; putative annotation: N/A; putative formula: C22H44)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.414,"smiles":null,"spectrum_id":"CCMSLIB00017257796","spectrum_index":25283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 436.3045 Da; putative annotation: N/A; putative formula: C23H40N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.344,"smiles":null,"spectrum_id":"CCMSLIB00017257798","spectrum_index":25284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 163.0633 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.15,"smiles":null,"spectrum_id":"CCMSLIB00017257800","spectrum_index":25285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 217.1504 Da; putative annotation: N/A; putative formula: C11H23NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.256,"smiles":null,"spectrum_id":"CCMSLIB00017257803","spectrum_index":25286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 266.26 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.313,"smiles":null,"spectrum_id":"CCMSLIB00017257805","spectrum_index":25287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 140.0167 Da; putative annotation: N/A; putative formula: C4H4N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.075,"smiles":null,"spectrum_id":"CCMSLIB00017257808","spectrum_index":25288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 88.0522 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017257810","spectrum_index":25289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 469.7799 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.851,"smiles":null,"spectrum_id":"CCMSLIB00017257813","spectrum_index":25290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 38.019 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.067,"smiles":null,"spectrum_id":"CCMSLIB00017257815","spectrum_index":25291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 32.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.106,"smiles":null,"spectrum_id":"CCMSLIB00017257818","spectrum_index":25292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 25.0304 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.122,"smiles":null,"spectrum_id":"CCMSLIB00017257820","spectrum_index":25293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 18.0091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.08,"smiles":null,"spectrum_id":"CCMSLIB00017257822","spectrum_index":25294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 93.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.29,"smiles":null,"spectrum_id":"CCMSLIB00017257825","spectrum_index":25295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-thiol (delta mass: 197.0728 Da; putative annotation: N/A; putative formula: C7H11N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.11,"smiles":null,"spectrum_id":"CCMSLIB00017257828","spectrum_index":25296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 126.1159 Da; putative annotation: N/A; putative formula: C7H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.207,"smiles":null,"spectrum_id":"CCMSLIB00017257830","spectrum_index":25297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 561.3165 Da; putative annotation: N/A; putative formula: C28H43N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":742.387,"smiles":null,"spectrum_id":"CCMSLIB00017257832","spectrum_index":25298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 308.0857 Da; putative annotation: N/A; putative formula: C10H16N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.166,"smiles":null,"spectrum_id":"CCMSLIB00017257835","spectrum_index":25299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385077-01![(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)oxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate (delta mass: 162.0306 Da; putative annotation: Caffeic acid; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.159,"smiles":null,"spectrum_id":"CCMSLIB00017257838","spectrum_index":25300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE0; MS2Dec (delta mass: 129.0424 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.103,"smiles":null,"spectrum_id":"CCMSLIB00017257841","spectrum_index":25301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 108.021 Da; putative annotation: 1,2,3-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017257842","spectrum_index":25302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 111.0331 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.194,"smiles":null,"spectrum_id":"CCMSLIB00017257845","spectrum_index":25303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 176.0469 Da; putative annotation: Gibepyrone D; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.202,"smiles":null,"spectrum_id":"CCMSLIB00017257848","spectrum_index":25304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 113.0838 Da; putative annotation: NORLEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.228,"smiles":null,"spectrum_id":"CCMSLIB00017257851","spectrum_index":25305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-Ile (delta mass: 163.064 Da; putative annotation: DL-o-Tyrosine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.229,"smiles":null,"spectrum_id":"CCMSLIB00017257854","spectrum_index":25306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 122.0367 Da; putative annotation: 2-METHOXYRESORCINOL; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017257857","spectrum_index":25307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 176.0684 Da; putative annotation: D-Pinitol; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.107,"smiles":null,"spectrum_id":"CCMSLIB00017257859","spectrum_index":25308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 71.0374 Da; putative annotation: BETA-ALANINE; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.124,"smiles":null,"spectrum_id":"CCMSLIB00017257861","spectrum_index":25309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 312.21 Da; putative annotation: 21-Hydroxyprogesterone; putative formula: C21H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.333,"smiles":null,"spectrum_id":"CCMSLIB00017257864","spectrum_index":25310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 228.1153 Da; putative annotation: Leu-Asp; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.27,"smiles":null,"spectrum_id":"CCMSLIB00017257867","spectrum_index":25311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 91.0426 Da; putative annotation: 3-Aminophenol; AIF; CE10; CorrDec; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.166,"smiles":null,"spectrum_id":"CCMSLIB00017257870","spectrum_index":25312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 84.0602 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.164,"smiles":null,"spectrum_id":"CCMSLIB00017257873","spectrum_index":25313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 76.0709 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.313,"smiles":null,"spectrum_id":"CCMSLIB00017257875","spectrum_index":25314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 16.9679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.055,"smiles":null,"spectrum_id":"CCMSLIB00017257877","spectrum_index":25315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 45.0309 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.148,"smiles":null,"spectrum_id":"CCMSLIB00017257880","spectrum_index":25316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017257883","spectrum_index":25317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 40.8568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.948,"smiles":null,"spectrum_id":"CCMSLIB00017257886","spectrum_index":25318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 57.0582 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.17,"smiles":null,"spectrum_id":"CCMSLIB00017257888","spectrum_index":25319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 234.0138 Da; putative annotation: N/A; putative formula: C7H2N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.079,"smiles":null,"spectrum_id":"CCMSLIB00017257891","spectrum_index":25320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 105.0791 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.159,"smiles":null,"spectrum_id":"CCMSLIB00017257893","spectrum_index":25321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 597.4925 Da; putative annotation: N/A; putative formula: C42H63NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.564,"smiles":null,"spectrum_id":"CCMSLIB00017257896","spectrum_index":25322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 68.0262 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.107,"smiles":null,"spectrum_id":"CCMSLIB00017257899","spectrum_index":25323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 98.0354 Da; putative annotation: N/A; putative formula: CH2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.122,"smiles":null,"spectrum_id":"CCMSLIB00017257902","spectrum_index":25324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 9.984 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.133,"smiles":null,"spectrum_id":"CCMSLIB00017257905","spectrum_index":25325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 460.1617 Da; putative annotation: N/A; putative formula: C23H24N8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.248,"smiles":null,"spectrum_id":"CCMSLIB00017257908","spectrum_index":25326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 571.2276 Da; putative annotation: N/A; putative formula: C27H33N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.377,"smiles":null,"spectrum_id":"CCMSLIB00017257909","spectrum_index":25327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 831.4405 Da; putative annotation: N/A; putative formula: C44H65NO14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1012.51,"smiles":null,"spectrum_id":"CCMSLIB00017257912","spectrum_index":25328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 248.0706 Da; putative annotation: N/A; putative formula: C14H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.151,"smiles":null,"spectrum_id":"CCMSLIB00017257915","spectrum_index":25329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutaecarpine (delta mass: 319.1707 Da; putative annotation: N/A; putative formula: C18H26NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.284,"smiles":null,"spectrum_id":"CCMSLIB00017257918","spectrum_index":25330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 159.361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.5,"smiles":null,"spectrum_id":"CCMSLIB00017257921","spectrum_index":25331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 419.2295 Da; putative annotation: N/A; putative formula: C27H35NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.3,"smiles":null,"spectrum_id":"CCMSLIB00017257922","spectrum_index":25332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 75.0406 Da; putative annotation: N/A; putative formula: CH5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.122,"smiles":null,"spectrum_id":"CCMSLIB00017257925","spectrum_index":25333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 205.0376 Da; putative annotation: N/A; putative formula: C10H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.098,"smiles":null,"spectrum_id":"CCMSLIB00017257928","spectrum_index":25334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 140.0833 Da; putative annotation: N/A; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.143,"smiles":null,"spectrum_id":"CCMSLIB00017257931","spectrum_index":25335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 152.1563 Da; putative annotation: N/A; putative formula: C11H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.221,"smiles":null,"spectrum_id":"CCMSLIB00017257932","spectrum_index":25336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 18.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017257935","spectrum_index":25337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 95.0388 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.12,"smiles":null,"spectrum_id":"CCMSLIB00017257938","spectrum_index":25338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 77.0265 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.108,"smiles":null,"spectrum_id":"CCMSLIB00017257940","spectrum_index":25339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 401.1537 Da; putative annotation: N/A; putative formula: C17H28N3O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.214,"smiles":null,"spectrum_id":"CCMSLIB00017257942","spectrum_index":25340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 287.0779 Da; putative annotation: N/A; putative formula: C12H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.154,"smiles":null,"spectrum_id":"CCMSLIB00017257945","spectrum_index":25341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 164.1477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.182,"smiles":null,"spectrum_id":"CCMSLIB00017257947","spectrum_index":25342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CLE_291.1026_12.2 (delta mass: 5.0133 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.116,"smiles":null,"spectrum_id":"CCMSLIB00017257949","spectrum_index":25343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 156.0786 Da; putative annotation: N/A; putative formula: C8H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.211,"smiles":null,"spectrum_id":"CCMSLIB00017257952","spectrum_index":25344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 634.1885 Da; putative annotation: N/A; putative formula: C35H30N4O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.227,"smiles":null,"spectrum_id":"CCMSLIB00017257955","spectrum_index":25345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 535.1009 Da; putative annotation: N/A; putative formula: C21H21N5O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.161,"smiles":null,"spectrum_id":"CCMSLIB00017257957","spectrum_index":25346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 236.1257 Da; putative annotation: N/A; putative formula: C10H20O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.212,"smiles":null,"spectrum_id":"CCMSLIB00017257959","spectrum_index":25347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE-3-ACETIC ACID (delta mass: 89.0344 Da; putative annotation: N/A; putative formula: H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.1,"smiles":null,"spectrum_id":"CCMSLIB00017257962","spectrum_index":25348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 36.9949 Da; putative annotation: N/A; putative formula: C2H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.075,"smiles":null,"spectrum_id":"CCMSLIB00017257964","spectrum_index":25349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydromorphine (delta mass: 140.068 Da; putative annotation: N/A; putative formula: CH4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.227,"smiles":null,"spectrum_id":"CCMSLIB00017257966","spectrum_index":25350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3S)-3-Hydroxyleucine (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.092,"smiles":null,"spectrum_id":"CCMSLIB00017257969","spectrum_index":25351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 16.0671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.132,"smiles":null,"spectrum_id":"CCMSLIB00017257972","spectrum_index":25352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 113.0862 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.23,"smiles":null,"spectrum_id":"CCMSLIB00017257974","spectrum_index":25353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin; AIF; CE0; MS2Dec (delta mass: 223.1275 Da; putative annotation: N/A; putative formula: C6H17N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.223,"smiles":null,"spectrum_id":"CCMSLIB00017257976","spectrum_index":25354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 110.0721 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.14,"smiles":null,"spectrum_id":"CCMSLIB00017257979","spectrum_index":25355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 79.0959 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.177,"smiles":null,"spectrum_id":"CCMSLIB00017257981","spectrum_index":25356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 102.9999 Da; putative annotation: N/A; putative formula: C3H6NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.042,"smiles":null,"spectrum_id":"CCMSLIB00017257984","spectrum_index":25357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 129.0796 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.161,"smiles":null,"spectrum_id":"CCMSLIB00017257986","spectrum_index":25358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 87.0473 Da; putative annotation: N/A; putative formula: C7H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.144,"smiles":null,"spectrum_id":"CCMSLIB00017257988","spectrum_index":25359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 240.1217 Da; putative annotation: N/A; putative formula: C12H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.213,"smiles":null,"spectrum_id":"CCMSLIB00017257991","spectrum_index":25360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 163.0729 Da; putative annotation: N/A; putative formula: C4H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.18,"smiles":null,"spectrum_id":"CCMSLIB00017257994","spectrum_index":25361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 99.0318 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.102,"smiles":null,"spectrum_id":"CCMSLIB00017257995","spectrum_index":25362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 527.7 Da; putative annotation: N/A; putative formula: C13H4O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.85,"smiles":null,"spectrum_id":"CCMSLIB00017257998","spectrum_index":25363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 122.0216 Da; putative annotation: N/A; putative formula: C3H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017258001","spectrum_index":25364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 395.1819 Da; putative annotation: N/A; putative formula: C18H21N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.243,"smiles":null,"spectrum_id":"CCMSLIB00017258003","spectrum_index":25365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 779.4879 Da; putative annotation: N/A; putative formula: C33H61N15O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.559,"smiles":null,"spectrum_id":"CCMSLIB00017258005","spectrum_index":25366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Chloro-9H-carbazole (delta mass: 174.1714 Da; putative annotation: N/A; putative formula: C5H18N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.213,"smiles":null,"spectrum_id":"CCMSLIB00017258008","spectrum_index":25367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Thr (delta mass: 317.1753 Da; putative annotation: N/A; putative formula: C18H19N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.294,"smiles":null,"spectrum_id":"CCMSLIB00017258011","spectrum_index":25368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU099404 8-Hydroxyquinoline|quinolin-8-ol (delta mass: 58.0632 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017258013","spectrum_index":25369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 26.0004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017258015","spectrum_index":25370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tributyl citrate (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.233,"smiles":null,"spectrum_id":"CCMSLIB00017258018","spectrum_index":25371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 319.2357 Da; putative annotation: N/A; putative formula: C16H33NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":986.465,"smiles":null,"spectrum_id":"CCMSLIB00017258021","spectrum_index":25372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000501 5-methoxyindole-3-carbaldehyde (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017258023","spectrum_index":25373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 29.9926 Da; putative annotation: N/A; putative formula: CH2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.064,"smiles":null,"spectrum_id":"CCMSLIB00017258025","spectrum_index":25374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-carbinol CollisionEnergy:205060 (delta mass: 8.0548 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.13,"smiles":null,"spectrum_id":"CCMSLIB00017258028","spectrum_index":25375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 39.0122 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.093,"smiles":null,"spectrum_id":"CCMSLIB00017258030","spectrum_index":25376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.374,"smiles":null,"spectrum_id":"CCMSLIB00017258032","spectrum_index":25377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycyl-L-4-hydroxyproline (delta mass: 113.0836 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.171,"smiles":null,"spectrum_id":"CCMSLIB00017258035","spectrum_index":25378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 116.0463 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.221,"smiles":null,"spectrum_id":"CCMSLIB00017258038","spectrum_index":25379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 96.0213 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.087,"smiles":null,"spectrum_id":"CCMSLIB00017258040","spectrum_index":25380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 107.0581 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.118,"smiles":null,"spectrum_id":"CCMSLIB00017258043","spectrum_index":25381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 55.9409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.032,"smiles":null,"spectrum_id":"CCMSLIB00017258045","spectrum_index":25382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 59.0733 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.165,"smiles":null,"spectrum_id":"CCMSLIB00017258048","spectrum_index":25383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olaquindox (delta mass: 145.9403 Da; putative annotation: N/A; putative formula: C3H-1O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.038,"smiles":null,"spectrum_id":"CCMSLIB00017258051","spectrum_index":25384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 107.0293 Da; putative annotation: N/A; putative formula: C6H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.132,"smiles":null,"spectrum_id":"CCMSLIB00017258053","spectrum_index":25385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 64.0886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.169,"smiles":null,"spectrum_id":"CCMSLIB00017258056","spectrum_index":25386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 421.1584 Da; putative annotation: N/A; putative formula: C17H27NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.261,"smiles":null,"spectrum_id":"CCMSLIB00017258059","spectrum_index":25387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 341.142 Da; putative annotation: N/A; putative formula: C15H25N3O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.229,"smiles":null,"spectrum_id":"CCMSLIB00017258061","spectrum_index":25388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 60.0218 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.175,"smiles":null,"spectrum_id":"CCMSLIB00017258063","spectrum_index":25389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 309.1722 Da; putative annotation: N/A; putative formula: C12H27N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.263,"smiles":null,"spectrum_id":"CCMSLIB00017258066","spectrum_index":25390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 106.0593 Da; putative annotation: N/A; putative formula: H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.13,"smiles":null,"spectrum_id":"CCMSLIB00017258069","spectrum_index":25391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 92.0427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.212,"smiles":null,"spectrum_id":"CCMSLIB00017258070","spectrum_index":25392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM823401 N-Butylbenzenesulfonamide (delta mass: 41.0692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017258073","spectrum_index":25393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 57.993 Da; putative annotation: N/A; putative formula: C4H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.08,"smiles":null,"spectrum_id":"CCMSLIB00017258075","spectrum_index":25394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 70.0 eV (delta mass: 14.016 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":126.103,"smiles":null,"spectrum_id":"CCMSLIB00017258077","spectrum_index":25395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 36.0001 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.065,"smiles":null,"spectrum_id":"CCMSLIB00017258080","spectrum_index":25396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 163.0633 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.213,"smiles":null,"spectrum_id":"CCMSLIB00017258082","spectrum_index":25397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 298.1045 Da; putative annotation: N/A; putative formula: C18H20P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.143,"smiles":null,"spectrum_id":"CCMSLIB00017258084","spectrum_index":25398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 115.1001 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.212,"smiles":null,"spectrum_id":"CCMSLIB00017258087","spectrum_index":25399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 58.0532 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017258089","spectrum_index":25400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 53.1062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.202,"smiles":null,"spectrum_id":"CCMSLIB00017258091","spectrum_index":25401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 153.1512 Da; putative annotation: N/A; putative formula: C10H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.3,"smiles":null,"spectrum_id":"CCMSLIB00017258094","spectrum_index":25402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 120.0416 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.102,"smiles":null,"spectrum_id":"CCMSLIB00017258096","spectrum_index":25403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 427.1332 Da; putative annotation: N/A; putative formula: C16H29NO8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.204,"smiles":null,"spectrum_id":"CCMSLIB00017258098","spectrum_index":25404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 416.1381 Da; putative annotation: N/A; putative formula: C25H24N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.197,"smiles":null,"spectrum_id":"CCMSLIB00017258100","spectrum_index":25405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(4-Methoxyphenyl)ethyl]-3-methyl-2-butenamide (delta mass: 95.0364 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.185,"smiles":null,"spectrum_id":"CCMSLIB00017258103","spectrum_index":25406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 303.1596 Da; putative annotation: N/A; putative formula: C17H17N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.287,"smiles":null,"spectrum_id":"CCMSLIB00017258104","spectrum_index":25407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 46.0059 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.207,"smiles":null,"spectrum_id":"CCMSLIB00017258107","spectrum_index":25408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 9.9901 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.029,"smiles":null,"spectrum_id":"CCMSLIB00017258109","spectrum_index":25409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxo-1,2-dihydro-quinoline-3,4-dicarboxylic acid (delta mass: 27.9941 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.034,"smiles":null,"spectrum_id":"CCMSLIB00017258111","spectrum_index":25410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one (delta mass: 169.1029 Da; putative annotation: N/A; putative formula: C8H15N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.196,"smiles":null,"spectrum_id":"CCMSLIB00017258114","spectrum_index":25411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 319.3085 Da; putative annotation: N/A; putative formula: C19H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.389,"smiles":null,"spectrum_id":"CCMSLIB00017258117","spectrum_index":25412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 341.1164 Da; putative annotation: N/A; putative formula: C21H15N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.183,"smiles":null,"spectrum_id":"CCMSLIB00017258118","spectrum_index":25413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 128.1028 Da; putative annotation: N/A; putative formula: C8H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.198,"smiles":null,"spectrum_id":"CCMSLIB00017258121","spectrum_index":25414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Chloro-2-hydroxy-4-phenyl-3-quinolinyl)acetic acid (delta mass: 32.034 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.092,"smiles":null,"spectrum_id":"CCMSLIB00017258124","spectrum_index":25415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 86.0004 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.066,"smiles":null,"spectrum_id":"CCMSLIB00017258126","spectrum_index":25416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Met (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.085,"smiles":null,"spectrum_id":"CCMSLIB00017258129","spectrum_index":25417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatinine (delta mass: 157.1334 Da; putative annotation: N/A; putative formula: C6H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.2,"smiles":null,"spectrum_id":"CCMSLIB00017258130","spectrum_index":25418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 59.0356 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.127,"smiles":null,"spectrum_id":"CCMSLIB00017258133","spectrum_index":25419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 343.0523 Da; putative annotation: N/A; putative formula: C18H17NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.176,"smiles":null,"spectrum_id":"CCMSLIB00017258136","spectrum_index":25420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 522.1712 Da; putative annotation: N/A; putative formula: C29H30O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1027.35,"smiles":null,"spectrum_id":"CCMSLIB00017258137","spectrum_index":25421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 31.0407 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.111,"smiles":null,"spectrum_id":"CCMSLIB00017258140","spectrum_index":25422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 720.2564 Da; putative annotation: N/A; putative formula: C55H32N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":858.348,"smiles":null,"spectrum_id":"CCMSLIB00017258143","spectrum_index":25423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Aminomethyl)benzoic acid (delta mass: 50.0266 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.097,"smiles":null,"spectrum_id":"CCMSLIB00017258144","spectrum_index":25424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 168.997 Da; putative annotation: N/A; putative formula: C4H4N5O-1PS)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.057,"smiles":null,"spectrum_id":"CCMSLIB00017258147","spectrum_index":25425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 28.0314 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.139,"smiles":null,"spectrum_id":"CCMSLIB00017258149","spectrum_index":25426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 126.0378 Da; putative annotation: N/A; putative formula: C4H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.197,"smiles":null,"spectrum_id":"CCMSLIB00017258151","spectrum_index":25427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]- (delta mass: 18.0201 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.213,"smiles":null,"spectrum_id":"CCMSLIB00017258154","spectrum_index":25428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 120.0415 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.201,"smiles":null,"spectrum_id":"CCMSLIB00017258156","spectrum_index":25429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Isopropyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid (delta mass: 126.1042 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.248,"smiles":null,"spectrum_id":"CCMSLIB00017258159","spectrum_index":25430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 634.4769 Da; putative annotation: N/A; putative formula: C35H71O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.568,"smiles":null,"spectrum_id":"CCMSLIB00017258161","spectrum_index":25431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 519.4311 Da; putative annotation: N/A; putative formula: C31H58N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.502,"smiles":null,"spectrum_id":"CCMSLIB00017258163","spectrum_index":25432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 32.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.101,"smiles":null,"spectrum_id":"CCMSLIB00017258166","spectrum_index":25433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 112.052 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.138,"smiles":null,"spectrum_id":"CCMSLIB00017258168","spectrum_index":25434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 270.0529 Da; putative annotation: N/A; putative formula: C8H18N2O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.124,"smiles":null,"spectrum_id":"CCMSLIB00017258170","spectrum_index":25435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 123.0743 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.138,"smiles":null,"spectrum_id":"CCMSLIB00017258172","spectrum_index":25436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 447.2466 Da; putative annotation: N/A; putative formula: C21H37NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.307,"smiles":null,"spectrum_id":"CCMSLIB00017258175","spectrum_index":25437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 187.084 Da; putative annotation: N/A; putative formula: C8H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.17,"smiles":null,"spectrum_id":"CCMSLIB00017258177","spectrum_index":25438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 286.2288 Da; putative annotation: N/A; putative formula: C14H31N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.282,"smiles":null,"spectrum_id":"CCMSLIB00017258180","spectrum_index":25439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 75.0207 Da; putative annotation: N/A; putative formula: C4HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.086,"smiles":null,"spectrum_id":"CCMSLIB00017258183","spectrum_index":25440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 26.0255 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.096,"smiles":null,"spectrum_id":"CCMSLIB00017258186","spectrum_index":25441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 272.1002 Da; putative annotation: N/A; putative formula: C13H21O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.197,"smiles":null,"spectrum_id":"CCMSLIB00017258187","spectrum_index":25442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 582.3919 Da; putative annotation: N/A; putative formula: C36H54O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.452,"smiles":null,"spectrum_id":"CCMSLIB00017258190","spectrum_index":25443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 424.3697 Da; putative annotation: N/A; putative formula: C24H49N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.555,"smiles":null,"spectrum_id":"CCMSLIB00017258193","spectrum_index":25444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 300.1724 Da; putative annotation: N/A; putative formula: C19H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.243,"smiles":null,"spectrum_id":"CCMSLIB00017258195","spectrum_index":25445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 89.0628 Da; putative annotation: N/A; putative formula: C7H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.144,"smiles":null,"spectrum_id":"CCMSLIB00017258197","spectrum_index":25446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 58.029 Da; putative annotation: N/A; putative formula: H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.163,"smiles":null,"spectrum_id":"CCMSLIB00017258200","spectrum_index":25447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 36.0359 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.09,"smiles":null,"spectrum_id":"CCMSLIB00017258203","spectrum_index":25448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 84.003 Da; putative annotation: N/A; putative formula: C4H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.078,"smiles":null,"spectrum_id":"CCMSLIB00017258205","spectrum_index":25449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 60.011 Da; putative annotation: N/A; putative formula: C4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.983,"smiles":null,"spectrum_id":"CCMSLIB00017258207","spectrum_index":25450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000697723-01! (delta mass: 90.0674 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.185,"smiles":null,"spectrum_id":"CCMSLIB00017258210","spectrum_index":25451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminoquinoline (delta mass: 15.996 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.072,"smiles":null,"spectrum_id":"CCMSLIB00017258212","spectrum_index":25452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 52.0564 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.121,"smiles":null,"spectrum_id":"CCMSLIB00017258215","spectrum_index":25453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 536.3892 Da; putative annotation: N/A; putative formula: C34H53N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.428,"smiles":null,"spectrum_id":"CCMSLIB00017258217","spectrum_index":25454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 87.0684 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.207,"smiles":null,"spectrum_id":"CCMSLIB00017258220","spectrum_index":25455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 23.0159 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.086,"smiles":null,"spectrum_id":"CCMSLIB00017258222","spectrum_index":25456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 216.1515 Da; putative annotation: Valerenic acid; putative formula: C15H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.222,"smiles":null,"spectrum_id":"CCMSLIB00017258224","spectrum_index":25457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 170.0513 Da; putative annotation: 8-Hydroxyquinoline-2-carboxamide; putative formula: C10H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.133,"smiles":null,"spectrum_id":"CCMSLIB00017258226","spectrum_index":25458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ARABITOL (delta mass: 71.0373 Da; putative annotation: beta-alanine CollisionEnergy:102040; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.113,"smiles":null,"spectrum_id":"CCMSLIB00017258229","spectrum_index":25459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 226.0631 Da; putative annotation: Massbank:FIO00599 Eleutherol; putative formula: C14H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.154,"smiles":null,"spectrum_id":"CCMSLIB00017258231","spectrum_index":25460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 135.0321 Da; putative annotation: 3-AMINO-4-HYDROXYBENZOATE; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.103,"smiles":null,"spectrum_id":"CCMSLIB00017258233","spectrum_index":25461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 113.0477 Da; putative annotation: (3R)-3-Hydroxy-L-proline; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017258236","spectrum_index":25462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 290.224 Da; putative annotation: Androstane-3,6,17-triol; putative formula: C19H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.347,"smiles":null,"spectrum_id":"CCMSLIB00017258239","spectrum_index":25463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 132.0561 Da; putative annotation: (2S,3S)-(-)-3-Phenylglycidol; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.117,"smiles":null,"spectrum_id":"CCMSLIB00017258240","spectrum_index":25464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 808.4243 Da; putative annotation: NCGC00380730-01_C42H66O16_beta-D-Glucopyranose, 6-O-beta-D-glucopyranosyl-1-O-[(3beta,5xi,9xi)-3,19,24-trihydroxy-24,28-dioxours-12-en-28-yl]-; putative formula: C42H64O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":989.495,"smiles":null,"spectrum_id":"CCMSLIB00017258243","spectrum_index":25465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 83.037 Da; putative annotation: L-Homoserine lactone; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017258246","spectrum_index":25466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 684.3652 Da; putative annotation: N/A; putative formula: C36H53N4O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.446,"smiles":null,"spectrum_id":"CCMSLIB00017258248","spectrum_index":25467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 154.0993 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.18,"smiles":null,"spectrum_id":"CCMSLIB00017258250","spectrum_index":25468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 18.0238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.121,"smiles":null,"spectrum_id":"CCMSLIB00017258253","spectrum_index":25469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169534-02_C14H18O9_Ethanone, 1-[4-(beta-D-glucopyranosyloxy)-2,6-dihydroxyphenyl]- (delta mass: 116.047 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.149,"smiles":null,"spectrum_id":"CCMSLIB00017258255","spectrum_index":25470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 751.3525 Da; putative annotation: N/A; putative formula: C49H45N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.466,"smiles":null,"spectrum_id":"CCMSLIB00017258257","spectrum_index":25471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxy-2-methylindole-3-carboxylic acid CollisionEnergy:102040 (delta mass: 185.0675 Da; putative annotation: N/A; putative formula: C12H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.133,"smiles":null,"spectrum_id":"CCMSLIB00017258260","spectrum_index":25472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 179.0792 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.332,"smiles":null,"spectrum_id":"CCMSLIB00017258262","spectrum_index":25473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 77.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.228,"smiles":null,"spectrum_id":"CCMSLIB00017258265","spectrum_index":25474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 248.2129 Da; putative annotation: N/A; putative formula: C17H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.325,"smiles":null,"spectrum_id":"CCMSLIB00017258267","spectrum_index":25475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 453.1483 Da; putative annotation: N/A; putative formula: C23H19N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.219,"smiles":null,"spectrum_id":"CCMSLIB00017258270","spectrum_index":25476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 72.042 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.185,"smiles":null,"spectrum_id":"CCMSLIB00017258272","spectrum_index":25477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 58.5633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.623,"smiles":null,"spectrum_id":"CCMSLIB00017258275","spectrum_index":25478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 90.083 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.169,"smiles":null,"spectrum_id":"CCMSLIB00017258278","spectrum_index":25479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-6-ol, 1-(4-methoxyphenyl)-2-methyl-3-nitro- (delta mass: 18.1074 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.21,"smiles":null,"spectrum_id":"CCMSLIB00017258279","spectrum_index":25480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 957.4936 Da; putative annotation: N/A; putative formula: C61H71N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1138.56,"smiles":null,"spectrum_id":"CCMSLIB00017258282","spectrum_index":25481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 955.4774 Da; putative annotation: N/A; putative formula: C45H69N11O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1136.55,"smiles":null,"spectrum_id":"CCMSLIB00017258285","spectrum_index":25482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 142.0656 Da; putative annotation: N/A; putative formula: C6H11N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.189,"smiles":null,"spectrum_id":"CCMSLIB00017258286","spectrum_index":25483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 372.1603 Da; putative annotation: N/A; putative formula: C21H24O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.325,"smiles":null,"spectrum_id":"CCMSLIB00017258289","spectrum_index":25484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C5:0 (delta mass: 185.1765 Da; putative annotation: N/A; putative formula: C7H19N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.32,"smiles":null,"spectrum_id":"CCMSLIB00017258292","spectrum_index":25485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 380.0854 Da; putative annotation: N/A; putative formula: C16H16N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.156,"smiles":null,"spectrum_id":"CCMSLIB00017258293","spectrum_index":25486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 169.095 Da; putative annotation: N/A; putative formula: C6H11N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.134,"smiles":null,"spectrum_id":"CCMSLIB00017258296","spectrum_index":25487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 87.1048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.217,"smiles":null,"spectrum_id":"CCMSLIB00017258297","spectrum_index":25488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-yl)ethanamine (delta mass: 127.0774 Da; putative annotation: N/A; putative formula: C10H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017258300","spectrum_index":25489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 382.1494 Da; putative annotation: N/A; putative formula: C17H34OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.278,"smiles":null,"spectrum_id":"CCMSLIB00017258302","spectrum_index":25490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 302.1733 Da; putative annotation: N/A; putative formula: C15H26O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.228,"smiles":null,"spectrum_id":"CCMSLIB00017258304","spectrum_index":25491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 168.1534 Da; putative annotation: N/A; putative formula: C11H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.258,"smiles":null,"spectrum_id":"CCMSLIB00017258307","spectrum_index":25492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kainic Acid (delta mass: 129.0464 Da; putative annotation: N/A; putative formula: C4H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.154,"smiles":null,"spectrum_id":"CCMSLIB00017258309","spectrum_index":25493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 41.324 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.405,"smiles":null,"spectrum_id":"CCMSLIB00017258311","spectrum_index":25494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 288.0848 Da; putative annotation: N/A; putative formula: C15H17N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.15,"smiles":null,"spectrum_id":"CCMSLIB00017258314","spectrum_index":25495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 124.0511 Da; putative annotation: N/A; putative formula: C3H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.163,"smiles":null,"spectrum_id":"CCMSLIB00017258317","spectrum_index":25496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 359.1305 Da; putative annotation: N/A; putative formula: C18H21N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.171,"smiles":null,"spectrum_id":"CCMSLIB00017258318","spectrum_index":25497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 67.021 Da; putative annotation: N/A; putative formula: C2HN3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.112,"smiles":null,"spectrum_id":"CCMSLIB00017258321","spectrum_index":25498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxybutanamide CollisionEnergy:102040\"\" (delta mass: 19.0781 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.232,"smiles":null,"spectrum_id":"CCMSLIB00017258324","spectrum_index":25499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 16.0693 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.174,"smiles":null,"spectrum_id":"CCMSLIB00017258325","spectrum_index":25500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 38.0497 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.292,"smiles":null,"spectrum_id":"CCMSLIB00017258328","spectrum_index":25501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 206.0885 Da; putative annotation: N/A; putative formula: C4H6N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.116,"smiles":null,"spectrum_id":"CCMSLIB00017258331","spectrum_index":25502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 193.0571 Da; putative annotation: N/A; putative formula: C3H3N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.122,"smiles":null,"spectrum_id":"CCMSLIB00017258332","spectrum_index":25503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 27.9955 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.128,"smiles":null,"spectrum_id":"CCMSLIB00017258335","spectrum_index":25504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 197.2351 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.374,"smiles":null,"spectrum_id":"CCMSLIB00017258337","spectrum_index":25505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 573.2099 Da; putative annotation: N/A; putative formula: C36H27N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.251,"smiles":null,"spectrum_id":"CCMSLIB00017258340","spectrum_index":25506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 303.277 Da; putative annotation: N/A; putative formula: C18H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.337,"smiles":null,"spectrum_id":"CCMSLIB00017258342","spectrum_index":25507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 63.0324 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.186,"smiles":null,"spectrum_id":"CCMSLIB00017258344","spectrum_index":25508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2,2,2-trifluoroethanamine (delta mass: 30.9945 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.078,"smiles":null,"spectrum_id":"CCMSLIB00017258347","spectrum_index":25509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 126.0424 Da; putative annotation: N/A; putative formula: C5H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.129,"smiles":null,"spectrum_id":"CCMSLIB00017258349","spectrum_index":25510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 172.0194 Da; putative annotation: N/A; putative formula: C7H8O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.054,"smiles":null,"spectrum_id":"CCMSLIB00017258351","spectrum_index":25511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 401.2066 Da; putative annotation: N/A; putative formula: C20H27N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.277,"smiles":null,"spectrum_id":"CCMSLIB00017258354","spectrum_index":25512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 537.3507 Da; putative annotation: N/A; putative formula: C39H43N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.421,"smiles":null,"spectrum_id":"CCMSLIB00017258357","spectrum_index":25513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 835.383 Da; putative annotation: N/A; putative formula: C37H60N9O7P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1016.45,"smiles":null,"spectrum_id":"CCMSLIB00017258358","spectrum_index":25514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 122.0368 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.102,"smiles":null,"spectrum_id":"CCMSLIB00017258361","spectrum_index":25515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 114.0466 Da; putative annotation: N/A; putative formula: C9H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.122,"smiles":null,"spectrum_id":"CCMSLIB00017258362","spectrum_index":25516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 170.0946 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.154,"smiles":null,"spectrum_id":"CCMSLIB00017258365","spectrum_index":25517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 60.0432 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.181,"smiles":null,"spectrum_id":"CCMSLIB00017258368","spectrum_index":25518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 18.0034 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.048,"smiles":null,"spectrum_id":"CCMSLIB00017258369","spectrum_index":25519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 368.1474 Da; putative annotation: N/A; putative formula: C13H21N8O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.186,"smiles":null,"spectrum_id":"CCMSLIB00017258372","spectrum_index":25520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 126.0608 Da; putative annotation: N/A; putative formula: C6H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.137,"smiles":null,"spectrum_id":"CCMSLIB00017258374","spectrum_index":25521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 96.0276 Da; putative annotation: N/A; putative formula: N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.145,"smiles":null,"spectrum_id":"CCMSLIB00017258376","spectrum_index":25522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 90.0103 Da; putative annotation: N/A; putative formula: C6H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017258379","spectrum_index":25523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 150.0855 Da; putative annotation: N/A; putative formula: C2H10N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.128,"smiles":null,"spectrum_id":"CCMSLIB00017258381","spectrum_index":25524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 256.1549 Da; putative annotation: N/A; putative formula: C12H16N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.309,"smiles":null,"spectrum_id":"CCMSLIB00017258384","spectrum_index":25525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 344.1086 Da; putative annotation: N/A; putative formula: C13H23N4OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.258,"smiles":null,"spectrum_id":"CCMSLIB00017258386","spectrum_index":25526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-(propylthio)phenylethylamine (delta mass: 18.1114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.248,"smiles":null,"spectrum_id":"CCMSLIB00017258388","spectrum_index":25527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 43.0059 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.15,"smiles":null,"spectrum_id":"CCMSLIB00017258391","spectrum_index":25528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 263.2807 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.363,"smiles":null,"spectrum_id":"CCMSLIB00017258394","spectrum_index":25529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 131.0947 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.176,"smiles":null,"spectrum_id":"CCMSLIB00017258395","spectrum_index":25530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 159.0896 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.202,"smiles":null,"spectrum_id":"CCMSLIB00017258398","spectrum_index":25531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 179.0795 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.145,"smiles":null,"spectrum_id":"CCMSLIB00017258399","spectrum_index":25532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 38.9527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.06,"smiles":null,"spectrum_id":"CCMSLIB00017258402","spectrum_index":25533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Glu (delta mass: 113.0839 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.219,"smiles":null,"spectrum_id":"CCMSLIB00017258404","spectrum_index":25534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 273.9403 Da; putative annotation: N/A; putative formula: C13H6O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.011,"smiles":null,"spectrum_id":"CCMSLIB00017258407","spectrum_index":25535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 367.3456 Da; putative annotation: N/A; putative formula: C23H45NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.458,"smiles":null,"spectrum_id":"CCMSLIB00017258409","spectrum_index":25536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 230.6193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.706,"smiles":null,"spectrum_id":"CCMSLIB00017258412","spectrum_index":25537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 157.0375 Da; putative annotation: N/A; putative formula: C6H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.108,"smiles":null,"spectrum_id":"CCMSLIB00017258414","spectrum_index":25538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(6-Methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-furaldehyde (delta mass: 252.0323 Da; putative annotation: N/A; putative formula: C9H8N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.081,"smiles":null,"spectrum_id":"CCMSLIB00017258417","spectrum_index":25539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-1H-indole-5-carbonitrile (delta mass: 60.0217 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.077,"smiles":null,"spectrum_id":"CCMSLIB00017258418","spectrum_index":25540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 146.0576 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.208,"smiles":null,"spectrum_id":"CCMSLIB00017258421","spectrum_index":25541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 143.0251 Da; putative annotation: N/A; putative formula: C4H6N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.158,"smiles":null,"spectrum_id":"CCMSLIB00017258424","spectrum_index":25542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 400.2136 Da; putative annotation: N/A; putative formula: C20H29N6OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.347,"smiles":null,"spectrum_id":"CCMSLIB00017258425","spectrum_index":25543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 317.2082 Da; putative annotation: N/A; putative formula: C14H23N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.331,"smiles":null,"spectrum_id":"CCMSLIB00017258428","spectrum_index":25544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 162.0509 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.088,"smiles":null,"spectrum_id":"CCMSLIB00017258429","spectrum_index":25545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 94.9772 Da; putative annotation: N/A; putative formula: H2NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.042,"smiles":null,"spectrum_id":"CCMSLIB00017258432","spectrum_index":25546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Miglitol (delta mass: 28.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.128,"smiles":null,"spectrum_id":"CCMSLIB00017258435","spectrum_index":25547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 136.0503 Da; putative annotation: N/A; putative formula: C4H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.115,"smiles":null,"spectrum_id":"CCMSLIB00017258436","spectrum_index":25548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 265.1313 Da; putative annotation: N/A; putative formula: C14H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.202,"smiles":null,"spectrum_id":"CCMSLIB00017258439","spectrum_index":25549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 257.1475 Da; putative annotation: N/A; putative formula: C12H24N3O-1PS)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.218,"smiles":null,"spectrum_id":"CCMSLIB00017258442","spectrum_index":25550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 172.0852 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.156,"smiles":null,"spectrum_id":"CCMSLIB00017258444","spectrum_index":25551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 186.1007 Da; putative annotation: N/A; putative formula: C8H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.171,"smiles":null,"spectrum_id":"CCMSLIB00017258446","spectrum_index":25552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 174.0644 Da; putative annotation: N/A; putative formula: C6H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.219,"smiles":null,"spectrum_id":"CCMSLIB00017258448","spectrum_index":25553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 240.1731 Da; putative annotation: N/A; putative formula: C14H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.21,"smiles":null,"spectrum_id":"CCMSLIB00017258451","spectrum_index":25554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 160.2438 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.278,"smiles":null,"spectrum_id":"CCMSLIB00017258453","spectrum_index":25555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 301.1973 Da; putative annotation: N/A; putative formula: C10H23N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.321,"smiles":null,"spectrum_id":"CCMSLIB00017258455","spectrum_index":25556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Camalexin (delta mass: 83.0801 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.128,"smiles":null,"spectrum_id":"CCMSLIB00017258458","spectrum_index":25557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 16.0315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.154,"smiles":null,"spectrum_id":"CCMSLIB00017258459","spectrum_index":25558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 287.283 Da; putative annotation: N/A; putative formula: C13H33N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.364,"smiles":null,"spectrum_id":"CCMSLIB00017258462","spectrum_index":25559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 190.171 Da; putative annotation: N/A; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.231,"smiles":null,"spectrum_id":"CCMSLIB00017258465","spectrum_index":25560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 112.0518 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.143,"smiles":null,"spectrum_id":"CCMSLIB00017258466","spectrum_index":25561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 15.1051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.274,"smiles":null,"spectrum_id":"CCMSLIB00017258469","spectrum_index":25562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N2,N4-Diethyl-6-hydrazino-1,3,5-triazine-2,4-diamine (delta mass: 17.0279 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.174,"smiles":null,"spectrum_id":"CCMSLIB00017258471","spectrum_index":25563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 323.9028 Da; putative annotation: N/A; putative formula: C12H4O3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.0,"smiles":null,"spectrum_id":"CCMSLIB00017258473","spectrum_index":25564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 325.1382 Da; putative annotation: N/A; putative formula: C13H27NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.25,"smiles":null,"spectrum_id":"CCMSLIB00017258476","spectrum_index":25565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 357.1268 Da; putative annotation: N/A; putative formula: C25H15N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.198,"smiles":null,"spectrum_id":"CCMSLIB00017258478","spectrum_index":25566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 229.0324 Da; putative annotation: N/A; putative formula: C9H12NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.097,"smiles":null,"spectrum_id":"CCMSLIB00017258481","spectrum_index":25567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 232.1314 Da; putative annotation: N/A; putative formula: C11H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.202,"smiles":null,"spectrum_id":"CCMSLIB00017258483","spectrum_index":25568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 162.0271 Da; putative annotation: N/A; putative formula: C6H11OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.108,"smiles":null,"spectrum_id":"CCMSLIB00017258485","spectrum_index":25569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 169.1109 Da; putative annotation: N/A; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.203,"smiles":null,"spectrum_id":"CCMSLIB00017258488","spectrum_index":25570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 480.0791 Da; putative annotation: N/A; putative formula: C28H20N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.12,"smiles":null,"spectrum_id":"CCMSLIB00017258490","spectrum_index":25571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 209.0904 Da; putative annotation: N/A; putative formula: C7H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.244,"smiles":null,"spectrum_id":"CCMSLIB00017258492","spectrum_index":25572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 511.2787 Da; putative annotation: N/A; putative formula: C29H42N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.349,"smiles":null,"spectrum_id":"CCMSLIB00017258495","spectrum_index":25573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 615.414 Da; putative annotation: N/A; putative formula: C37H61NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.485,"smiles":null,"spectrum_id":"CCMSLIB00017258497","spectrum_index":25574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 158.0182 Da; putative annotation: N/A; putative formula: C4H7N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.172,"smiles":null,"spectrum_id":"CCMSLIB00017258499","spectrum_index":25575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 635.281 Da; putative annotation: N/A; putative formula: C30H45N5O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.341,"smiles":null,"spectrum_id":"CCMSLIB00017258502","spectrum_index":25576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 247.2061 Da; putative annotation: N/A; putative formula: C15H25N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.303,"smiles":null,"spectrum_id":"CCMSLIB00017258504","spectrum_index":25577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 381.2482 Da; putative annotation: N/A; putative formula: C17H31N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.319,"smiles":null,"spectrum_id":"CCMSLIB00017258506","spectrum_index":25578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 28.0703 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.13,"smiles":null,"spectrum_id":"CCMSLIB00017258509","spectrum_index":25579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NALOXONE (delta mass: 245.0803 Da; putative annotation: N/A; putative formula: C12H11N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.235,"smiles":null,"spectrum_id":"CCMSLIB00017258511","spectrum_index":25580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 114.9928 Da; putative annotation: N/A; putative formula: C2H2N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.053,"smiles":null,"spectrum_id":"CCMSLIB00017258514","spectrum_index":25581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 1084.7749 Da; putative annotation: N/A; putative formula: C59H108N2O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1468.92,"smiles":null,"spectrum_id":"CCMSLIB00017258515","spectrum_index":25582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 430.1879 Da; putative annotation: N/A; putative formula: C20H35N2O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.259,"smiles":null,"spectrum_id":"CCMSLIB00017258518","spectrum_index":25583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 225.043 Da; putative annotation: N/A; putative formula: C6H7N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.155,"smiles":null,"spectrum_id":"CCMSLIB00017258521","spectrum_index":25584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 16.0157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.175,"smiles":null,"spectrum_id":"CCMSLIB00017258522","spectrum_index":25585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 96.0685 Da; putative annotation: N/A; putative formula: C5H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.149,"smiles":null,"spectrum_id":"CCMSLIB00017258525","spectrum_index":25586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNT (delta mass: 17.0285 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.284,"smiles":null,"spectrum_id":"CCMSLIB00017258528","spectrum_index":25587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 129.0394 Da; putative annotation: N/A; putative formula: CH3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.11,"smiles":null,"spectrum_id":"CCMSLIB00017258529","spectrum_index":25588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 85.2148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.242,"smiles":null,"spectrum_id":"CCMSLIB00017258532","spectrum_index":25589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[3-[3-Hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxyphenyl]-5-oxo-2H-furan-2-yl]acetic acid (delta mass: 60.0155 Da; putative annotation: N/A; putative formula: CH4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.123,"smiles":null,"spectrum_id":"CCMSLIB00017258535","spectrum_index":25590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 191.1734 Da; putative annotation: N/A; putative formula: C3H17N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.254,"smiles":null,"spectrum_id":"CCMSLIB00017258536","spectrum_index":25591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 281.1793 Da; putative annotation: N/A; putative formula: C12H23N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.359,"smiles":null,"spectrum_id":"CCMSLIB00017258539","spectrum_index":25592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 97.0487 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.202,"smiles":null,"spectrum_id":"CCMSLIB00017258541","spectrum_index":25593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 260.0897 Da; putative annotation: N/A; putative formula: C11H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.165,"smiles":null,"spectrum_id":"CCMSLIB00017258544","spectrum_index":25594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 172.0974 Da; putative annotation: N/A; putative formula: C6H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.134,"smiles":null,"spectrum_id":"CCMSLIB00017258546","spectrum_index":25595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 159.0566 Da; putative annotation: N/A; putative formula: C5H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.158,"smiles":null,"spectrum_id":"CCMSLIB00017258549","spectrum_index":25596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 53.0718 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017258550","spectrum_index":25597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 93.058 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.118,"smiles":null,"spectrum_id":"CCMSLIB00017258553","spectrum_index":25598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 163.0465 Da; putative annotation: N/A; putative formula: C2HN11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.164,"smiles":null,"spectrum_id":"CCMSLIB00017258556","spectrum_index":25599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 795.4338 Da; putative annotation: N/A; putative formula: C32H61N9O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1122.56,"smiles":null,"spectrum_id":"CCMSLIB00017258558","spectrum_index":25600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 179.0765 Da; putative annotation: N/A; putative formula: C10H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.147,"smiles":null,"spectrum_id":"CCMSLIB00017258560","spectrum_index":25601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 78.0569 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.164,"smiles":null,"spectrum_id":"CCMSLIB00017258563","spectrum_index":25602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 868.5554 Da; putative annotation: N/A; putative formula: C61H68N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.67,"smiles":null,"spectrum_id":"CCMSLIB00017258566","spectrum_index":25603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 59.0618 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.144,"smiles":null,"spectrum_id":"CCMSLIB00017258569","spectrum_index":25604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 154.0808 Da; putative annotation: N/A; putative formula: C9H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.188,"smiles":null,"spectrum_id":"CCMSLIB00017258570","spectrum_index":25605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 276.2315 Da; putative annotation: N/A; putative formula: C16H28N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.312,"smiles":null,"spectrum_id":"CCMSLIB00017258573","spectrum_index":25606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 306.1393 Da; putative annotation: N/A; putative formula: C18H19N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.21,"smiles":null,"spectrum_id":"CCMSLIB00017258574","spectrum_index":25607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 167.0796 Da; putative annotation: N/A; putative formula: C6H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.161,"smiles":null,"spectrum_id":"CCMSLIB00017258577","spectrum_index":25608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 63.9235 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.083,"smiles":null,"spectrum_id":"CCMSLIB00017258579","spectrum_index":25609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 383.2511 Da; putative annotation: N/A; putative formula: C22H33N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.311,"smiles":null,"spectrum_id":"CCMSLIB00017258581","spectrum_index":25610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 200.0685 Da; putative annotation: N/A; putative formula: C9H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.108,"smiles":null,"spectrum_id":"CCMSLIB00017258584","spectrum_index":25611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 113.0793 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.17,"smiles":null,"spectrum_id":"CCMSLIB00017258587","spectrum_index":25612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 68.0672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.163,"smiles":null,"spectrum_id":"CCMSLIB00017258589","spectrum_index":25613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine; AIF; CE0; MS2Dec (delta mass: 116.0128 Da; putative annotation: N/A; putative formula: C5N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.11,"smiles":null,"spectrum_id":"CCMSLIB00017258591","spectrum_index":25614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 201.0787 Da; putative annotation: N/A; putative formula: C12H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.154,"smiles":null,"spectrum_id":"CCMSLIB00017258594","spectrum_index":25615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 89.9953 Da; putative annotation: N/A; putative formula: C2H2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.123,"smiles":null,"spectrum_id":"CCMSLIB00017258596","spectrum_index":25616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 76.0522 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.122,"smiles":null,"spectrum_id":"CCMSLIB00017258598","spectrum_index":25617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 92.01 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.07,"smiles":null,"spectrum_id":"CCMSLIB00017258601","spectrum_index":25618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 9.0232 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.203,"smiles":null,"spectrum_id":"CCMSLIB00017258603","spectrum_index":25619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 48.0364 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017258605","spectrum_index":25620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 312.1427 Da; putative annotation: N/A; putative formula: C23H21O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.234,"smiles":null,"spectrum_id":"CCMSLIB00017258608","spectrum_index":25621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 46.0273 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.15,"smiles":null,"spectrum_id":"CCMSLIB00017258611","spectrum_index":25622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 266.0949 Da; putative annotation: N/A; putative formula: C17H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.155,"smiles":null,"spectrum_id":"CCMSLIB00017258613","spectrum_index":25623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 164.1202 Da; putative annotation: N/A; putative formula: C11H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.201,"smiles":null,"spectrum_id":"CCMSLIB00017258615","spectrum_index":25624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 28.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.118,"smiles":null,"spectrum_id":"CCMSLIB00017258618","spectrum_index":25625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 245.1774 Da; putative annotation: N/A; putative formula: C16H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.284,"smiles":null,"spectrum_id":"CCMSLIB00017258620","spectrum_index":25626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 60.5294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.6,"smiles":null,"spectrum_id":"CCMSLIB00017258622","spectrum_index":25627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 290.1092 Da; putative annotation: N/A; putative formula: C15H18N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.15,"smiles":null,"spectrum_id":"CCMSLIB00017258625","spectrum_index":25628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16,26,27-trimethoxy-7,22-dimethyl-29,31-dioxa-7,22-diazaoctacyclo[19.9.3.1?,?.1?,?.1?,?.0,?.0?,.0?,]hexatriaconta-1,3,10,12,14(36),15(35),16,18,25(33),26,28(32),30(34)-dodecaen-13-ol (delta mass: 606.2933 Da; putative annotation: N/A; putative formula: C26H46N4O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1213.57,"smiles":null,"spectrum_id":"CCMSLIB00017258627","spectrum_index":25629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of galanthamine (delta mass: 62.0017 Da; putative annotation: N/A; putative formula: C2H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.161,"smiles":null,"spectrum_id":"CCMSLIB00017258629","spectrum_index":25630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 89.0839 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.155,"smiles":null,"spectrum_id":"CCMSLIB00017258632","spectrum_index":25631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 150.0697 Da; putative annotation: N/A; putative formula: C8H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.156,"smiles":null,"spectrum_id":"CCMSLIB00017258635","spectrum_index":25632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 23.9993 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.045,"smiles":null,"spectrum_id":"CCMSLIB00017258636","spectrum_index":25633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 346.1526 Da; putative annotation: N/A; putative formula: C18H22N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.213,"smiles":null,"spectrum_id":"CCMSLIB00017258639","spectrum_index":25634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 215.116 Da; putative annotation: N/A; putative formula: C10H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.187,"smiles":null,"spectrum_id":"CCMSLIB00017258642","spectrum_index":25635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 99.0936 Da; putative annotation: N/A; putative formula: C3H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.253,"smiles":null,"spectrum_id":"CCMSLIB00017258643","spectrum_index":25636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cinchonine (delta mass: 42.056 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.237,"smiles":null,"spectrum_id":"CCMSLIB00017258646","spectrum_index":25637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 61.0403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.215,"smiles":null,"spectrum_id":"CCMSLIB00017258649","spectrum_index":25638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phthalyl-L-tryptophan (delta mass: 18.0084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.111,"smiles":null,"spectrum_id":"CCMSLIB00017258651","spectrum_index":25639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 211.142 Da; putative annotation: N/A; putative formula: C9H17N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.197,"smiles":null,"spectrum_id":"CCMSLIB00017258653","spectrum_index":25640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 135.1246 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.222,"smiles":null,"spectrum_id":"CCMSLIB00017258656","spectrum_index":25641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Imidazol-1-ylmethyl)benzoic acid (delta mass: 35.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017258658","spectrum_index":25642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 56.0597 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.071,"smiles":null,"spectrum_id":"CCMSLIB00017258660","spectrum_index":25643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 71.0215 Da; putative annotation: N/A; putative formula: HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.071,"smiles":null,"spectrum_id":"CCMSLIB00017258663","spectrum_index":25644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 97.0389 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.104,"smiles":null,"spectrum_id":"CCMSLIB00017258665","spectrum_index":25645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 178.2078 Da; putative annotation: N/A; putative formula: C14H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.294,"smiles":null,"spectrum_id":"CCMSLIB00017258667","spectrum_index":25646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 199.1931 Da; putative annotation: N/A; putative formula: C12H25NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.362,"smiles":null,"spectrum_id":"CCMSLIB00017258670","spectrum_index":25647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 81.0317 Da; putative annotation: N/A; putative formula: C3H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.218,"smiles":null,"spectrum_id":"CCMSLIB00017258671","spectrum_index":25648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Glu (delta mass: 97.0526 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.166,"smiles":null,"spectrum_id":"CCMSLIB00017258674","spectrum_index":25649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Leu-DL-Val (delta mass: 113.0832 Da; putative annotation: 2-(Diethylamino)acetic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017258677","spectrum_index":25650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 164.0328 Da; putative annotation: 3-(Methylthio)phenyl acetic acid; putative formula: C9H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.119,"smiles":null,"spectrum_id":"CCMSLIB00017258679","spectrum_index":25651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 166.0627 Da; putative annotation: 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel-; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.123,"smiles":null,"spectrum_id":"CCMSLIB00017258681","spectrum_index":25652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 208.1831 Da; putative annotation: Myristoleic acid; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.452,"smiles":null,"spectrum_id":"CCMSLIB00017258684","spectrum_index":25653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 171.0682 Da; putative annotation: N-Benzyl-2,2,2-trifluoroethanamine; putative formula: C9H8F3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.155,"smiles":null,"spectrum_id":"CCMSLIB00017258686","spectrum_index":25654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 122.0368 Da; putative annotation: Ethyl maltol - 40.0 eV; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.108,"smiles":null,"spectrum_id":"CCMSLIB00017258688","spectrum_index":25655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 157.0739 Da; putative annotation: 4,4-Dimethyl-L-glutamic acid; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017258691","spectrum_index":25656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 182.008 Da; putative annotation: N/A; putative formula: C5H12OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.074,"smiles":null,"spectrum_id":"CCMSLIB00017258694","spectrum_index":25657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 467.3066 Da; putative annotation: N/A; putative formula: C28H42N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.387,"smiles":null,"spectrum_id":"CCMSLIB00017258696","spectrum_index":25658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 260.2813 Da; putative annotation: N/A; putative formula: C20H36O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.363,"smiles":null,"spectrum_id":"CCMSLIB00017258698","spectrum_index":25659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 82.063 Da; putative annotation: N/A; putative formula: C3H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017258701","spectrum_index":25660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.19,"smiles":null,"spectrum_id":"CCMSLIB00017258702","spectrum_index":25661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 27.0505 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.115,"smiles":null,"spectrum_id":"CCMSLIB00017258705","spectrum_index":25662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 63.0401 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.133,"smiles":null,"spectrum_id":"CCMSLIB00017258708","spectrum_index":25663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 396.1291 Da; putative annotation: N/A; putative formula: C17H24N4O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.21,"smiles":null,"spectrum_id":"CCMSLIB00017258710","spectrum_index":25664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Azaindole (delta mass: 42.9945 Da; putative annotation: N/A; putative formula: CH2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.055,"smiles":null,"spectrum_id":"CCMSLIB00017258712","spectrum_index":25665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 179.1229 Da; putative annotation: N/A; putative formula: C11H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.171,"smiles":null,"spectrum_id":"CCMSLIB00017258715","spectrum_index":25666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 925.5038 Da; putative annotation: N/A; putative formula: C47H75NO17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1106.57,"smiles":null,"spectrum_id":"CCMSLIB00017258716","spectrum_index":25667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 829.4238 Da; putative annotation: N/A; putative formula: C49H59N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1010.49,"smiles":null,"spectrum_id":"CCMSLIB00017258719","spectrum_index":25668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to His-Val from NIST14 (delta mass: 99.0689 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.214,"smiles":null,"spectrum_id":"CCMSLIB00017258722","spectrum_index":25669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 102.0013 Da; putative annotation: N/A; putative formula: C7H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.067,"smiles":null,"spectrum_id":"CCMSLIB00017258724","spectrum_index":25670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 70.0422 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.17,"smiles":null,"spectrum_id":"CCMSLIB00017258726","spectrum_index":25671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (delta mass: 346.1241 Da; putative annotation: N/A; putative formula: C19H22O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.268,"smiles":null,"spectrum_id":"CCMSLIB00017258729","spectrum_index":25672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 81.0426 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.155,"smiles":null,"spectrum_id":"CCMSLIB00017258732","spectrum_index":25673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 161.0922 Da; putative annotation: N/A; putative formula: C4H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.191,"smiles":null,"spectrum_id":"CCMSLIB00017258734","spectrum_index":25674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 245.1648 Da; putative annotation: N/A; putative formula: C13H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.292,"smiles":null,"spectrum_id":"CCMSLIB00017258736","spectrum_index":25675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 27.0108 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.092,"smiles":null,"spectrum_id":"CCMSLIB00017258739","spectrum_index":25676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 246.1054 Da; putative annotation: N/A; putative formula: C11H14N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.186,"smiles":null,"spectrum_id":"CCMSLIB00017258741","spectrum_index":25677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4,5-Dihydroxy-6-(hydroxymethyl)-2-[2,4,6-trihydroxy-3-(4-hydroxybenzoyl)phenyl]oxan-3-yl] 3,4,5-trihydroxybenzoate (delta mass: 150.0312 Da; putative annotation: N/A; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.155,"smiles":null,"spectrum_id":"CCMSLIB00017258743","spectrum_index":25678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 114.0673 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.159,"smiles":null,"spectrum_id":"CCMSLIB00017258746","spectrum_index":25679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isonicotinic acid - 40.0 eV (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.05,"smiles":null,"spectrum_id":"CCMSLIB00017258749","spectrum_index":25680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-2-carbaldehyde (delta mass: 18.045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017258751","spectrum_index":25681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 45.9291 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017258753","spectrum_index":25682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 518.1853 Da; putative annotation: N/A; putative formula: C25H44O-1P2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.266,"smiles":null,"spectrum_id":"CCMSLIB00017258755","spectrum_index":25683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 265.1519 Da; putative annotation: N/A; putative formula: C11H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.223,"smiles":null,"spectrum_id":"CCMSLIB00017258758","spectrum_index":25684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 535.3348 Da; putative annotation: N/A; putative formula: C39H41N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.406,"smiles":null,"spectrum_id":"CCMSLIB00017258761","spectrum_index":25685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 639.3849 Da; putative annotation: N/A; putative formula: C31H53N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.422,"smiles":null,"spectrum_id":"CCMSLIB00017258762","spectrum_index":25686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 583.392 Da; putative annotation: N/A; putative formula: C33H53N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.463,"smiles":null,"spectrum_id":"CCMSLIB00017258765","spectrum_index":25687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 74.0006 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.05,"smiles":null,"spectrum_id":"CCMSLIB00017258768","spectrum_index":25688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 138.0637 Da; putative annotation: N/A; putative formula: C4H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.15,"smiles":null,"spectrum_id":"CCMSLIB00017258769","spectrum_index":25689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311056 Glutamylphenylalanine (isomer of 1503) (delta mass: 276.112 Da; putative annotation: N/A; putative formula: C14H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.241,"smiles":null,"spectrum_id":"CCMSLIB00017258772","spectrum_index":25690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 268.1316 Da; putative annotation: N/A; putative formula: C15H24S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.166,"smiles":null,"spectrum_id":"CCMSLIB00017258774","spectrum_index":25691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 22.9905 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.092,"smiles":null,"spectrum_id":"CCMSLIB00017258776","spectrum_index":25692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacetic acid (delta mass: 154.0484 Da; putative annotation: N/A; putative formula: C5H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.119,"smiles":null,"spectrum_id":"CCMSLIB00017258779","spectrum_index":25693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 459.1759 Da; putative annotation: N/A; putative formula: C22H29N5O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.247,"smiles":null,"spectrum_id":"CCMSLIB00017258782","spectrum_index":25694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 28.9787 Da; putative annotation: N/A; putative formula: NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017258783","spectrum_index":25695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 270.2322 Da; putative annotation: N/A; putative formula: C15H30N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":863.508,"smiles":null,"spectrum_id":"CCMSLIB00017258786","spectrum_index":25696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 106.0417 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.133,"smiles":null,"spectrum_id":"CCMSLIB00017258789","spectrum_index":25697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 48.9916 Da; putative annotation: N/A; putative formula: C3H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.057,"smiles":null,"spectrum_id":"CCMSLIB00017258790","spectrum_index":25698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 360.0485 Da; putative annotation: N/A; putative formula: C20H13N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.114,"smiles":null,"spectrum_id":"CCMSLIB00017258793","spectrum_index":25699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 60.0363 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017258795","spectrum_index":25700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 144.0608 Da; putative annotation: N/A; putative formula: C7H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.121,"smiles":null,"spectrum_id":"CCMSLIB00017258798","spectrum_index":25701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 498.0613 Da; putative annotation: N/A; putative formula: C17H25O11P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.22,"smiles":null,"spectrum_id":"CCMSLIB00017258800","spectrum_index":25702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Didodecyl 3,3'-thiodipropionate oxide from NIST14 - Hydroxylated variant ? (delta mass: 45.034 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.442,"smiles":null,"spectrum_id":"CCMSLIB00017258802","spectrum_index":25703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 304.1792 Da; putative annotation: N/A; putative formula: C10H24N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.245,"smiles":null,"spectrum_id":"CCMSLIB00017258805","spectrum_index":25704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 489.3303 Da; putative annotation: N/A; putative formula: C25H47NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.401,"smiles":null,"spectrum_id":"CCMSLIB00017258806","spectrum_index":25705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 45.0583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.192,"smiles":null,"spectrum_id":"CCMSLIB00017258809","spectrum_index":25706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 87.0685 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.17,"smiles":null,"spectrum_id":"CCMSLIB00017258811","spectrum_index":25707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 623.3705 Da; putative annotation: N/A; putative formula: C30H57NO10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.441,"smiles":null,"spectrum_id":"CCMSLIB00017258813","spectrum_index":25708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 86.0347 Da; putative annotation: N/A; putative formula: H2N6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.105,"smiles":null,"spectrum_id":"CCMSLIB00017258816","spectrum_index":25709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-isopropylthiophenethylamine (delta mass: 159.0595 Da; putative annotation: N/A; putative formula: C10H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.196,"smiles":null,"spectrum_id":"CCMSLIB00017258817","spectrum_index":25710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 184.1252 Da; putative annotation: N/A; putative formula: C14H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017258820","spectrum_index":25711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 281.3176 Da; putative annotation: N/A; putative formula: C18H39N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.352,"smiles":null,"spectrum_id":"CCMSLIB00017258823","spectrum_index":25712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 119.0731 Da; putative annotation: N/A; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.154,"smiles":null,"spectrum_id":"CCMSLIB00017258824","spectrum_index":25713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301555 Harman (delta mass: 174.0642 Da; putative annotation: N/A; putative formula: C6H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.156,"smiles":null,"spectrum_id":"CCMSLIB00017258827","spectrum_index":25714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 70.9329 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.993,"smiles":null,"spectrum_id":"CCMSLIB00017258830","spectrum_index":25715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 462.2539 Da; putative annotation: N/A; putative formula: C26H39O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":789.383,"smiles":null,"spectrum_id":"CCMSLIB00017258831","spectrum_index":25716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 186.3418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.413,"smiles":null,"spectrum_id":"CCMSLIB00017258834","spectrum_index":25717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 88.0421 Da; putative annotation: N/A; putative formula: C6H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.123,"smiles":null,"spectrum_id":"CCMSLIB00017258836","spectrum_index":25718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 551.2951 Da; putative annotation: N/A; putative formula: C26H49NO7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.355,"smiles":null,"spectrum_id":"CCMSLIB00017258838","spectrum_index":25719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Glu (delta mass: 631.1778 Da; putative annotation: N/A; putative formula: C25H34N3O14P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.265,"smiles":null,"spectrum_id":"CCMSLIB00017258841","spectrum_index":25720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 37.035 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.138,"smiles":null,"spectrum_id":"CCMSLIB00017258844","spectrum_index":25721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 208.1415 Da; putative annotation: N/A; putative formula: C12H20N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.189,"smiles":null,"spectrum_id":"CCMSLIB00017258845","spectrum_index":25722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLIC ACID - 70.00 eV (delta mass: 70.0494 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.104,"smiles":null,"spectrum_id":"CCMSLIB00017258848","spectrum_index":25723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 105.0897 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.149,"smiles":null,"spectrum_id":"CCMSLIB00017258851","spectrum_index":25724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 413.3501 Da; putative annotation: N/A; putative formula: C24H47NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.387,"smiles":null,"spectrum_id":"CCMSLIB00017258852","spectrum_index":25725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 321.338 Da; putative annotation: N/A; putative formula: C22H43N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.45,"smiles":null,"spectrum_id":"CCMSLIB00017258855","spectrum_index":25726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 31.022 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.119,"smiles":null,"spectrum_id":"CCMSLIB00017258858","spectrum_index":25727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 75.077 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017258860","spectrum_index":25728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 240.1211 Da; putative annotation: N/A; putative formula: C12H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.197,"smiles":null,"spectrum_id":"CCMSLIB00017258862","spectrum_index":25729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 733.5703 Da; putative annotation: N/A; putative formula: C40H79NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.63,"smiles":null,"spectrum_id":"CCMSLIB00017258865","spectrum_index":25730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 411.1108 Da; putative annotation: N/A; putative formula: C25H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.261,"smiles":null,"spectrum_id":"CCMSLIB00017258867","spectrum_index":25731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 458.084 Da; putative annotation: N/A; putative formula: C22H18O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.181,"smiles":null,"spectrum_id":"CCMSLIB00017258869","spectrum_index":25732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 76.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.128,"smiles":null,"spectrum_id":"CCMSLIB00017258872","spectrum_index":25733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 37.0413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.169,"smiles":null,"spectrum_id":"CCMSLIB00017258874","spectrum_index":25734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 212.9114 Da; putative annotation: N/A; putative formula: C2NO7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.003,"smiles":null,"spectrum_id":"CCMSLIB00017258876","spectrum_index":25735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 89.0477 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.107,"smiles":null,"spectrum_id":"CCMSLIB00017258879","spectrum_index":25736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 294.257 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.37,"smiles":null,"spectrum_id":"CCMSLIB00017258880","spectrum_index":25737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 167.0963 Da; putative annotation: N/A; putative formula: C8H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.151,"smiles":null,"spectrum_id":"CCMSLIB00017258883","spectrum_index":25738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 76.0672 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.143,"smiles":null,"spectrum_id":"CCMSLIB00017258886","spectrum_index":25739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 332.0989 Da; putative annotation: N/A; putative formula: C12H22N4OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.242,"smiles":null,"spectrum_id":"CCMSLIB00017258887","spectrum_index":25740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 98.0366 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.107,"smiles":null,"spectrum_id":"CCMSLIB00017258890","spectrum_index":25741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 42.1087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.243,"smiles":null,"spectrum_id":"CCMSLIB00017258892","spectrum_index":25742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 85.0525 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.112,"smiles":null,"spectrum_id":"CCMSLIB00017258894","spectrum_index":25743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 355.0886 Da; putative annotation: N/A; putative formula: C20H21NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.175,"smiles":null,"spectrum_id":"CCMSLIB00017258897","spectrum_index":25744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 92.0408 Da; putative annotation: N/A; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.175,"smiles":null,"spectrum_id":"CCMSLIB00017258900","spectrum_index":25745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 101.063 Da; putative annotation: N/A; putative formula: C8H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.118,"smiles":null,"spectrum_id":"CCMSLIB00017258901","spectrum_index":25746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 189.0641 Da; putative annotation: N/A; putative formula: C8H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.145,"smiles":null,"spectrum_id":"CCMSLIB00017258904","spectrum_index":25747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 841.4667 Da; putative annotation: N/A; putative formula: C52H63N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1022.54,"smiles":null,"spectrum_id":"CCMSLIB00017258907","spectrum_index":25748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 887.3979 Da; putative annotation: N/A; putative formula: C48H49N13O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1068.47,"smiles":null,"spectrum_id":"CCMSLIB00017258908","spectrum_index":25749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 893.443 Da; putative annotation: N/A; putative formula: C39H63N11O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1074.51,"smiles":null,"spectrum_id":"CCMSLIB00017258911","spectrum_index":25750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 646.5162 Da; putative annotation: N/A; putative formula: C34H71N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.613,"smiles":null,"spectrum_id":"CCMSLIB00017258914","spectrum_index":25751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU035603 Ethirimol|5-butyl-2-(ethylamino)-6-methyl-1H-pyrimidin-4-one (delta mass: 27.0378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.198,"smiles":null,"spectrum_id":"CCMSLIB00017258917","spectrum_index":25752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 37.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017258918","spectrum_index":25753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 194.0433 Da; putative annotation: N/A; putative formula: C9H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.166,"smiles":null,"spectrum_id":"CCMSLIB00017258921","spectrum_index":25754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2,3-dione (delta mass: 22.0884 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.118,"smiles":null,"spectrum_id":"CCMSLIB00017258924","spectrum_index":25755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 113.0938 Da; putative annotation: N/A; putative formula: C5H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.176,"smiles":null,"spectrum_id":"CCMSLIB00017258926","spectrum_index":25756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 90.0313 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.17,"smiles":null,"spectrum_id":"CCMSLIB00017258928","spectrum_index":25757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 493.8417 Da; putative annotation: N/A; putative formula: C10H6O13S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.902,"smiles":null,"spectrum_id":"CCMSLIB00017258931","spectrum_index":25758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 1162.7377 Da; putative annotation: N/A; putative formula: C62H94N14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1837.98,"smiles":null,"spectrum_id":"CCMSLIB00017258934","spectrum_index":25759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 265.1547 Da; putative annotation: N/A; putative formula: C12H19N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.283,"smiles":null,"spectrum_id":"CCMSLIB00017258935","spectrum_index":25760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxycamptothecin (delta mass: 468.3466 Da; putative annotation: N/A; putative formula: C28H44N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.46,"smiles":null,"spectrum_id":"CCMSLIB00017258938","spectrum_index":25761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 222.2373 Da; putative annotation: N/A; putative formula: C16H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.324,"smiles":null,"spectrum_id":"CCMSLIB00017258941","spectrum_index":25762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 28.0295 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.205,"smiles":null,"spectrum_id":"CCMSLIB00017258942","spectrum_index":25763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 60.0157 Da; putative annotation: N/A; putative formula: CH4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.093,"smiles":null,"spectrum_id":"CCMSLIB00017258945","spectrum_index":25764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 262.0689 Da; putative annotation: N/A; putative formula: C10H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.15,"smiles":null,"spectrum_id":"CCMSLIB00017258948","spectrum_index":25765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 305.1108 Da; putative annotation: N/A; putative formula: C12H19NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.181,"smiles":null,"spectrum_id":"CCMSLIB00017258950","spectrum_index":25766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 6.0723 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.139,"smiles":null,"spectrum_id":"CCMSLIB00017258952","spectrum_index":25767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 551.5097 Da; putative annotation: N/A; putative formula: C35H69NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.581,"smiles":null,"spectrum_id":"CCMSLIB00017258955","spectrum_index":25768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Gln (delta mass: 113.0832 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.244,"smiles":null,"spectrum_id":"CCMSLIB00017258956","spectrum_index":25769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 439.1326 Da; putative annotation: N/A; putative formula: C16H25NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.193,"smiles":null,"spectrum_id":"CCMSLIB00017258959","spectrum_index":25770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU211802 Nordeprenyl|Desmethylselegiline|1-phenyl-N-prop-2-ynylpropan-2-amine (delta mass: 217.2377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.365,"smiles":null,"spectrum_id":"CCMSLIB00017258961","spectrum_index":25771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GLUCOSAMINE (delta mass: 1269.2143 Da; putative annotation: N/A; putative formula: C57H61NO20P2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1491.31,"smiles":null,"spectrum_id":"CCMSLIB00017258963","spectrum_index":25772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 18.0776 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.155,"smiles":null,"spectrum_id":"CCMSLIB00017258966","spectrum_index":25773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-cysteine (delta mass: 70.0416 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.079,"smiles":null,"spectrum_id":"CCMSLIB00017258969","spectrum_index":25774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Formyltryptophan (delta mass: 86.0352 Da; putative annotation: N/A; putative formula: H2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.127,"smiles":null,"spectrum_id":"CCMSLIB00017258970","spectrum_index":25775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 160.1435 Da; putative annotation: N/A; putative formula: C5H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.203,"smiles":null,"spectrum_id":"CCMSLIB00017258973","spectrum_index":25776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 72.9987 Da; putative annotation: N/A; putative formula: C2H3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.095,"smiles":null,"spectrum_id":"CCMSLIB00017258976","spectrum_index":25777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 189.1797 Da; putative annotation: N/A; putative formula: C5H19N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.275,"smiles":null,"spectrum_id":"CCMSLIB00017258979","spectrum_index":25778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Undulatoside A (delta mass: 105.0243 Da; putative annotation: N/A; putative formula: C3H7NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.127,"smiles":null,"spectrum_id":"CCMSLIB00017258980","spectrum_index":25779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 1102.818 Da; putative annotation: N/A; putative formula: C68H106N6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1236.91,"smiles":null,"spectrum_id":"CCMSLIB00017258983","spectrum_index":25780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 57.0576 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.263,"smiles":null,"spectrum_id":"CCMSLIB00017258986","spectrum_index":25781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 75.9684 Da; putative annotation: N/A; putative formula: CHO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.059,"smiles":null,"spectrum_id":"CCMSLIB00017258987","spectrum_index":25782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of XYLITOL (delta mass: 65.0243 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.1,"smiles":null,"spectrum_id":"CCMSLIB00017258990","spectrum_index":25783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Ile (delta mass: 129.0432 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.204,"smiles":null,"spectrum_id":"CCMSLIB00017258993","spectrum_index":25784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE10; MS2Dec (delta mass: 340.2244 Da; putative annotation: N/A; putative formula: C19H32O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.322,"smiles":null,"spectrum_id":"CCMSLIB00017258994","spectrum_index":25785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 256.1304 Da; putative annotation: N/A; putative formula: C10H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.253,"smiles":null,"spectrum_id":"CCMSLIB00017258997","spectrum_index":25786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 847.5467 Da; putative annotation: N/A; putative formula: C49H69N9O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1001.63,"smiles":null,"spectrum_id":"CCMSLIB00017259000","spectrum_index":25787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 447.8632 Da; putative annotation: N/A; putative formula: O28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.987,"smiles":null,"spectrum_id":"CCMSLIB00017259001","spectrum_index":25788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 60.0298 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.111,"smiles":null,"spectrum_id":"CCMSLIB00017259004","spectrum_index":25789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 158.0726 Da; putative annotation: N/A; putative formula: C11H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017259007","spectrum_index":25790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-(1H-Imidazol-4-yl)propyl]-N'-methylthiourea (delta mass: 35.0117 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.113,"smiles":null,"spectrum_id":"CCMSLIB00017259009","spectrum_index":25791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 702.2967 Da; putative annotation: N/A; putative formula: C44H34N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1045.42,"smiles":null,"spectrum_id":"CCMSLIB00017259011","spectrum_index":25792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 86.0493 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.12,"smiles":null,"spectrum_id":"CCMSLIB00017259014","spectrum_index":25793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 185.1454 Da; putative annotation: N/A; putative formula: C9H20N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.2,"smiles":null,"spectrum_id":"CCMSLIB00017259017","spectrum_index":25794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Homoserine (delta mass: 57.0215 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.087,"smiles":null,"spectrum_id":"CCMSLIB00017259018","spectrum_index":25795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-2-ol (delta mass: 53.0265 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.087,"smiles":null,"spectrum_id":"CCMSLIB00017259021","spectrum_index":25796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 30.9945 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017259023","spectrum_index":25797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1106.5554 Da; putative annotation: N/A; putative formula: C43H82N10O23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1269.62,"smiles":null,"spectrum_id":"CCMSLIB00017259025","spectrum_index":25798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Prolylphenylalanine (delta mass: 260.1531 Da; putative annotation: N/A; putative formula: C15H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.292,"smiles":null,"spectrum_id":"CCMSLIB00017259028","spectrum_index":25799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 50.0388 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.105,"smiles":null,"spectrum_id":"CCMSLIB00017259031","spectrum_index":25800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 59.073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.175,"smiles":null,"spectrum_id":"CCMSLIB00017259033","spectrum_index":25801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 320.2492 Da; putative annotation: N/A; putative formula: C18H33N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.314,"smiles":null,"spectrum_id":"CCMSLIB00017259035","spectrum_index":25802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 728.6756 Da; putative annotation: N/A; putative formula: C47H88N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.767,"smiles":null,"spectrum_id":"CCMSLIB00017259038","spectrum_index":25803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 44.4987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.57,"smiles":null,"spectrum_id":"CCMSLIB00017259041","spectrum_index":25804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 36.0371 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.17,"smiles":null,"spectrum_id":"CCMSLIB00017259043","spectrum_index":25805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 134.0638 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.134,"smiles":null,"spectrum_id":"CCMSLIB00017259045","spectrum_index":25806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Paxitriol (delta mass: 398.1679 Da; putative annotation: N/A; putative formula: C12H27N6O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":836.432,"smiles":null,"spectrum_id":"CCMSLIB00017259048","spectrum_index":25807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 188.0795 Da; putative annotation: N/A; putative formula: C7H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.229,"smiles":null,"spectrum_id":"CCMSLIB00017259050","spectrum_index":25808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 41.9854 Da; putative annotation: N/A; putative formula: H-2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.134,"smiles":null,"spectrum_id":"CCMSLIB00017259052","spectrum_index":25809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 193.0739 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.202,"smiles":null,"spectrum_id":"CCMSLIB00017259055","spectrum_index":25810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-hydroxy-1H-pyrimidin-4-one (delta mass: 69.0576 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.103,"smiles":null,"spectrum_id":"CCMSLIB00017259057","spectrum_index":25811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1094.5524 Da; putative annotation: N/A; putative formula: C59H74N12O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1316.65,"smiles":null,"spectrum_id":"CCMSLIB00017259060","spectrum_index":25812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 129.0615 Da; putative annotation: N/A; putative formula: C6H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.169,"smiles":null,"spectrum_id":"CCMSLIB00017259062","spectrum_index":25813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 36.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.149,"smiles":null,"spectrum_id":"CCMSLIB00017259064","spectrum_index":25814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 294.1476 Da; putative annotation: N/A; putative formula: C17H26S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.218,"smiles":null,"spectrum_id":"CCMSLIB00017259067","spectrum_index":25815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 264.2457 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.358,"smiles":null,"spectrum_id":"CCMSLIB00017259070","spectrum_index":25816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 676.4673 Da; putative annotation: N/A; putative formula: C39H68N2O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":839.527,"smiles":null,"spectrum_id":"CCMSLIB00017259071","spectrum_index":25817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Decanol (delta mass: 380.3263 Da; putative annotation: N/A; putative formula: C20H40N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.501,"smiles":null,"spectrum_id":"CCMSLIB00017259074","spectrum_index":25818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 24.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.134,"smiles":null,"spectrum_id":"CCMSLIB00017259077","spectrum_index":25819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 109.0539 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.166,"smiles":null,"spectrum_id":"CCMSLIB00017259079","spectrum_index":25820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 29.9618 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.038,"smiles":null,"spectrum_id":"CCMSLIB00017259081","spectrum_index":25821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GLUCOSAMINE (delta mass: 238.2294 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.316,"smiles":null,"spectrum_id":"CCMSLIB00017259084","spectrum_index":25822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbamazepine-10,11-epoxide (delta mass: 45.0214 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.119,"smiles":null,"spectrum_id":"CCMSLIB00017259086","spectrum_index":25823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 54.0218 Da; putative annotation: N/A; putative formula: C2H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.072,"smiles":null,"spectrum_id":"CCMSLIB00017259088","spectrum_index":25824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017259091","spectrum_index":25825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 15.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.139,"smiles":null,"spectrum_id":"CCMSLIB00017259093","spectrum_index":25826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 157.1816 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.248,"smiles":null,"spectrum_id":"CCMSLIB00017259096","spectrum_index":25827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Octopamine from NIST14 (delta mass: 150.175 Da; putative annotation: N/A; putative formula: C12H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.261,"smiles":null,"spectrum_id":"CCMSLIB00017259098","spectrum_index":25828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 129.0805 Da; putative annotation: N/A; putative formula: C5H12N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.14,"smiles":null,"spectrum_id":"CCMSLIB00017259101","spectrum_index":25829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piracetam (delta mass: 14.0252 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.107,"smiles":null,"spectrum_id":"CCMSLIB00017259103","spectrum_index":25830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 114.0317 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.103,"smiles":null,"spectrum_id":"CCMSLIB00017259106","spectrum_index":25831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 123.0687 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.139,"smiles":null,"spectrum_id":"CCMSLIB00017259108","spectrum_index":25832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 198.1037 Da; putative annotation: N/A; putative formula: C8H15N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.19,"smiles":null,"spectrum_id":"CCMSLIB00017259111","spectrum_index":25833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 462.3365 Da; putative annotation: N/A; putative formula: C29H42N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.423,"smiles":null,"spectrum_id":"CCMSLIB00017259113","spectrum_index":25834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 509.2628 Da; putative annotation: N/A; putative formula: C26H39NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.333,"smiles":null,"spectrum_id":"CCMSLIB00017259116","spectrum_index":25835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 17.0305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.128,"smiles":null,"spectrum_id":"CCMSLIB00017259118","spectrum_index":25836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 62.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.144,"smiles":null,"spectrum_id":"CCMSLIB00017259120","spectrum_index":25837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 148.16 Da; putative annotation: N/A; putative formula: C12H20O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.225,"smiles":null,"spectrum_id":"CCMSLIB00017259123","spectrum_index":25838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 152.069 Da; putative annotation: N/A; putative formula: C6H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.166,"smiles":null,"spectrum_id":"CCMSLIB00017259125","spectrum_index":25839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 97.0528 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.207,"smiles":null,"spectrum_id":"CCMSLIB00017259128","spectrum_index":25840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 324.1063 Da; putative annotation: ?-Gentiobiose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.283,"smiles":null,"spectrum_id":"CCMSLIB00017259129","spectrum_index":25841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 127.0991 Da; putative annotation: 7-Aminoheptanoic acid; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.17,"smiles":null,"spectrum_id":"CCMSLIB00017259132","spectrum_index":25842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 144.0411 Da; putative annotation: 1,6-Anhydro-.beta.-D-glucose; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.165,"smiles":null,"spectrum_id":"CCMSLIB00017259135","spectrum_index":25843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 146.0721 Da; putative annotation: 4-Hydrazino-1-methyl-1H-pyrazolo[3,4-d]pyrimidine; putative formula: C6H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.169,"smiles":null,"spectrum_id":"CCMSLIB00017259136","spectrum_index":25844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 123.0801 Da; putative annotation: L-Histidinol; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.141,"smiles":null,"spectrum_id":"CCMSLIB00017259139","spectrum_index":25845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 31.0907 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.091,"smiles":null,"spectrum_id":"CCMSLIB00017259141","spectrum_index":25846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 183.1685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017259144","spectrum_index":25847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 43.9897 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.076,"smiles":null,"spectrum_id":"CCMSLIB00017259146","spectrum_index":25848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 298.1045 Da; putative annotation: N/A; putative formula: C18H20P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.253,"smiles":null,"spectrum_id":"CCMSLIB00017259148","spectrum_index":25849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 256.2401 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.326,"smiles":null,"spectrum_id":"CCMSLIB00017259151","spectrum_index":25850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Pro-Lys (delta mass: 69.0581 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.271,"smiles":null,"spectrum_id":"CCMSLIB00017259152","spectrum_index":25851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.15,"smiles":null,"spectrum_id":"CCMSLIB00017259155","spectrum_index":25852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 70.0169 Da; putative annotation: N/A; putative formula: C2H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.14,"smiles":null,"spectrum_id":"CCMSLIB00017259158","spectrum_index":25853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 78.0327 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.104,"smiles":null,"spectrum_id":"CCMSLIB00017259159","spectrum_index":25854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 691.3772 Da; putative annotation: N/A; putative formula: C46H49N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.448,"smiles":null,"spectrum_id":"CCMSLIB00017259162","spectrum_index":25855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 933.4926 Da; putative annotation: N/A; putative formula: C58H67N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1114.56,"smiles":null,"spectrum_id":"CCMSLIB00017259164","spectrum_index":25856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 814.1954 Da; putative annotation: N/A; putative formula: C38H38O20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":977.255,"smiles":null,"spectrum_id":"CCMSLIB00017259166","spectrum_index":25857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 42.0058 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.083,"smiles":null,"spectrum_id":"CCMSLIB00017259169","spectrum_index":25858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.077,"smiles":null,"spectrum_id":"CCMSLIB00017259171","spectrum_index":25859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 141.0789 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.176,"smiles":null,"spectrum_id":"CCMSLIB00017259173","spectrum_index":25860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 359.2294 Da; putative annotation: N/A; putative formula: C15H25N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.3,"smiles":null,"spectrum_id":"CCMSLIB00017259176","spectrum_index":25861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of fMet CollisionEnergy:102040 (delta mass: 129.0428 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.096,"smiles":null,"spectrum_id":"CCMSLIB00017259178","spectrum_index":25862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 130.0411 Da; putative annotation: N/A; putative formula: C3H7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.122,"smiles":null,"spectrum_id":"CCMSLIB00017259181","spectrum_index":25863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 27.9937 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.08,"smiles":null,"spectrum_id":"CCMSLIB00017259182","spectrum_index":25864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2,3-Dimethylphenyl)-7-methyl-1,2,4-triazaspiro[4.5]decane-3-thione (delta mass: 18.0026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.171,"smiles":null,"spectrum_id":"CCMSLIB00017259185","spectrum_index":25865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 128.0837 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.143,"smiles":null,"spectrum_id":"CCMSLIB00017259187","spectrum_index":25866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.123,"smiles":null,"spectrum_id":"CCMSLIB00017259189","spectrum_index":25867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 135.0573 Da; putative annotation: N/A; putative formula: C2H9N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017259192","spectrum_index":25868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Octen-3-ol (delta mass: 158.0939 Da; putative annotation: N/A; putative formula: C8H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.221,"smiles":null,"spectrum_id":"CCMSLIB00017259194","spectrum_index":25869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 1.9174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.004,"smiles":null,"spectrum_id":"CCMSLIB00017259196","spectrum_index":25870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE10; MS2Dec (delta mass: 176.0319 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.108,"smiles":null,"spectrum_id":"CCMSLIB00017259199","spectrum_index":25871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 251.1736 Da; putative annotation: N/A; putative formula: C12H21N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.239,"smiles":null,"spectrum_id":"CCMSLIB00017259202","spectrum_index":25872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 339.2119 Da; putative annotation: N/A; putative formula: C22H30NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.298,"smiles":null,"spectrum_id":"CCMSLIB00017259204","spectrum_index":25873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 64.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017259207","spectrum_index":25874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 185.0781 Da; putative annotation: N/A; putative formula: C3H7N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.201,"smiles":null,"spectrum_id":"CCMSLIB00017259210","spectrum_index":25875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 251.0116 Da; putative annotation: N/A; putative formula: C8H5N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.087,"smiles":null,"spectrum_id":"CCMSLIB00017259212","spectrum_index":25876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 28.8774 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017259214","spectrum_index":25877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Val (delta mass: 198.1011 Da; putative annotation: N/A; putative formula: C9H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.271,"smiles":null,"spectrum_id":"CCMSLIB00017259217","spectrum_index":25878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 147.0693 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.219,"smiles":null,"spectrum_id":"CCMSLIB00017259220","spectrum_index":25879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 285.2669 Da; putative annotation: N/A; putative formula: C17H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.494,"smiles":null,"spectrum_id":"CCMSLIB00017259222","spectrum_index":25880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-Gln (delta mass: 111.0315 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.145,"smiles":null,"spectrum_id":"CCMSLIB00017259225","spectrum_index":25881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 111.9602 Da; putative annotation: N/A; putative formula: C4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.026,"smiles":null,"spectrum_id":"CCMSLIB00017259228","spectrum_index":25882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 92.9347 Da; putative annotation: N/A; putative formula: H-1NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.021,"smiles":null,"spectrum_id":"CCMSLIB00017259230","spectrum_index":25883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 243.2345 Da; putative annotation: N/A; putative formula: C18H29NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.347,"smiles":null,"spectrum_id":"CCMSLIB00017259233","spectrum_index":25884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 27.0451 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.178,"smiles":null,"spectrum_id":"CCMSLIB00017259236","spectrum_index":25885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 56.0611 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.184,"smiles":null,"spectrum_id":"CCMSLIB00017259238","spectrum_index":25886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 523.3337 Da; putative annotation: N/A; putative formula: C22H41N11O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.404,"smiles":null,"spectrum_id":"CCMSLIB00017259241","spectrum_index":25887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 469.2511 Da; putative annotation: N/A; putative formula: C25H35N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.322,"smiles":null,"spectrum_id":"CCMSLIB00017259243","spectrum_index":25888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 520.1954 Da; putative annotation: N/A; putative formula: C27H36O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.318,"smiles":null,"spectrum_id":"CCMSLIB00017259246","spectrum_index":25889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 72.0664 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017259248","spectrum_index":25890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 785.4935 Da; putative annotation: N/A; putative formula: C52H68NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.532,"smiles":null,"spectrum_id":"CCMSLIB00017259251","spectrum_index":25891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 132.0791 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.129,"smiles":null,"spectrum_id":"CCMSLIB00017259253","spectrum_index":25892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 192.0268 Da; putative annotation: N/A; putative formula: C6H8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.066,"smiles":null,"spectrum_id":"CCMSLIB00017259256","spectrum_index":25893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 87.048 Da; putative annotation: N/A; putative formula: C7H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.113,"smiles":null,"spectrum_id":"CCMSLIB00017259258","spectrum_index":25894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 491.3478 Da; putative annotation: N/A; putative formula: C27H41N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.419,"smiles":null,"spectrum_id":"CCMSLIB00017259261","spectrum_index":25895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 192.1193 Da; putative annotation: N/A; putative formula: C11H17N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.19,"smiles":null,"spectrum_id":"CCMSLIB00017259263","spectrum_index":25896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 189.0138 Da; putative annotation: N/A; putative formula: C5H10N3O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.199,"smiles":null,"spectrum_id":"CCMSLIB00017259266","spectrum_index":25897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Glycolylneuraminic acid (delta mass: 131.0934 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.202,"smiles":null,"spectrum_id":"CCMSLIB00017259268","spectrum_index":25898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 31.9071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.972,"smiles":null,"spectrum_id":"CCMSLIB00017259271","spectrum_index":25899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 786.4785 Da; putative annotation: N/A; putative formula: C44H82O-1S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":952.565,"smiles":null,"spectrum_id":"CCMSLIB00017259273","spectrum_index":25900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)propane-1,2-diol (delta mass: 115.0733 Da; putative annotation: N/A; putative formula: C4H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.159,"smiles":null,"spectrum_id":"CCMSLIB00017259276","spectrum_index":25901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 170.109 Da; putative annotation: N/A; putative formula: C7H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017259278","spectrum_index":25902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 331.1713 Da; putative annotation: N/A; putative formula: C18H25N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.331,"smiles":null,"spectrum_id":"CCMSLIB00017259280","spectrum_index":25903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 646.2976 Da; putative annotation: N/A; putative formula: C31H38N10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":827.368,"smiles":null,"spectrum_id":"CCMSLIB00017259283","spectrum_index":25904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 170.0577 Da; putative annotation: N/A; putative formula: C8H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.118,"smiles":null,"spectrum_id":"CCMSLIB00017259286","spectrum_index":25905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 86.0396 Da; putative annotation: N/A; putative formula: C3H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017259287","spectrum_index":25906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 486.0649 Da; putative annotation: N/A; putative formula: C22H19N2O7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.104,"smiles":null,"spectrum_id":"CCMSLIB00017259290","spectrum_index":25907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 103.0643 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.14,"smiles":null,"spectrum_id":"CCMSLIB00017259291","spectrum_index":25908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 132.0421 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.18,"smiles":null,"spectrum_id":"CCMSLIB00017259294","spectrum_index":25909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 224.1159 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.266,"smiles":null,"spectrum_id":"CCMSLIB00017259297","spectrum_index":25910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 192.0635 Da; putative annotation: N/A; putative formula: C7H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.097,"smiles":null,"spectrum_id":"CCMSLIB00017259300","spectrum_index":25911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Val (delta mass: 99.0688 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.203,"smiles":null,"spectrum_id":"CCMSLIB00017259301","spectrum_index":25912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 562.5006 Da; putative annotation: N/A; putative formula: C26H62N10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.597,"smiles":null,"spectrum_id":"CCMSLIB00017259304","spectrum_index":25913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 186.1259 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.176,"smiles":null,"spectrum_id":"CCMSLIB00017259305","spectrum_index":25914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 98.0518 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.112,"smiles":null,"spectrum_id":"CCMSLIB00017259308","spectrum_index":25915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Aminobutyl)urea (delta mass: 159.0469 Da; putative annotation: N/A; putative formula: C5H9N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.16,"smiles":null,"spectrum_id":"CCMSLIB00017259310","spectrum_index":25916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of colchicine (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.197,"smiles":null,"spectrum_id":"CCMSLIB00017259313","spectrum_index":25917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 144.005 Da; putative annotation: N/A; putative formula: C5H4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.065,"smiles":null,"spectrum_id":"CCMSLIB00017259315","spectrum_index":25918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 188.1151 Da; putative annotation: N/A; putative formula: C10H21O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.175,"smiles":null,"spectrum_id":"CCMSLIB00017259318","spectrum_index":25919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 318.219 Da; putative annotation: N/A; putative formula: C20H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.315,"smiles":null,"spectrum_id":"CCMSLIB00017259320","spectrum_index":25920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 232.1104 Da; putative annotation: N/A; putative formula: C7H16N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.186,"smiles":null,"spectrum_id":"CCMSLIB00017259323","spectrum_index":25921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 100.0526 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.233,"smiles":null,"spectrum_id":"CCMSLIB00017259325","spectrum_index":25922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 42.087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.152,"smiles":null,"spectrum_id":"CCMSLIB00017259327","spectrum_index":25923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 38.0723 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.153,"smiles":null,"spectrum_id":"CCMSLIB00017259330","spectrum_index":25924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 372.2852 Da; putative annotation: N/A; putative formula: C25H40S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.322,"smiles":null,"spectrum_id":"CCMSLIB00017259331","spectrum_index":25925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 103.9877 Da; putative annotation: N/A; putative formula: C2H4N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.053,"smiles":null,"spectrum_id":"CCMSLIB00017259334","spectrum_index":25926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 138.0253 Da; putative annotation: N/A; putative formula: C6H6N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.101,"smiles":null,"spectrum_id":"CCMSLIB00017259336","spectrum_index":25927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Arg (delta mass: 115.0271 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.23,"smiles":null,"spectrum_id":"CCMSLIB00017259338","spectrum_index":25928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.128,"smiles":null,"spectrum_id":"CCMSLIB00017259341","spectrum_index":25929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 26.0004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017259343","spectrum_index":25930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 691.5232 Da; putative annotation: N/A; putative formula: C37H73NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.583,"smiles":null,"spectrum_id":"CCMSLIB00017259345","spectrum_index":25931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 186.0701 Da; putative annotation: N/A; putative formula: C11H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.146,"smiles":null,"spectrum_id":"CCMSLIB00017259348","spectrum_index":25932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.123,"smiles":null,"spectrum_id":"CCMSLIB00017259351","spectrum_index":25933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 195.0539 Da; putative annotation: N/A; putative formula: C10H13NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.177,"smiles":null,"spectrum_id":"CCMSLIB00017259353","spectrum_index":25934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 186.087 Da; putative annotation: N/A; putative formula: C13H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.221,"smiles":null,"spectrum_id":"CCMSLIB00017259355","spectrum_index":25935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 302.1819 Da; putative annotation: N/A; putative formula: C18H26N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.284,"smiles":null,"spectrum_id":"CCMSLIB00017259358","spectrum_index":25936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 106.0398 Da; putative annotation: N/A; putative formula: C3H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.095,"smiles":null,"spectrum_id":"CCMSLIB00017259360","spectrum_index":25937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 208.11 Da; putative annotation: N/A; putative formula: C12H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.254,"smiles":null,"spectrum_id":"CCMSLIB00017259363","spectrum_index":25938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 46.0075 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.183,"smiles":null,"spectrum_id":"CCMSLIB00017259365","spectrum_index":25939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 97.0565 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.195,"smiles":null,"spectrum_id":"CCMSLIB00017259367","spectrum_index":25940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 208.088 Da; putative annotation: N/A; putative formula: C7H16N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.217,"smiles":null,"spectrum_id":"CCMSLIB00017259370","spectrum_index":25941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 345.1579 Da; putative annotation: N/A; putative formula: C19H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.229,"smiles":null,"spectrum_id":"CCMSLIB00017259372","spectrum_index":25942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 18.0004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.066,"smiles":null,"spectrum_id":"CCMSLIB00017259374","spectrum_index":25943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 207.093 Da; putative annotation: N/A; putative formula: C8H17NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.169,"smiles":null,"spectrum_id":"CCMSLIB00017259377","spectrum_index":25944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 14.0149 Da; putative annotation: N/A; putative formula: CH2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.106,"smiles":null,"spectrum_id":"CCMSLIB00017259378","spectrum_index":25945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 73.0846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.207,"smiles":null,"spectrum_id":"CCMSLIB00017259381","spectrum_index":25946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 59.0693 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.208,"smiles":null,"spectrum_id":"CCMSLIB00017259383","spectrum_index":25947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 192.0268 Da; putative annotation: N/A; putative formula: C6H8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.108,"smiles":null,"spectrum_id":"CCMSLIB00017259385","spectrum_index":25948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 839.4333 Da; putative annotation: N/A; putative formula: C52H61N3O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1020.5,"smiles":null,"spectrum_id":"CCMSLIB00017259388","spectrum_index":25949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 24.9357 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.012,"smiles":null,"spectrum_id":"CCMSLIB00017259391","spectrum_index":25950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 163.0634 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.161,"smiles":null,"spectrum_id":"CCMSLIB00017259392","spectrum_index":25951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 252.0635 Da; putative annotation: N/A; putative formula: C12H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1225.39,"smiles":null,"spectrum_id":"CCMSLIB00017259395","spectrum_index":25952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 221.6237 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.736,"smiles":null,"spectrum_id":"CCMSLIB00017259397","spectrum_index":25953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 1190.7679 Da; putative annotation: N/A; putative formula: C63H102N10O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1866.01,"smiles":null,"spectrum_id":"CCMSLIB00017259400","spectrum_index":25954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 116.0553 Da; putative annotation: N/A; putative formula: C3H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.163,"smiles":null,"spectrum_id":"CCMSLIB00017259402","spectrum_index":25955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 621.3867 Da; putative annotation: N/A; putative formula: C39H51N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.426,"smiles":null,"spectrum_id":"CCMSLIB00017259404","spectrum_index":25956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 533.2125 Da; putative annotation: N/A; putative formula: C24H31N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.273,"smiles":null,"spectrum_id":"CCMSLIB00017259407","spectrum_index":25957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 80.095 Da; putative annotation: N/A; putative formula: C7H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.234,"smiles":null,"spectrum_id":"CCMSLIB00017259409","spectrum_index":25958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:102040 (delta mass: 246.2671 Da; putative annotation: N/A; putative formula: C19H34O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.348,"smiles":null,"spectrum_id":"CCMSLIB00017259411","spectrum_index":25959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-ethyl-2,4-dihydroxy-6-methoxyphenyl)butan-1-one (delta mass: 162.0535 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.181,"smiles":null,"spectrum_id":"CCMSLIB00017259414","spectrum_index":25960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 67.0528 Da; putative annotation: N/A; putative formula: C3H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.15,"smiles":null,"spectrum_id":"CCMSLIB00017259417","spectrum_index":25961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 113.0475 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017259418","spectrum_index":25962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 242.2036 Da; putative annotation: N/A; putative formula: C18H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.3,"smiles":null,"spectrum_id":"CCMSLIB00017259421","spectrum_index":25963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 351.3137 Da; putative annotation: N/A; putative formula: C22H41NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.4,"smiles":null,"spectrum_id":"CCMSLIB00017259424","spectrum_index":25964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 345.725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.796,"smiles":null,"spectrum_id":"CCMSLIB00017259425","spectrum_index":25965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 25.0077 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.115,"smiles":null,"spectrum_id":"CCMSLIB00017259428","spectrum_index":25966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-His (delta mass: 146.9093 Da; putative annotation: N/A; putative formula: C2HNO-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.008,"smiles":null,"spectrum_id":"CCMSLIB00017259431","spectrum_index":25967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 38.0517 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.232,"smiles":null,"spectrum_id":"CCMSLIB00017259432","spectrum_index":25968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 165.0638 Da; putative annotation: N/A; putative formula: C5H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.124,"smiles":null,"spectrum_id":"CCMSLIB00017259435","spectrum_index":25969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 240.1469 Da; putative annotation: N/A; putative formula: C14H25O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.243,"smiles":null,"spectrum_id":"CCMSLIB00017259436","spectrum_index":25970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 220.1366 Da; putative annotation: N/A; putative formula: C16H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.296,"smiles":null,"spectrum_id":"CCMSLIB00017259439","spectrum_index":25971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 361.3187 Da; putative annotation: N/A; putative formula: C21H39N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.379,"smiles":null,"spectrum_id":"CCMSLIB00017259442","spectrum_index":25972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 42.9962 Da; putative annotation: N/A; putative formula: CH2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.108,"smiles":null,"spectrum_id":"CCMSLIB00017259443","spectrum_index":25973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 424.1581 Da; putative annotation: N/A; putative formula: C17H28O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.25,"smiles":null,"spectrum_id":"CCMSLIB00017259446","spectrum_index":25974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 25.0075 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.094,"smiles":null,"spectrum_id":"CCMSLIB00017259448","spectrum_index":25975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 157.0738 Da; putative annotation: N/A; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.145,"smiles":null,"spectrum_id":"CCMSLIB00017259450","spectrum_index":25976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 17.0938 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.19,"smiles":null,"spectrum_id":"CCMSLIB00017259453","spectrum_index":25977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 255.0745 Da; putative annotation: N/A; putative formula: C11H13NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.134,"smiles":null,"spectrum_id":"CCMSLIB00017259455","spectrum_index":25978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 94.0631 Da; putative annotation: N/A; putative formula: C4H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017259457","spectrum_index":25979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 17.0272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.207,"smiles":null,"spectrum_id":"CCMSLIB00017259460","spectrum_index":25980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ozagrel (delta mass: 128.0359 Da; putative annotation: N/A; putative formula: C8H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017259462","spectrum_index":25981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 157.074 Da; putative annotation: N/A; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.145,"smiles":null,"spectrum_id":"CCMSLIB00017259464","spectrum_index":25982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 89.0427 Da; putative annotation: N/A; putative formula: C2H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.102,"smiles":null,"spectrum_id":"CCMSLIB00017259467","spectrum_index":25983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrimidinemethanamine (delta mass: 53.0265 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.098,"smiles":null,"spectrum_id":"CCMSLIB00017259470","spectrum_index":25984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 166.1565 Da; putative annotation: N/A; putative formula: C9H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.269,"smiles":null,"spectrum_id":"CCMSLIB00017259472","spectrum_index":25985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 297.2346 Da; putative annotation: N/A; putative formula: C15H31N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.425,"smiles":null,"spectrum_id":"CCMSLIB00017259474","spectrum_index":25986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 69.0215 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.103,"smiles":null,"spectrum_id":"CCMSLIB00017259477","spectrum_index":25987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 297.1719 Da; putative annotation: N/A; putative formula: C19H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.315,"smiles":null,"spectrum_id":"CCMSLIB00017259479","spectrum_index":25988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 112.9325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.993,"smiles":null,"spectrum_id":"CCMSLIB00017259482","spectrum_index":25989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017259485","spectrum_index":25990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 94.0418 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.175,"smiles":null,"spectrum_id":"CCMSLIB00017259486","spectrum_index":25991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 84.0117 Da; putative annotation: N/A; putative formula: C6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.188,"smiles":null,"spectrum_id":"CCMSLIB00017259489","spectrum_index":25992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3aS,3a1S,10bR,13S)-3a-ethyl-5-(methoxycarbonyl)-1,2,3,3a,3a1,4,6,11,12,13-decahydroindolizino[8,1-cd]carbazol-13-ium iodide (delta mass: 9.8733 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.08,"smiles":null,"spectrum_id":"CCMSLIB00017259492","spectrum_index":25993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 15.9773 Da; putative annotation: N/A; putative formula: O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.027,"smiles":null,"spectrum_id":"CCMSLIB00017259493","spectrum_index":25994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-mannosamine - 40.0 eV (delta mass: 674.4128 Da; putative annotation: N/A; putative formula: C34H50N12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.51,"smiles":null,"spectrum_id":"CCMSLIB00017259496","spectrum_index":25995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.081,"smiles":null,"spectrum_id":"CCMSLIB00017259499","spectrum_index":25996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 92.056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.148,"smiles":null,"spectrum_id":"CCMSLIB00017259500","spectrum_index":25997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 25.9692 Da; putative annotation: N/A; putative formula: C14H19N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.019,"smiles":null,"spectrum_id":"CCMSLIB00017259503","spectrum_index":25998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 71.0729 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.196,"smiles":null,"spectrum_id":"CCMSLIB00017259506","spectrum_index":25999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 145.1118 Da; putative annotation: N/A; putative formula: C7H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.38,"smiles":null,"spectrum_id":"CCMSLIB00017259507","spectrum_index":26000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Untitled CollisionEnergy:205060 (delta mass: 288.1771 Da; putative annotation: N/A; putative formula: C15H30OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.342,"smiles":null,"spectrum_id":"CCMSLIB00017259510","spectrum_index":26001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelenteramine (delta mass: 14.0251 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.154,"smiles":null,"spectrum_id":"CCMSLIB00017259511","spectrum_index":26002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 573.3531 Da; putative annotation: N/A; putative formula: C31H51N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.413,"smiles":null,"spectrum_id":"CCMSLIB00017259514","spectrum_index":26003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 164.0905 Da; putative annotation: N/A; putative formula: C4H12N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017259517","spectrum_index":26004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 148.1617 Da; putative annotation: N/A; putative formula: C12H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.222,"smiles":null,"spectrum_id":"CCMSLIB00017259518","spectrum_index":26005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-ethyl-2,4-dihydroxy-6-methoxyphenyl)butan-1-one (delta mass: 195.1469 Da; putative annotation: N/A; putative formula: C9H17N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.275,"smiles":null,"spectrum_id":"CCMSLIB00017259521","spectrum_index":26006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.175,"smiles":null,"spectrum_id":"CCMSLIB00017259522","spectrum_index":26007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 32.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.067,"smiles":null,"spectrum_id":"CCMSLIB00017259525","spectrum_index":26008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 243.1876 Da; putative annotation: N/A; putative formula: C11H25N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.294,"smiles":null,"spectrum_id":"CCMSLIB00017259528","spectrum_index":26009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 254.2242 Da; putative annotation: N/A; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.316,"smiles":null,"spectrum_id":"CCMSLIB00017259529","spectrum_index":26010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 120.9836 Da; putative annotation: N/A; putative formula: C2H3NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.08,"smiles":null,"spectrum_id":"CCMSLIB00017259532","spectrum_index":26011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 122.1292 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017259535","spectrum_index":26012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 26.9425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.008,"smiles":null,"spectrum_id":"CCMSLIB00017259536","spectrum_index":26013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 84.0755 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017259539","spectrum_index":26014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 118.0276 Da; putative annotation: N/A; putative formula: C5H10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.083,"smiles":null,"spectrum_id":"CCMSLIB00017259542","spectrum_index":26015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal (delta mass: 54.0409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.09,"smiles":null,"spectrum_id":"CCMSLIB00017259543","spectrum_index":26016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 46.0384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.12,"smiles":null,"spectrum_id":"CCMSLIB00017259546","spectrum_index":26017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1,2,3,4-tetrahydroquinazolin-2-one (delta mass: 17.0145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.101,"smiles":null,"spectrum_id":"CCMSLIB00017259548","spectrum_index":26018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 246.0741 Da; putative annotation: N/A; putative formula: C10H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.113,"smiles":null,"spectrum_id":"CCMSLIB00017259551","spectrum_index":26019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 104.0639 Da; putative annotation: 4-Methylbenzenemethanol; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.176,"smiles":null,"spectrum_id":"CCMSLIB00017259553","spectrum_index":26020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 910.4947 Da; putative annotation: Asperosaponin VI; putative formula: C47H74O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1091.57,"smiles":null,"spectrum_id":"CCMSLIB00017259556","spectrum_index":26021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 324.1065 Da; putative annotation: Lactulose - 30.0 eV; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.283,"smiles":null,"spectrum_id":"CCMSLIB00017259558","spectrum_index":26022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 232.0695 Da; putative annotation: 2-(1,2-Dihydroxy-2-phenylethyl)-3-hydroxy-2,3-dihydropyran-6-one; putative formula: C13H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.161,"smiles":null,"spectrum_id":"CCMSLIB00017259561","spectrum_index":26023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Venalstonine (delta mass: 336.1829 Da; putative annotation: methyl (3R,7S,8S)-7-ethyl-5-methyl-10-oxo-5,12-diazatetracyclo[9.7.0.0,?.0,?]octadeca-1(11),13,15,17-tetraene-3-carboxylate; putative formula: C21H24N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.374,"smiles":null,"spectrum_id":"CCMSLIB00017259564","spectrum_index":26024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 438.35 Da; putative annotation: (3.alpha.,9.Xi.)-3-Hydroxyolean-12-en-24-oic acid; putative formula: C30H46O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.398,"smiles":null,"spectrum_id":"CCMSLIB00017259565","spectrum_index":26025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 232.1461 Da; putative annotation: 3,7-Dihydroxy-9,11-eremophiladien-8-one; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.227,"smiles":null,"spectrum_id":"CCMSLIB00017259568","spectrum_index":26026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 209.0854 Da; putative annotation: N-Ethyl-2,4,6-trimethylbenzenesulfonamide; putative formula: C11H15NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.177,"smiles":null,"spectrum_id":"CCMSLIB00017259569","spectrum_index":26027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 350.3234 Da; putative annotation: N/A; putative formula: C22H43N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.388,"smiles":null,"spectrum_id":"CCMSLIB00017259572","spectrum_index":26028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 328.2967 Da; putative annotation: N/A; putative formula: C20H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.383,"smiles":null,"spectrum_id":"CCMSLIB00017259575","spectrum_index":26029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 88.0311 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.117,"smiles":null,"spectrum_id":"CCMSLIB00017259577","spectrum_index":26030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 254.0941 Da; putative annotation: N/A; putative formula: C16H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017259580","spectrum_index":26031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 257.1259 Da; putative annotation: N/A; putative formula: C12H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.197,"smiles":null,"spectrum_id":"CCMSLIB00017259582","spectrum_index":26032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 140.0624 Da; putative annotation: N/A; putative formula: C11H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.186,"smiles":null,"spectrum_id":"CCMSLIB00017259585","spectrum_index":26033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lansoprazole (delta mass: 132.0141 Da; putative annotation: N/A; putative formula: C7H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.097,"smiles":null,"spectrum_id":"CCMSLIB00017259587","spectrum_index":26034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 15.0837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.154,"smiles":null,"spectrum_id":"CCMSLIB00017259590","spectrum_index":26035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-3-(4-piperidinyl)-1H-indole (delta mass: 223.1139 Da; putative annotation: N/A; putative formula: C11H17N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.243,"smiles":null,"spectrum_id":"CCMSLIB00017259591","spectrum_index":26036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 70.0421 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.133,"smiles":null,"spectrum_id":"CCMSLIB00017259594","spectrum_index":26037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 65.0341 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.131,"smiles":null,"spectrum_id":"CCMSLIB00017259595","spectrum_index":26038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100215 alpha-Methyl-DL-serine|DL-2-Methylserine|2-Amino-3-hydroxy-2-methylpropanoic Acid|DL-2-Amino-3-hydroxy-2-methylpropionic Acid|DL-alpha-(Hydroxymethyl)alanine|alpha-Methylserine (delta mass: 127.0638 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.129,"smiles":null,"spectrum_id":"CCMSLIB00017259598","spectrum_index":26039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austalide B (delta mass: 491.2437 Da; putative annotation: N/A; putative formula: C26H38NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":966.476,"smiles":null,"spectrum_id":"CCMSLIB00017259601","spectrum_index":26040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.118,"smiles":null,"spectrum_id":"CCMSLIB00017259602","spectrum_index":26041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 302.0924 Da; putative annotation: N/A; putative formula: C14H23OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.163,"smiles":null,"spectrum_id":"CCMSLIB00017259605","spectrum_index":26042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 193.1566 Da; putative annotation: N/A; putative formula: C11H19N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.284,"smiles":null,"spectrum_id":"CCMSLIB00017259606","spectrum_index":26043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 193.0589 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.187,"smiles":null,"spectrum_id":"CCMSLIB00017259609","spectrum_index":26044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 124.0585 Da; putative annotation: N/A; putative formula: C2H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.154,"smiles":null,"spectrum_id":"CCMSLIB00017259610","spectrum_index":26045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 204.1362 Da; putative annotation: N/A; putative formula: C10H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017259613","spectrum_index":26046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-3-(3-methylphenyl)propanoic acid (delta mass: 114.0464 Da; putative annotation: N/A; putative formula: C3H7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.148,"smiles":null,"spectrum_id":"CCMSLIB00017259616","spectrum_index":26047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 389.1301 Da; putative annotation: N/A; putative formula: C20H23NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.19,"smiles":null,"spectrum_id":"CCMSLIB00017259617","spectrum_index":26048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 56.0332 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.109,"smiles":null,"spectrum_id":"CCMSLIB00017259620","spectrum_index":26049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 90.0674 Da; putative annotation: N/A; putative formula: H6N6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.138,"smiles":null,"spectrum_id":"CCMSLIB00017259623","spectrum_index":26050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 317.1118 Da; putative annotation: N/A; putative formula: C14H23NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.262,"smiles":null,"spectrum_id":"CCMSLIB00017259624","spectrum_index":26051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Acetyloxy)-2-naphthoic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017259627","spectrum_index":26052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 308.0864 Da; putative annotation: N/A; putative formula: C11H20N2O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.214,"smiles":null,"spectrum_id":"CCMSLIB00017259630","spectrum_index":26053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 123.1625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.291,"smiles":null,"spectrum_id":"CCMSLIB00017259631","spectrum_index":26054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 145.0202 Da; putative annotation: N/A; putative formula: C5H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.117,"smiles":null,"spectrum_id":"CCMSLIB00017259634","spectrum_index":26055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 266.245 Da; putative annotation: N/A; putative formula: C18H34O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.341,"smiles":null,"spectrum_id":"CCMSLIB00017259635","spectrum_index":26056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 135.0759 Da; putative annotation: N/A; putative formula: C2H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.153,"smiles":null,"spectrum_id":"CCMSLIB00017259638","spectrum_index":26057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 14.0244 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017259640","spectrum_index":26058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 82.0419 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017259642","spectrum_index":26059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 45.0104 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017259644","spectrum_index":26060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 131.0372 Da; putative annotation: N/A; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.161,"smiles":null,"spectrum_id":"CCMSLIB00017259647","spectrum_index":26061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-uridine (delta mass: 180.0632 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.14,"smiles":null,"spectrum_id":"CCMSLIB00017259649","spectrum_index":26062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 30.0297 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.095,"smiles":null,"spectrum_id":"CCMSLIB00017259651","spectrum_index":26063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 376.1456 Da; putative annotation: N/A; putative formula: C19H24N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.186,"smiles":null,"spectrum_id":"CCMSLIB00017259654","spectrum_index":26064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 264.2449 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.353,"smiles":null,"spectrum_id":"CCMSLIB00017259657","spectrum_index":26065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 124.1 Da; putative annotation: N/A; putative formula: C7H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.202,"smiles":null,"spectrum_id":"CCMSLIB00017259659","spectrum_index":26066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 83.9493 Da; putative annotation: N/A; putative formula: C3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.02,"smiles":null,"spectrum_id":"CCMSLIB00017259661","spectrum_index":26067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 262.1573 Da; putative annotation: N/A; putative formula: C16H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.296,"smiles":null,"spectrum_id":"CCMSLIB00017259664","spectrum_index":26068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 113.0818 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.258,"smiles":null,"spectrum_id":"CCMSLIB00017259665","spectrum_index":26069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 362.1507 Da; putative annotation: N/A; putative formula: C17H23N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.211,"smiles":null,"spectrum_id":"CCMSLIB00017259668","spectrum_index":26070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.128,"smiles":null,"spectrum_id":"CCMSLIB00017259671","spectrum_index":26071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 464.1161 Da; putative annotation: N/A; putative formula: C31H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.176,"smiles":null,"spectrum_id":"CCMSLIB00017259672","spectrum_index":26072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 305.2592 Da; putative annotation: N/A; putative formula: C17H31N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.34,"smiles":null,"spectrum_id":"CCMSLIB00017259675","spectrum_index":26073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 74.4352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.5,"smiles":null,"spectrum_id":"CCMSLIB00017259678","spectrum_index":26074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 274.1257 Da; putative annotation: N/A; putative formula: C14H18N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.206,"smiles":null,"spectrum_id":"CCMSLIB00017259679","spectrum_index":26075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 67.0219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.119,"smiles":null,"spectrum_id":"CCMSLIB00017259682","spectrum_index":26076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 129.0424 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.155,"smiles":null,"spectrum_id":"CCMSLIB00017259685","spectrum_index":26077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 143.072 Da; putative annotation: N/A; putative formula: C4H10N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.143,"smiles":null,"spectrum_id":"CCMSLIB00017259686","spectrum_index":26078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 131.041 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.076,"smiles":null,"spectrum_id":"CCMSLIB00017259689","spectrum_index":26079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 140.0445 Da; putative annotation: N/A; putative formula: C3H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.12,"smiles":null,"spectrum_id":"CCMSLIB00017259690","spectrum_index":26080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 127.0643 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.129,"smiles":null,"spectrum_id":"CCMSLIB00017259693","spectrum_index":26081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 52.0314 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.102,"smiles":null,"spectrum_id":"CCMSLIB00017259696","spectrum_index":26082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 796.2656 Da; putative annotation: N/A; putative formula: C48H40N6O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":923.305,"smiles":null,"spectrum_id":"CCMSLIB00017259697","spectrum_index":26083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1107.5517 Da; putative annotation: N/A; putative formula: C58H81N3O18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1270.61,"smiles":null,"spectrum_id":"CCMSLIB00017259700","spectrum_index":26084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 217.0961 Da; putative annotation: N/A; putative formula: C10H19NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.198,"smiles":null,"spectrum_id":"CCMSLIB00017259703","spectrum_index":26085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 197.143 Da; putative annotation: N/A; putative formula: C11H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.208,"smiles":null,"spectrum_id":"CCMSLIB00017259704","spectrum_index":26086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 62.0521 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.242,"smiles":null,"spectrum_id":"CCMSLIB00017259706","spectrum_index":26087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 46.0049 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.065,"smiles":null,"spectrum_id":"CCMSLIB00017259709","spectrum_index":26088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 28.0025 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.078,"smiles":null,"spectrum_id":"CCMSLIB00017259711","spectrum_index":26089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 59.0375 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.108,"smiles":null,"spectrum_id":"CCMSLIB00017259713","spectrum_index":26090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 52.0424 Da; putative annotation: N/A; putative formula: C3H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.14,"smiles":null,"spectrum_id":"CCMSLIB00017259716","spectrum_index":26091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 75.999 Da; putative annotation: N/A; putative formula: C2H6O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.148,"smiles":null,"spectrum_id":"CCMSLIB00017259719","spectrum_index":26092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 36.0217 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.171,"smiles":null,"spectrum_id":"CCMSLIB00017259720","spectrum_index":26093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 44.057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.105,"smiles":null,"spectrum_id":"CCMSLIB00017259723","spectrum_index":26094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 131.0592 Da; putative annotation: N/A; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.245,"smiles":null,"spectrum_id":"CCMSLIB00017259724","spectrum_index":26095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 244.0863 Da; putative annotation: N/A; putative formula: C14H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.189,"smiles":null,"spectrum_id":"CCMSLIB00017259727","spectrum_index":26096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 42.0795 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.127,"smiles":null,"spectrum_id":"CCMSLIB00017259730","spectrum_index":26097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 55.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.076,"smiles":null,"spectrum_id":"CCMSLIB00017259731","spectrum_index":26098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-9H-pyrido[2,3-b]indole (AalphaC) (delta mass: 27.984 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.071,"smiles":null,"spectrum_id":"CCMSLIB00017259734","spectrum_index":26099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 91.9884 Da; putative annotation: N/A; putative formula: C5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.085,"smiles":null,"spectrum_id":"CCMSLIB00017259737","spectrum_index":26100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 24.0365 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.169,"smiles":null,"spectrum_id":"CCMSLIB00017259739","spectrum_index":26101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 79.9616 Da; putative annotation: N/A; putative formula: H2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.066,"smiles":null,"spectrum_id":"CCMSLIB00017259741","spectrum_index":26102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 63.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.129,"smiles":null,"spectrum_id":"CCMSLIB00017259744","spectrum_index":26103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 82.9723 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.023,"smiles":null,"spectrum_id":"CCMSLIB00017259746","spectrum_index":26104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 30.0547 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.114,"smiles":null,"spectrum_id":"CCMSLIB00017259748","spectrum_index":26105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 618.3871 Da; putative annotation: N/A; putative formula: C39H50N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.489,"smiles":null,"spectrum_id":"CCMSLIB00017259751","spectrum_index":26106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 400.1728 Da; putative annotation: N/A; putative formula: C14H33N4O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.322,"smiles":null,"spectrum_id":"CCMSLIB00017259754","spectrum_index":26107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-imidazol-5-yl-2-[(4-methoxyphenyl)carbonylamino]propanoic acid CollisionEnergy:205060 (delta mass: 183.0726 Da; putative annotation: N/A; putative formula: C2H5N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.186,"smiles":null,"spectrum_id":"CCMSLIB00017259757","spectrum_index":26108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017259759","spectrum_index":26109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 459.4287 Da; putative annotation: N/A; putative formula: C28H53N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.51,"smiles":null,"spectrum_id":"CCMSLIB00017259761","spectrum_index":26110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 65.01 Da; putative annotation: N/A; putative formula: CH-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.07,"smiles":null,"spectrum_id":"CCMSLIB00017259764","spectrum_index":26111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paxilline (delta mass: 18.2518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.5,"smiles":null,"spectrum_id":"CCMSLIB00017259766","spectrum_index":26112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017259769","spectrum_index":26113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 92.0843 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.165,"smiles":null,"spectrum_id":"CCMSLIB00017259771","spectrum_index":26114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 198.0867 Da; putative annotation: N/A; putative formula: C14H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.188,"smiles":null,"spectrum_id":"CCMSLIB00017259773","spectrum_index":26115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 100.0251 Da; putative annotation: N/A; putative formula: C3H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.066,"smiles":null,"spectrum_id":"CCMSLIB00017259776","spectrum_index":26116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 189.1 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.165,"smiles":null,"spectrum_id":"CCMSLIB00017259779","spectrum_index":26117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 336.1413 Da; putative annotation: N/A; putative formula: C19H20N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.182,"smiles":null,"spectrum_id":"CCMSLIB00017259780","spectrum_index":26118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311014 Feruloyl agmatine (isomer of 1607) (delta mass: 102.0316 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.208,"smiles":null,"spectrum_id":"CCMSLIB00017259783","spectrum_index":26119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-5-carboxylic acid (delta mass: 68.035 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.09,"smiles":null,"spectrum_id":"CCMSLIB00017259786","spectrum_index":26120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Threonine (delta mass: 238.1938 Da; putative annotation: N/A; putative formula: C15H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.259,"smiles":null,"spectrum_id":"CCMSLIB00017259787","spectrum_index":26121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 54.9969 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.141,"smiles":null,"spectrum_id":"CCMSLIB00017259790","spectrum_index":26122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 631.3732 Da; putative annotation: N/A; putative formula: C36H49N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.444,"smiles":null,"spectrum_id":"CCMSLIB00017259792","spectrum_index":26123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 222.0843 Da; putative annotation: N/A; putative formula: C9H19O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.218,"smiles":null,"spectrum_id":"CCMSLIB00017259794","spectrum_index":26124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 38.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.046,"smiles":null,"spectrum_id":"CCMSLIB00017259797","spectrum_index":26125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 99.0716 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.212,"smiles":null,"spectrum_id":"CCMSLIB00017259799","spectrum_index":26126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 527.2105 Da; putative annotation: N/A; putative formula: C36H33NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.302,"smiles":null,"spectrum_id":"CCMSLIB00017259801","spectrum_index":26127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 76.0156 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.107,"smiles":null,"spectrum_id":"CCMSLIB00017259804","spectrum_index":26128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 212.1403 Da; putative annotation: N/A; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.2,"smiles":null,"spectrum_id":"CCMSLIB00017259806","spectrum_index":26129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 176.0256 Da; putative annotation: N/A; putative formula: C5H8N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.17,"smiles":null,"spectrum_id":"CCMSLIB00017259808","spectrum_index":26130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 60.1188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.258,"smiles":null,"spectrum_id":"CCMSLIB00017259811","spectrum_index":26131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 69.0217 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017259814","spectrum_index":26132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 563.3827 Da; putative annotation: N/A; putative formula: C27H50N9O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.443,"smiles":null,"spectrum_id":"CCMSLIB00017259816","spectrum_index":26133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 242.1699 Da; putative annotation: N/A; putative formula: C14H26OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.266,"smiles":null,"spectrum_id":"CCMSLIB00017259819","spectrum_index":26134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 485.1732 Da; putative annotation: N/A; putative formula: C22H33NO7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.349,"smiles":null,"spectrum_id":"CCMSLIB00017259821","spectrum_index":26135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phenol, 4-(2-aminoethyl)- from NIST14 (delta mass: 583.3722 Da; putative annotation: N/A; putative formula: C31H53NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.464,"smiles":null,"spectrum_id":"CCMSLIB00017259824","spectrum_index":26136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 370.2861 Da; putative annotation: N/A; putative formula: C25H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.336,"smiles":null,"spectrum_id":"CCMSLIB00017259825","spectrum_index":26137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 217.0446 Da; putative annotation: N/A; putative formula: C15H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.136,"smiles":null,"spectrum_id":"CCMSLIB00017259828","spectrum_index":26138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 405.3445 Da; putative annotation: N/A; putative formula: C19H39N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.415,"smiles":null,"spectrum_id":"CCMSLIB00017259830","spectrum_index":26139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 113.0482 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.15,"smiles":null,"spectrum_id":"CCMSLIB00017259832","spectrum_index":26140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 230.1162 Da; putative annotation: N/A; putative formula: C12H22S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.254,"smiles":null,"spectrum_id":"CCMSLIB00017259835","spectrum_index":26141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 177.0618 Da; putative annotation: N/A; putative formula: C3H3N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.099,"smiles":null,"spectrum_id":"CCMSLIB00017259837","spectrum_index":26142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 346.0853 Da; putative annotation: N/A; putative formula: C22H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.182,"smiles":null,"spectrum_id":"CCMSLIB00017259839","spectrum_index":26143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 76.0203 Da; putative annotation: N/A; putative formula: H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.1,"smiles":null,"spectrum_id":"CCMSLIB00017259842","spectrum_index":26144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 248.1404 Da; putative annotation: N/A; putative formula: C15H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.211,"smiles":null,"spectrum_id":"CCMSLIB00017259845","spectrum_index":26145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 131.0585 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017259847","spectrum_index":26146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 48.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.301,"smiles":null,"spectrum_id":"CCMSLIB00017259849","spectrum_index":26147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 267.1792 Da; putative annotation: N/A; putative formula: C11H21N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.365,"smiles":null,"spectrum_id":"CCMSLIB00017259852","spectrum_index":26148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimifugin (delta mass: 91.9943 Da; putative annotation: N/A; putative formula: C2H6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.112,"smiles":null,"spectrum_id":"CCMSLIB00017259854","spectrum_index":26149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 151.1931 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.305,"smiles":null,"spectrum_id":"CCMSLIB00017259857","spectrum_index":26150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 79.966 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.026,"smiles":null,"spectrum_id":"CCMSLIB00017259859","spectrum_index":26151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1124.8175 Da; putative annotation: N/A; putative formula: C58H104N14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1346.91,"smiles":null,"spectrum_id":"CCMSLIB00017259862","spectrum_index":26152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 9.9841 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017259864","spectrum_index":26153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 69.9974 Da; putative annotation: N/A; putative formula: C3H3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.079,"smiles":null,"spectrum_id":"CCMSLIB00017259867","spectrum_index":26154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 786.6808 Da; putative annotation: N/A; putative formula: C44H90N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1008.78,"smiles":null,"spectrum_id":"CCMSLIB00017259869","spectrum_index":26155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Phenylalanine, methyl ester (delta mass: 42.0092 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.111,"smiles":null,"spectrum_id":"CCMSLIB00017259871","spectrum_index":26156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 15.0185 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.09,"smiles":null,"spectrum_id":"CCMSLIB00017259874","spectrum_index":26157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 42.0142 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.085,"smiles":null,"spectrum_id":"CCMSLIB00017259876","spectrum_index":26158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 304.1418 Da; putative annotation: N/A; putative formula: C18H25PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.239,"smiles":null,"spectrum_id":"CCMSLIB00017259878","spectrum_index":26159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 101.0536 Da; putative annotation: N/A; putative formula: C3H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017259881","spectrum_index":26160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 63.074 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017259883","spectrum_index":26161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 172.004 Da; putative annotation: N/A; putative formula: C5H5N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.091,"smiles":null,"spectrum_id":"CCMSLIB00017259885","spectrum_index":26162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 95.1845 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.276,"smiles":null,"spectrum_id":"CCMSLIB00017259888","spectrum_index":26163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 106.0626 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.143,"smiles":null,"spectrum_id":"CCMSLIB00017259891","spectrum_index":26164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methanone, [1-(2-hydroxypentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)- (delta mass: 100.0526 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.28,"smiles":null,"spectrum_id":"CCMSLIB00017259892","spectrum_index":26165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 101.0845 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.186,"smiles":null,"spectrum_id":"CCMSLIB00017259895","spectrum_index":26166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 85.0524 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.165,"smiles":null,"spectrum_id":"CCMSLIB00017259898","spectrum_index":26167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 85.0535 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.177,"smiles":null,"spectrum_id":"CCMSLIB00017259899","spectrum_index":26168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Hydroxymethyl)-2,4a,7,10b-tetramethyl-1a,2a,4,4a,10,10a,10b,11a-octahydro-2H,7H-[1]benzoxireno[3,4-f]pyrano[2,3-b]chromene-9,11(3H,8H)-dione (delta mass: 60.0369 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.233,"smiles":null,"spectrum_id":"CCMSLIB00017259902","spectrum_index":26169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 281.0715 Da; putative annotation: N/A; putative formula: C15H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.152,"smiles":null,"spectrum_id":"CCMSLIB00017259904","spectrum_index":26170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 116.0471 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.128,"smiles":null,"spectrum_id":"CCMSLIB00017259906","spectrum_index":26171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 564.1633 Da; putative annotation: N/A; putative formula: C23H36N2O8S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.223,"smiles":null,"spectrum_id":"CCMSLIB00017259909","spectrum_index":26172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017259911","spectrum_index":26173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 334.0499 Da; putative annotation: N/A; putative formula: C20H16O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.11,"smiles":null,"spectrum_id":"CCMSLIB00017259914","spectrum_index":26174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 18.0533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.165,"smiles":null,"spectrum_id":"CCMSLIB00017259916","spectrum_index":26175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 17.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.076,"smiles":null,"spectrum_id":"CCMSLIB00017259918","spectrum_index":26176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 600.1275 Da; putative annotation: N/A; putative formula: C25H24N6O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.209,"smiles":null,"spectrum_id":"CCMSLIB00017259921","spectrum_index":26177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 46.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.16,"smiles":null,"spectrum_id":"CCMSLIB00017259923","spectrum_index":26178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 208.1828 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.306,"smiles":null,"spectrum_id":"CCMSLIB00017259925","spectrum_index":26179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-phenylalanine (delta mass: 74.0005 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.097,"smiles":null,"spectrum_id":"CCMSLIB00017259928","spectrum_index":26180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 227.1048 Da; putative annotation: N/A; putative formula: C13H13N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.159,"smiles":null,"spectrum_id":"CCMSLIB00017259929","spectrum_index":26181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 448.3634 Da; putative annotation: N/A; putative formula: C23H44N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.455,"smiles":null,"spectrum_id":"CCMSLIB00017259932","spectrum_index":26182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 30.009 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.1,"smiles":null,"spectrum_id":"CCMSLIB00017259934","spectrum_index":26183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 96.0784 Da; putative annotation: N/A; putative formula: C4H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017259936","spectrum_index":26184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Ile (delta mass: 241.1787 Da; putative annotation: Leu-Lys; putative formula: C12H23N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.376,"smiles":null,"spectrum_id":"CCMSLIB00017259939","spectrum_index":26185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Tyr from NIST14 (delta mass: 163.0643 Da; putative annotation: DL-o-Tyrosine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.229,"smiles":null,"spectrum_id":"CCMSLIB00017259941","spectrum_index":26186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 170.1053 Da; putative annotation: Glycyl-L-norleucine; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.26,"smiles":null,"spectrum_id":"CCMSLIB00017259943","spectrum_index":26187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 58.0418 Da; putative annotation: 1,3-Propanediol; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.091,"smiles":null,"spectrum_id":"CCMSLIB00017259946","spectrum_index":26188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 122.0574 Da; putative annotation: 5-Amino-1-methyl-1H-pyrazole-4-carboxamide; putative formula: C5H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.18,"smiles":null,"spectrum_id":"CCMSLIB00017259948","spectrum_index":26189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 316.2412 Da; putative annotation: 5.beta.-Pregnane-3.alpha.,17-diol-20-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.365,"smiles":null,"spectrum_id":"CCMSLIB00017259950","spectrum_index":26190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 126.0326 Da; putative annotation: 2-(Hydroxymethyl)-3-methoxy-2H-furan-5-one; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.156,"smiles":null,"spectrum_id":"CCMSLIB00017259953","spectrum_index":26191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 309.3006 Da; putative annotation: Stearoyl ethanolamide; putative formula: C20H39NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.527,"smiles":null,"spectrum_id":"CCMSLIB00017259954","spectrum_index":26192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 269.2716 Da; putative annotation: Heptadecasphinganine; putative formula: C17H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.342,"smiles":null,"spectrum_id":"CCMSLIB00017259957","spectrum_index":26193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 165.0903 Da; putative annotation: N/A; putative formula: C8H11N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.15,"smiles":null,"spectrum_id":"CCMSLIB00017259960","spectrum_index":26194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.107,"smiles":null,"spectrum_id":"CCMSLIB00017259961","spectrum_index":26195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087703 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 340.2937 Da; putative annotation: N/A; putative formula: C13H32N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.358,"smiles":null,"spectrum_id":"CCMSLIB00017259964","spectrum_index":26196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 197.1547 Da; putative annotation: N/A; putative formula: C10H19N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.226,"smiles":null,"spectrum_id":"CCMSLIB00017259966","spectrum_index":26197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-(2-fluorophenoxy)ethanamine (delta mass: 35.0173 Da; putative annotation: N/A; putative formula: C3HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.146,"smiles":null,"spectrum_id":"CCMSLIB00017259968","spectrum_index":26198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 137.0685 Da; putative annotation: N/A; putative formula: C5H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.118,"smiles":null,"spectrum_id":"CCMSLIB00017259971","spectrum_index":26199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 124.0672 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.191,"smiles":null,"spectrum_id":"CCMSLIB00017259974","spectrum_index":26200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 118.0446 Da; putative annotation: N/A; putative formula: C5H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.1,"smiles":null,"spectrum_id":"CCMSLIB00017259976","spectrum_index":26201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:102040 (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017259979","spectrum_index":26202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 77.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.144,"smiles":null,"spectrum_id":"CCMSLIB00017259981","spectrum_index":26203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.086,"smiles":null,"spectrum_id":"CCMSLIB00017259984","spectrum_index":26204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 118.0318 Da; putative annotation: N/A; putative formula: C2H6N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.153,"smiles":null,"spectrum_id":"CCMSLIB00017259987","spectrum_index":26205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 18.1071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.24,"smiles":null,"spectrum_id":"CCMSLIB00017259989","spectrum_index":26206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 999.5034 Da; putative annotation: N/A; putative formula: C47H73N11O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1180.57,"smiles":null,"spectrum_id":"CCMSLIB00017259991","spectrum_index":26207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 54.8737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.976,"smiles":null,"spectrum_id":"CCMSLIB00017259994","spectrum_index":26208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 226.1299 Da; putative annotation: N/A; putative formula: C7H14N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.238,"smiles":null,"spectrum_id":"CCMSLIB00017259997","spectrum_index":26209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381092-01_C15H20O8_2-Acetyl-5-hydroxy-3-methylphenyl beta-D-glucopyranoside (delta mass: 200.0628 Da; putative annotation: N/A; putative formula: C16H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.186,"smiles":null,"spectrum_id":"CCMSLIB00017259999","spectrum_index":26210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 325.3583 Da; putative annotation: N/A; putative formula: C19H43N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.481,"smiles":null,"spectrum_id":"CCMSLIB00017260002","spectrum_index":26211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 163.0278 Da; putative annotation: N/A; putative formula: CH5N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.155,"smiles":null,"spectrum_id":"CCMSLIB00017260004","spectrum_index":26212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 91.991 Da; putative annotation: N/A; putative formula: C5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.13,"smiles":null,"spectrum_id":"CCMSLIB00017260006","spectrum_index":26213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 221.046 Da; putative annotation: N/A; putative formula: C8H16NPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.106,"smiles":null,"spectrum_id":"CCMSLIB00017260009","spectrum_index":26214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000528 4-methoxy-1H-indole-3-carbaldehyde (delta mass: 116.0946 Da; putative annotation: N/A; putative formula: C5H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.165,"smiles":null,"spectrum_id":"CCMSLIB00017260012","spectrum_index":26215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Amino-1-benzyluracil (delta mass: 96.046 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.138,"smiles":null,"spectrum_id":"CCMSLIB00017260013","spectrum_index":26216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 115.1607 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.242,"smiles":null,"spectrum_id":"CCMSLIB00017260016","spectrum_index":26217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin D (delta mass: 95.1147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.3,"smiles":null,"spectrum_id":"CCMSLIB00017260019","spectrum_index":26218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 17.1227 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.16,"smiles":null,"spectrum_id":"CCMSLIB00017260020","spectrum_index":26219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 395.1412 Da; putative annotation: N/A; putative formula: C22H18N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.265,"smiles":null,"spectrum_id":"CCMSLIB00017260023","spectrum_index":26220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 34.9524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.055,"smiles":null,"spectrum_id":"CCMSLIB00017260024","spectrum_index":26221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 113.0361 Da; putative annotation: N/A; putative formula: C7H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.17,"smiles":null,"spectrum_id":"CCMSLIB00017260027","spectrum_index":26222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 59.0314 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.047,"smiles":null,"spectrum_id":"CCMSLIB00017260029","spectrum_index":26223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 60.166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.182,"smiles":null,"spectrum_id":"CCMSLIB00017260031","spectrum_index":26224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole (delta mass: 16.9976 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.105,"smiles":null,"spectrum_id":"CCMSLIB00017260034","spectrum_index":26225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 662.4476 Da; putative annotation: N/A; putative formula: C43H59N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.529,"smiles":null,"spectrum_id":"CCMSLIB00017260037","spectrum_index":26226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 102.083 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017260038","spectrum_index":26227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 380.2539 Da; putative annotation: N/A; putative formula: C26H36S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.334,"smiles":null,"spectrum_id":"CCMSLIB00017260041","spectrum_index":26228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 265.1528 Da; putative annotation: N/A; putative formula: C11H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.245,"smiles":null,"spectrum_id":"CCMSLIB00017260044","spectrum_index":26229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 110.0358 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.159,"smiles":null,"spectrum_id":"CCMSLIB00017260045","spectrum_index":26230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 273.1233 Da; putative annotation: N/A; putative formula: C6H15N11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.204,"smiles":null,"spectrum_id":"CCMSLIB00017260048","spectrum_index":26231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine (delta mass: 217.0266 Da; putative annotation: N/A; putative formula: C5H7N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.134,"smiles":null,"spectrum_id":"CCMSLIB00017260051","spectrum_index":26232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 90.0469 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.102,"smiles":null,"spectrum_id":"CCMSLIB00017260052","spectrum_index":26233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 221.0892 Da; putative annotation: N/A; putative formula: C12H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.186,"smiles":null,"spectrum_id":"CCMSLIB00017260055","spectrum_index":26234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 128.0582 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.203,"smiles":null,"spectrum_id":"CCMSLIB00017260056","spectrum_index":26235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clusiacyclol A (delta mass: 78.0446 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.219,"smiles":null,"spectrum_id":"CCMSLIB00017260059","spectrum_index":26236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 388.1897 Da; putative annotation: N/A; putative formula: C23H24N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.26,"smiles":null,"spectrum_id":"CCMSLIB00017260062","spectrum_index":26237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 147.9055 Da; putative annotation: N/A; putative formula: C3HO-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.977,"smiles":null,"spectrum_id":"CCMSLIB00017260064","spectrum_index":26238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 153.0391 Da; putative annotation: N/A; putative formula: C2H7N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.098,"smiles":null,"spectrum_id":"CCMSLIB00017260066","spectrum_index":26239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 821.5489 Da; putative annotation: N/A; putative formula: C47H75N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":984.609,"smiles":null,"spectrum_id":"CCMSLIB00017260069","spectrum_index":26240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 482.2918 Da; putative annotation: N/A; putative formula: C26H39N6OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.362,"smiles":null,"spectrum_id":"CCMSLIB00017260072","spectrum_index":26241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 284.2755 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.347,"smiles":null,"spectrum_id":"CCMSLIB00017260073","spectrum_index":26242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 810.3875 Da; putative annotation: N/A; putative formula: C42H58N4O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":961.448,"smiles":null,"spectrum_id":"CCMSLIB00017260076","spectrum_index":26243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 271.1756 Da; putative annotation: N/A; putative formula: C10H21N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.23,"smiles":null,"spectrum_id":"CCMSLIB00017260079","spectrum_index":26244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 41.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.112,"smiles":null,"spectrum_id":"CCMSLIB00017260080","spectrum_index":26245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 243.1322 Da; putative annotation: N/A; putative formula: C11H22N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.203,"smiles":null,"spectrum_id":"CCMSLIB00017260083","spectrum_index":26246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 66.0102 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.07,"smiles":null,"spectrum_id":"CCMSLIB00017260085","spectrum_index":26247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 26.9862 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.114,"smiles":null,"spectrum_id":"CCMSLIB00017260087","spectrum_index":26248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 101.0839 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.17,"smiles":null,"spectrum_id":"CCMSLIB00017260090","spectrum_index":26249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 172.0739 Da; putative annotation: N/A; putative formula: C8H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.134,"smiles":null,"spectrum_id":"CCMSLIB00017260093","spectrum_index":26250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1028.5211 Da; putative annotation: N/A; putative formula: C74H68N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1191.58,"smiles":null,"spectrum_id":"CCMSLIB00017260094","spectrum_index":26251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 119.0466 Da; putative annotation: N/A; putative formula: C6H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017260097","spectrum_index":26252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis,cis-9,12-Octadecadien-1-ol (delta mass: 70.0781 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.346,"smiles":null,"spectrum_id":"CCMSLIB00017260098","spectrum_index":26253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 144.049 Da; putative annotation: N/A; putative formula: C10H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.125,"smiles":null,"spectrum_id":"CCMSLIB00017260101","spectrum_index":26254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 128.9891 Da; putative annotation: N/A; putative formula: C4H5NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.037,"smiles":null,"spectrum_id":"CCMSLIB00017260104","spectrum_index":26255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 117.1801 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.266,"smiles":null,"spectrum_id":"CCMSLIB00017260105","spectrum_index":26256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 64.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017260108","spectrum_index":26257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310825 N-Fructosyl isoleucine (delta mass: 326.2453 Da; putative annotation: N/A; putative formula: C19H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.4,"smiles":null,"spectrum_id":"CCMSLIB00017260109","spectrum_index":26258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 828.2858 Da; putative annotation: N/A; putative formula: C37H41N12O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1495.51,"smiles":null,"spectrum_id":"CCMSLIB00017260112","spectrum_index":26259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 524.4561 Da; putative annotation: N/A; putative formula: C32H64N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1117.73,"smiles":null,"spectrum_id":"CCMSLIB00017260115","spectrum_index":26260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 252.0219 Da; putative annotation: N/A; putative formula: C11H4N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.098,"smiles":null,"spectrum_id":"CCMSLIB00017260116","spectrum_index":26261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 90.0464 Da; putative annotation: N/A; putative formula: CH7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.111,"smiles":null,"spectrum_id":"CCMSLIB00017260119","spectrum_index":26262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-acetaldehyde CollisionEnergy:205060 (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.102,"smiles":null,"spectrum_id":"CCMSLIB00017260122","spectrum_index":26263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 270.1253 Da; putative annotation: N/A; putative formula: C17H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.274,"smiles":null,"spectrum_id":"CCMSLIB00017260124","spectrum_index":26264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 369.1658 Da; putative annotation: N/A; putative formula: C16H27N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.33,"smiles":null,"spectrum_id":"CCMSLIB00017260126","spectrum_index":26265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 75.9906 Da; putative annotation: N/A; putative formula: N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.055,"smiles":null,"spectrum_id":"CCMSLIB00017260129","spectrum_index":26266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 576.49 Da; putative annotation: N/A; putative formula: C40H64O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1185.76,"smiles":null,"spectrum_id":"CCMSLIB00017260130","spectrum_index":26267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 190.1126 Da; putative annotation: N/A; putative formula: C9H19O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.193,"smiles":null,"spectrum_id":"CCMSLIB00017260133","spectrum_index":26268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 191.0582 Da; putative annotation: N/A; putative formula: C10H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.181,"smiles":null,"spectrum_id":"CCMSLIB00017260136","spectrum_index":26269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.091,"smiles":null,"spectrum_id":"CCMSLIB00017260139","spectrum_index":26270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 90.0798 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.27,"smiles":null,"spectrum_id":"CCMSLIB00017260140","spectrum_index":26271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 12.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.144,"smiles":null,"spectrum_id":"CCMSLIB00017260143","spectrum_index":26272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 87.0413 Da; putative annotation: N/A; putative formula: C2H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.101,"smiles":null,"spectrum_id":"CCMSLIB00017260146","spectrum_index":26273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 713.3477 Da; putative annotation: N/A; putative formula: C45H43N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":876.408,"smiles":null,"spectrum_id":"CCMSLIB00017260148","spectrum_index":26274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3-(2-Hydroxyethyl)indole from NIST14 (delta mass: 108.0225 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.114,"smiles":null,"spectrum_id":"CCMSLIB00017260150","spectrum_index":26275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 32.0559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.106,"smiles":null,"spectrum_id":"CCMSLIB00017260153","spectrum_index":26276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 306.1891 Da; putative annotation: N/A; putative formula: C14H31N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.307,"smiles":null,"spectrum_id":"CCMSLIB00017260154","spectrum_index":26277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 44.0295 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.09,"smiles":null,"spectrum_id":"CCMSLIB00017260157","spectrum_index":26278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 25.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.186,"smiles":null,"spectrum_id":"CCMSLIB00017260160","spectrum_index":26279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyltyramine (delta mass: 102.0299 Da; putative annotation: N/A; putative formula: H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.137,"smiles":null,"spectrum_id":"CCMSLIB00017260161","spectrum_index":26280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 25.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.14,"smiles":null,"spectrum_id":"CCMSLIB00017260164","spectrum_index":26281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 86.036 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.075,"smiles":null,"spectrum_id":"CCMSLIB00017260167","spectrum_index":26282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 80.0472 Da; putative annotation: N/A; putative formula: C3H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.144,"smiles":null,"spectrum_id":"CCMSLIB00017260168","spectrum_index":26283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 345.1933 Da; putative annotation: N/A; putative formula: C14H28N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.27,"smiles":null,"spectrum_id":"CCMSLIB00017260171","spectrum_index":26284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 154.0995 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.18,"smiles":null,"spectrum_id":"CCMSLIB00017260172","spectrum_index":26285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 164.0671 Da; putative annotation: N/A; putative formula: C3H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.169,"smiles":null,"spectrum_id":"CCMSLIB00017260175","spectrum_index":26286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 41.0605 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.173,"smiles":null,"spectrum_id":"CCMSLIB00017260178","spectrum_index":26287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 43.0521 Da; putative annotation: N/A; putative formula: CH5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.112,"smiles":null,"spectrum_id":"CCMSLIB00017260180","spectrum_index":26288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 64.0157 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.118,"smiles":null,"spectrum_id":"CCMSLIB00017260182","spectrum_index":26289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 68.0262 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017260185","spectrum_index":26290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 600.4282 Da; putative annotation: N/A; putative formula: C33H57N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.525,"smiles":null,"spectrum_id":"CCMSLIB00017260188","spectrum_index":26291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 164.0477 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.129,"smiles":null,"spectrum_id":"CCMSLIB00017260190","spectrum_index":26292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 248.1654 Da; putative annotation: N/A; putative formula: C11H25N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.304,"smiles":null,"spectrum_id":"CCMSLIB00017260192","spectrum_index":26293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 130.076 Da; putative annotation: N/A; putative formula: C4H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.147,"smiles":null,"spectrum_id":"CCMSLIB00017260195","spectrum_index":26294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 75.0472 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.16,"smiles":null,"spectrum_id":"CCMSLIB00017260198","spectrum_index":26295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 171.0895 Da; putative annotation: N/A; putative formula: C8H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.181,"smiles":null,"spectrum_id":"CCMSLIB00017260200","spectrum_index":26296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,5-tetrahydro-1H-azepin[4,5-b]indole (delta mass: 390.275 Da; putative annotation: N/A; putative formula: C20H44N2O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.414,"smiles":null,"spectrum_id":"CCMSLIB00017260202","spectrum_index":26297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 642.4124 Da; putative annotation: N/A; putative formula: C30H62N2O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":835.483,"smiles":null,"spectrum_id":"CCMSLIB00017260205","spectrum_index":26298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 9.0351 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.277,"smiles":null,"spectrum_id":"CCMSLIB00017260207","spectrum_index":26299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 306.0967 Da; putative annotation: N/A; putative formula: C14H26O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.225,"smiles":null,"spectrum_id":"CCMSLIB00017260210","spectrum_index":26300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 503.2005 Da; putative annotation: N/A; putative formula: C28H25N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.287,"smiles":null,"spectrum_id":"CCMSLIB00017260213","spectrum_index":26301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 983.4907 Da; putative annotation: N/A; putative formula: C48H93N3O-1S9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1146.55,"smiles":null,"spectrum_id":"CCMSLIB00017260215","spectrum_index":26302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyomeprazole sulfide (delta mass: 44.1991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.31,"smiles":null,"spectrum_id":"CCMSLIB00017260217","spectrum_index":26303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 195.1463 Da; putative annotation: N/A; putative formula: C12H21NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.336,"smiles":null,"spectrum_id":"CCMSLIB00017260220","spectrum_index":26304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 15.995 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.118,"smiles":null,"spectrum_id":"CCMSLIB00017260223","spectrum_index":26305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 230.1283 Da; putative annotation: N/A; putative formula: C11H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.23,"smiles":null,"spectrum_id":"CCMSLIB00017260224","spectrum_index":26306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 75.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.149,"smiles":null,"spectrum_id":"CCMSLIB00017260227","spectrum_index":26307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000497 3-Acetylindole|1-(1H-indol-3-yl)ethanone (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.108,"smiles":null,"spectrum_id":"CCMSLIB00017260230","spectrum_index":26308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 122.8286 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.097,"smiles":null,"spectrum_id":"CCMSLIB00017260232","spectrum_index":26309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 36.9356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.085,"smiles":null,"spectrum_id":"CCMSLIB00017260234","spectrum_index":26310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 68.0081 Da; putative annotation: N/A; putative formula: C4H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.083,"smiles":null,"spectrum_id":"CCMSLIB00017260237","spectrum_index":26311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 28.99 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.081,"smiles":null,"spectrum_id":"CCMSLIB00017260239","spectrum_index":26312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 263.1372 Da; putative annotation: N/A; putative formula: C11H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.208,"smiles":null,"spectrum_id":"CCMSLIB00017260241","spectrum_index":26313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 86.0837 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.165,"smiles":null,"spectrum_id":"CCMSLIB00017260244","spectrum_index":26314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 82.026 Da; putative annotation: N/A; putative formula: C5H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.106,"smiles":null,"spectrum_id":"CCMSLIB00017260247","spectrum_index":26315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 526.6985 Da; putative annotation: N/A; putative formula: C9H5NOS12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.822,"smiles":null,"spectrum_id":"CCMSLIB00017260248","spectrum_index":26316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 76.0312 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017260251","spectrum_index":26317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 389.205 Da; putative annotation: N/A; putative formula: C18H31NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.276,"smiles":null,"spectrum_id":"CCMSLIB00017260254","spectrum_index":26318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 473.2475 Da; putative annotation: N/A; putative formula: C25H31N9O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.318,"smiles":null,"spectrum_id":"CCMSLIB00017260255","spectrum_index":26319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE0; MS2Dec (delta mass: 126.1046 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.165,"smiles":null,"spectrum_id":"CCMSLIB00017260258","spectrum_index":26320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 254.1885 Da; putative annotation: N/A; putative formula: C15H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.226,"smiles":null,"spectrum_id":"CCMSLIB00017260259","spectrum_index":26321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 83.0377 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.124,"smiles":null,"spectrum_id":"CCMSLIB00017260262","spectrum_index":26322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 90.0107 Da; putative annotation: N/A; putative formula: C6H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.134,"smiles":null,"spectrum_id":"CCMSLIB00017260264","spectrum_index":26323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 13.0073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.103,"smiles":null,"spectrum_id":"CCMSLIB00017260266","spectrum_index":26324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 579.1943 Da; putative annotation: N/A; putative formula: C32H29N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.275,"smiles":null,"spectrum_id":"CCMSLIB00017260269","spectrum_index":26325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 126.0831 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017260271","spectrum_index":26326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gln (delta mass: 93.0219 Da; putative annotation: N/A; putative formula: C5H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.141,"smiles":null,"spectrum_id":"CCMSLIB00017260273","spectrum_index":26327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 131.059 Da; putative annotation: N/A; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.13,"smiles":null,"spectrum_id":"CCMSLIB00017260276","spectrum_index":26328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLIC ACID (delta mass: 146.0667 Da; putative annotation: N/A; putative formula: CH6N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.122,"smiles":null,"spectrum_id":"CCMSLIB00017260278","spectrum_index":26329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 489.3367 Da; putative annotation: N/A; putative formula: C29H48NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.486,"smiles":null,"spectrum_id":"CCMSLIB00017260280","spectrum_index":26330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 90.0833 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017260283","spectrum_index":26331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 771.4771 Da; putative annotation: N/A; putative formula: C40H69NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":934.537,"smiles":null,"spectrum_id":"CCMSLIB00017260285","spectrum_index":26332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 101.925 Da; putative annotation: N/A; putative formula: C2O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.98,"smiles":null,"spectrum_id":"CCMSLIB00017260288","spectrum_index":26333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 146.1519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.257,"smiles":null,"spectrum_id":"CCMSLIB00017260290","spectrum_index":26334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 104.0667 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.179,"smiles":null,"spectrum_id":"CCMSLIB00017260293","spectrum_index":26335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethylene glycol (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.128,"smiles":null,"spectrum_id":"CCMSLIB00017260295","spectrum_index":26336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-2-carbaldehyde (delta mass: 133.0527 Da; putative annotation: N/A; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.108,"smiles":null,"spectrum_id":"CCMSLIB00017260298","spectrum_index":26337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epinine (delta mass: 199.8895 Da; putative annotation: N/A; putative formula: C6S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.991,"smiles":null,"spectrum_id":"CCMSLIB00017260300","spectrum_index":26338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 397.2597 Da; putative annotation: N/A; putative formula: C21H31N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.32,"smiles":null,"spectrum_id":"CCMSLIB00017260302","spectrum_index":26339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-5-hydroxytryptamine (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.145,"smiles":null,"spectrum_id":"CCMSLIB00017260305","spectrum_index":26340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 23.0007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017260307","spectrum_index":26341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 31.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017260309","spectrum_index":26342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 114.0316 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.201,"smiles":null,"spectrum_id":"CCMSLIB00017260312","spectrum_index":26343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 69.0573 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.117,"smiles":null,"spectrum_id":"CCMSLIB00017260315","spectrum_index":26344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-pyruvic acid (delta mass: 131.074 Da; putative annotation: N/A; putative formula: C9H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.139,"smiles":null,"spectrum_id":"CCMSLIB00017260316","spectrum_index":26345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 44.0227 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.119,"smiles":null,"spectrum_id":"CCMSLIB00017260319","spectrum_index":26346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 25.8982 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.033,"smiles":null,"spectrum_id":"CCMSLIB00017260322","spectrum_index":26347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 104.0588 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.14,"smiles":null,"spectrum_id":"CCMSLIB00017260323","spectrum_index":26348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 126.0317 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017260326","spectrum_index":26349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 1333.7148 Da; putative annotation: N/A; putative formula: C64H107N3O26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1555.81,"smiles":null,"spectrum_id":"CCMSLIB00017260329","spectrum_index":26350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 378.94 Da; putative annotation: N/A; putative formula: C9H17NOS7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017260332","spectrum_index":26351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 216.1199 Da; putative annotation: N/A; putative formula: C11H22P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.41,"smiles":null,"spectrum_id":"CCMSLIB00017260333","spectrum_index":26352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 650.2213 Da; putative annotation: N/A; putative formula: C37H30N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":885.281,"smiles":null,"spectrum_id":"CCMSLIB00017260336","spectrum_index":26353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 383.3548 Da; putative annotation: N/A; putative formula: C27H45N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.42,"smiles":null,"spectrum_id":"CCMSLIB00017260337","spectrum_index":26354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 24.9718 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.162,"smiles":null,"spectrum_id":"CCMSLIB00017260340","spectrum_index":26355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 108.0424 Da; putative annotation: N/A; putative formula: C4H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017260342","spectrum_index":26356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 17.8459 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.949,"smiles":null,"spectrum_id":"CCMSLIB00017260345","spectrum_index":26357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-pyridinol (delta mass: 17.9965 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.052,"smiles":null,"spectrum_id":"CCMSLIB00017260347","spectrum_index":26358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 153.1156 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.191,"smiles":null,"spectrum_id":"CCMSLIB00017260349","spectrum_index":26359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 836.2077 Da; putative annotation: N/A; putative formula: C44H40N2O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1040.27,"smiles":null,"spectrum_id":"CCMSLIB00017260352","spectrum_index":26360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 39.0232 Da; putative annotation: N/A; putative formula: CHN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.12,"smiles":null,"spectrum_id":"CCMSLIB00017260355","spectrum_index":26361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 151.0562 Da; putative annotation: N/A; putative formula: C7H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.138,"smiles":null,"spectrum_id":"CCMSLIB00017260356","spectrum_index":26362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 56.0716 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.138,"smiles":null,"spectrum_id":"CCMSLIB00017260359","spectrum_index":26363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxyethoxy)-5-(trifluoromethyl)aniline (delta mass: 105.0794 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.169,"smiles":null,"spectrum_id":"CCMSLIB00017260362","spectrum_index":26364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 174.063 Da; putative annotation: N/A; putative formula: C8H15PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.144,"smiles":null,"spectrum_id":"CCMSLIB00017260363","spectrum_index":26365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 307.1272 Da; putative annotation: N/A; putative formula: C15H22N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.208,"smiles":null,"spectrum_id":"CCMSLIB00017260366","spectrum_index":26366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Trp (delta mass: 186.0799 Da; putative annotation: L-Tryptophan; putative formula: C11H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.22,"smiles":null,"spectrum_id":"CCMSLIB00017260369","spectrum_index":26367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Gln (delta mass: 129.0424 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.203,"smiles":null,"spectrum_id":"CCMSLIB00017260371","spectrum_index":26368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 130.0782 Da; putative annotation: 3-Phenylbut-2-en-1-ol; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.143,"smiles":null,"spectrum_id":"CCMSLIB00017260373","spectrum_index":26369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 115.0637 Da; putative annotation: L-.beta.-Homothreonine; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017260376","spectrum_index":26370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-O-((2E)-3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoyl)hex-2-ulofuranosyl hexopyranoside (delta mass: 320.0891 Da; putative annotation: Gerberinside; putative formula: C16H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":839.26,"smiles":null,"spectrum_id":"CCMSLIB00017260379","spectrum_index":26371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 136.0524 Da; putative annotation: 2-(2-Hydroxyethoxy)phenol; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017260380","spectrum_index":26372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 336.0639 Da; putative annotation: Antibiotic WS 5995-C; putative formula: C19H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.15,"smiles":null,"spectrum_id":"CCMSLIB00017260383","spectrum_index":26373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 38.071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.162,"smiles":null,"spectrum_id":"CCMSLIB00017260385","spectrum_index":26374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 144.1083 Da; putative annotation: N/A; putative formula: C7H16N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.189,"smiles":null,"spectrum_id":"CCMSLIB00017260387","spectrum_index":26375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE10; MS2Dec (delta mass: 58.0385 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.136,"smiles":null,"spectrum_id":"CCMSLIB00017260390","spectrum_index":26376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 401.387 Da; putative annotation: N/A; putative formula: C25H47N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.426,"smiles":null,"spectrum_id":"CCMSLIB00017260391","spectrum_index":26377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-11-Hydroxy-.DELTA.9-tetrahydrocannabinol (delta mass: 79.9549 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.182,"smiles":null,"spectrum_id":"CCMSLIB00017260394","spectrum_index":26378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 60.057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.128,"smiles":null,"spectrum_id":"CCMSLIB00017260397","spectrum_index":26379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 106.0044 Da; putative annotation: N/A; putative formula: C6H2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.07,"smiles":null,"spectrum_id":"CCMSLIB00017260398","spectrum_index":26380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 38.023 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.125,"smiles":null,"spectrum_id":"CCMSLIB00017260401","spectrum_index":26381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 44.026 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017260403","spectrum_index":26382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 135.0317 Da; putative annotation: N/A; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.086,"smiles":null,"spectrum_id":"CCMSLIB00017260405","spectrum_index":26383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 204.0273 Da; putative annotation: N/A; putative formula: C2H5N8O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.124,"smiles":null,"spectrum_id":"CCMSLIB00017260408","spectrum_index":26384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 226.0778 Da; putative annotation: N/A; putative formula: C10H14N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.169,"smiles":null,"spectrum_id":"CCMSLIB00017260411","spectrum_index":26385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 162.0608 Da; putative annotation: N/A; putative formula: C9H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.12,"smiles":null,"spectrum_id":"CCMSLIB00017260412","spectrum_index":26386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-nitro-1H-indole-2-carboxylate (delta mass: 18.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.14,"smiles":null,"spectrum_id":"CCMSLIB00017260415","spectrum_index":26387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 753.4303 Da; putative annotation: N/A; putative formula: C39H63NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":934.501,"smiles":null,"spectrum_id":"CCMSLIB00017260417","spectrum_index":26388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 115.0259 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.102,"smiles":null,"spectrum_id":"CCMSLIB00017260420","spectrum_index":26389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 302.0901 Da; putative annotation: N/A; putative formula: C15H14N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.161,"smiles":null,"spectrum_id":"CCMSLIB00017260423","spectrum_index":26390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00017 Biotin (delta mass: 326.0464 Da; putative annotation: N/A; putative formula: C17H15N2O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.142,"smiles":null,"spectrum_id":"CCMSLIB00017260425","spectrum_index":26391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 277.1016 Da; putative annotation: N/A; putative formula: C10H20N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.172,"smiles":null,"spectrum_id":"CCMSLIB00017260427","spectrum_index":26392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 263.1734 Da; putative annotation: N/A; putative formula: C12H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.306,"smiles":null,"spectrum_id":"CCMSLIB00017260430","spectrum_index":26393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dehydrocoelenterazine (delta mass: 172.1455 Da; putative annotation: N/A; putative formula: C10H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.295,"smiles":null,"spectrum_id":"CCMSLIB00017260431","spectrum_index":26394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 296.2353 Da; putative annotation: N/A; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.272,"smiles":null,"spectrum_id":"CCMSLIB00017260434","spectrum_index":26395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 245.2099 Da; putative annotation: N/A; putative formula: C12H27N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.297,"smiles":null,"spectrum_id":"CCMSLIB00017260435","spectrum_index":26396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 170.1327 Da; putative annotation: N/A; putative formula: C9H19N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.238,"smiles":null,"spectrum_id":"CCMSLIB00017260438","spectrum_index":26397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 176.0323 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.134,"smiles":null,"spectrum_id":"CCMSLIB00017260441","spectrum_index":26398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 926.3369 Da; putative annotation: N/A; putative formula: C64H42N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1310.49,"smiles":null,"spectrum_id":"CCMSLIB00017260442","spectrum_index":26399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(9H-Carbazol-9-yl)propanoic acid (delta mass: 19.0078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.11,"smiles":null,"spectrum_id":"CCMSLIB00017260445","spectrum_index":26400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 44.0473 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.217,"smiles":null,"spectrum_id":"CCMSLIB00017260447","spectrum_index":26401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 177.0993 Da; putative annotation: N/A; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.14,"smiles":null,"spectrum_id":"CCMSLIB00017260449","spectrum_index":26402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 17.0229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.146,"smiles":null,"spectrum_id":"CCMSLIB00017260452","spectrum_index":26403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 25.0754 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.13,"smiles":null,"spectrum_id":"CCMSLIB00017260454","spectrum_index":26404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 159.0334 Da; putative annotation: N/A; putative formula: C2H5N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.12,"smiles":null,"spectrum_id":"CCMSLIB00017260456","spectrum_index":26405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 131.0371 Da; putative annotation: N/A; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.113,"smiles":null,"spectrum_id":"CCMSLIB00017260459","spectrum_index":26406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 41.0381 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.172,"smiles":null,"spectrum_id":"CCMSLIB00017260462","spectrum_index":26407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 77.0297 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.189,"smiles":null,"spectrum_id":"CCMSLIB00017260463","spectrum_index":26408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 222.1016 Da; putative annotation: N/A; putative formula: C12H10N6O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.188,"smiles":null,"spectrum_id":"CCMSLIB00017260466","spectrum_index":26409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 42.0468 Da; putative annotation: N/A; putative formula: C3H6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.107,"smiles":null,"spectrum_id":"CCMSLIB00017260468","spectrum_index":26410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 114.0676 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.148,"smiles":null,"spectrum_id":"CCMSLIB00017260470","spectrum_index":26411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 17.9573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.045,"smiles":null,"spectrum_id":"CCMSLIB00017260473","spectrum_index":26412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 327.1806 Da; putative annotation: N/A; putative formula: C16H21N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.35,"smiles":null,"spectrum_id":"CCMSLIB00017260475","spectrum_index":26413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 560.3417 Da; putative annotation: N/A; putative formula: C36H49O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.444,"smiles":null,"spectrum_id":"CCMSLIB00017260477","spectrum_index":26414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 52.4196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.5,"smiles":null,"spectrum_id":"CCMSLIB00017260480","spectrum_index":26415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 166.0129 Da; putative annotation: N/A; putative formula: C5H2N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.094,"smiles":null,"spectrum_id":"CCMSLIB00017260483","spectrum_index":26416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 291.2034 Da; putative annotation: N/A; putative formula: C11H21N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.274,"smiles":null,"spectrum_id":"CCMSLIB00017260486","spectrum_index":26417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 55.004 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.085,"smiles":null,"spectrum_id":"CCMSLIB00017260487","spectrum_index":26418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 490.062 Da; putative annotation: N/A; putative formula: C13H27N4O6P5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.168,"smiles":null,"spectrum_id":"CCMSLIB00017260490","spectrum_index":26419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.128,"smiles":null,"spectrum_id":"CCMSLIB00017260493","spectrum_index":26420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 331.2123 Da; putative annotation: N/A; putative formula: C16H25N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.356,"smiles":null,"spectrum_id":"CCMSLIB00017260494","spectrum_index":26421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 201.1244 Da; putative annotation: N/A; putative formula: C6H16N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.183,"smiles":null,"spectrum_id":"CCMSLIB00017260497","spectrum_index":26422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 187.0594 Da; putative annotation: N/A; putative formula: C9H8F3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.107,"smiles":null,"spectrum_id":"CCMSLIB00017260499","spectrum_index":26423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Pro-Ile (delta mass: 113.084 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.323,"smiles":null,"spectrum_id":"CCMSLIB00017260501","spectrum_index":26424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 586.2262 Da; putative annotation: N/A; putative formula: C27H38O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.307,"smiles":null,"spectrum_id":"CCMSLIB00017260504","spectrum_index":26425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 283.0923 Da; putative annotation: N/A; putative formula: C10H23NO2P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.189,"smiles":null,"spectrum_id":"CCMSLIB00017260505","spectrum_index":26426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 96.0203 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.086,"smiles":null,"spectrum_id":"CCMSLIB00017260508","spectrum_index":26427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 650.4289 Da; putative annotation: N/A; putative formula: C33H59N6O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.489,"smiles":null,"spectrum_id":"CCMSLIB00017260511","spectrum_index":26428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 28.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.222,"smiles":null,"spectrum_id":"CCMSLIB00017260513","spectrum_index":26429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 24.0156 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.16,"smiles":null,"spectrum_id":"CCMSLIB00017260515","spectrum_index":26430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 118.0765 Da; putative annotation: N/A; putative formula: C3H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.372,"smiles":null,"spectrum_id":"CCMSLIB00017260518","spectrum_index":26431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 72.0286 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.143,"smiles":null,"spectrum_id":"CCMSLIB00017260521","spectrum_index":26432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 409.1957 Da; putative annotation: N/A; putative formula: C18H35NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.287,"smiles":null,"spectrum_id":"CCMSLIB00017260523","spectrum_index":26433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE (delta mass: 146.119 Da; putative annotation: N/A; putative formula: C10H14N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.206,"smiles":null,"spectrum_id":"CCMSLIB00017260526","spectrum_index":26434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 277.9036 Da; putative annotation: N/A; putative formula: C3H2O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":871.179,"smiles":null,"spectrum_id":"CCMSLIB00017260528","spectrum_index":26435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 76.0678 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.201,"smiles":null,"spectrum_id":"CCMSLIB00017260531","spectrum_index":26436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 51.0472 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.149,"smiles":null,"spectrum_id":"CCMSLIB00017260533","spectrum_index":26437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 243.0406 Da; putative annotation: N/A; putative formula: C11HN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.101,"smiles":null,"spectrum_id":"CCMSLIB00017260536","spectrum_index":26438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 154.0631 Da; putative annotation: N/A; putative formula: C8H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.128,"smiles":null,"spectrum_id":"CCMSLIB00017260538","spectrum_index":26439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylquinolin-4-amine (delta mass: 56.0299 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.122,"smiles":null,"spectrum_id":"CCMSLIB00017260540","spectrum_index":26440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 226.1617 Da; putative annotation: N/A; putative formula: C11H22N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.301,"smiles":null,"spectrum_id":"CCMSLIB00017260543","spectrum_index":26441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304055 p-Coumaraldehyde (delta mass: 110.037 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.097,"smiles":null,"spectrum_id":"CCMSLIB00017260545","spectrum_index":26442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLSEROTONIN (delta mass: 223.0466 Da; putative annotation: N/A; putative formula: C14H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.159,"smiles":null,"spectrum_id":"CCMSLIB00017260547","spectrum_index":26443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 253.1923 Da; putative annotation: N/A; putative formula: C12H23N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.284,"smiles":null,"spectrum_id":"CCMSLIB00017260550","spectrum_index":26444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 384.2195 Da; putative annotation: N/A; putative formula: C18H32N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.358,"smiles":null,"spectrum_id":"CCMSLIB00017260553","spectrum_index":26445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (delta mass: 118.039 Da; putative annotation: N/A; putative formula: C4H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.128,"smiles":null,"spectrum_id":"CCMSLIB00017260554","spectrum_index":26446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 98.0368 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017260557","spectrum_index":26447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 267.184 Da; putative annotation: N/A; putative formula: C15H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.28,"smiles":null,"spectrum_id":"CCMSLIB00017260558","spectrum_index":26448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 150.1029 Da; putative annotation: N/A; putative formula: C6H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.195,"smiles":null,"spectrum_id":"CCMSLIB00017260561","spectrum_index":26449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine; LC-tDDA; CE10 (delta mass: 570.3893 Da; putative annotation: N/A; putative formula: C31H50N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.485,"smiles":null,"spectrum_id":"CCMSLIB00017260564","spectrum_index":26450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 197.09 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.171,"smiles":null,"spectrum_id":"CCMSLIB00017260565","spectrum_index":26451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin analogue LVR (or VLR) (delta mass: 60.0331 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.32,"smiles":null,"spectrum_id":"CCMSLIB00017260568","spectrum_index":26452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 72.054 Da; putative annotation: N/A; putative formula: H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.149,"smiles":null,"spectrum_id":"CCMSLIB00017260569","spectrum_index":26453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 117.0483 Da; putative annotation: N/A; putative formula: C2H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.113,"smiles":null,"spectrum_id":"CCMSLIB00017260572","spectrum_index":26454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 14.9757 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.062,"smiles":null,"spectrum_id":"CCMSLIB00017260575","spectrum_index":26455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 35.0272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.087,"smiles":null,"spectrum_id":"CCMSLIB00017260576","spectrum_index":26456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 12.0378 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.129,"smiles":null,"spectrum_id":"CCMSLIB00017260579","spectrum_index":26457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroflavopereirine (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.149,"smiles":null,"spectrum_id":"CCMSLIB00017260581","spectrum_index":26458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 60.0423 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.202,"smiles":null,"spectrum_id":"CCMSLIB00017260584","spectrum_index":26459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one (delta mass: 585.1553 Da; putative annotation: N/A; putative formula: C32H28NO8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.183,"smiles":null,"spectrum_id":"CCMSLIB00017260586","spectrum_index":26460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 38.0523 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.117,"smiles":null,"spectrum_id":"CCMSLIB00017260588","spectrum_index":26461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HarmalolHCl2H2O///harmalol///Harmalol CollisionEnergy:205060 (delta mass: 57.0581 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.16,"smiles":null,"spectrum_id":"CCMSLIB00017260591","spectrum_index":26462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyanomethyl)-1H-indole-2-carboxylic acid (delta mass: 43.9776 Da; putative annotation: N/A; putative formula: CHP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.044,"smiles":null,"spectrum_id":"CCMSLIB00017260594","spectrum_index":26463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 705.539 Da; putative annotation: N/A; putative formula: C38H75NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.599,"smiles":null,"spectrum_id":"CCMSLIB00017260596","spectrum_index":26464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 90.047 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017260598","spectrum_index":26465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 84.0394 Da; putative annotation: N/A; putative formula: C5H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.152,"smiles":null,"spectrum_id":"CCMSLIB00017260601","spectrum_index":26466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 191.5474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.608,"smiles":null,"spectrum_id":"CCMSLIB00017260604","spectrum_index":26467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 294.2565 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.369,"smiles":null,"spectrum_id":"CCMSLIB00017260606","spectrum_index":26468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 30.1559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.289,"smiles":null,"spectrum_id":"CCMSLIB00017260608","spectrum_index":26469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 35.9996 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.06,"smiles":null,"spectrum_id":"CCMSLIB00017260611","spectrum_index":26470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 121.0911 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.22,"smiles":null,"spectrum_id":"CCMSLIB00017260613","spectrum_index":26471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM823401 N-Butylbenzenesulfonamide (delta mass: 40.158 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.248,"smiles":null,"spectrum_id":"CCMSLIB00017260616","spectrum_index":26472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 156.0787 Da; putative annotation: N/A; putative formula: C8H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.176,"smiles":null,"spectrum_id":"CCMSLIB00017260618","spectrum_index":26473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 4.0647 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.203,"smiles":null,"spectrum_id":"CCMSLIB00017260621","spectrum_index":26474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 74.0734 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.155,"smiles":null,"spectrum_id":"CCMSLIB00017260623","spectrum_index":26475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Chloro-2-hydroxy-4-phenyl-3-quinolinyl)acetic acid (delta mass: 311.1082 Da; putative annotation: N/A; putative formula: C18H18NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.166,"smiles":null,"spectrum_id":"CCMSLIB00017260625","spectrum_index":26476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-.beta.-carboline (delta mass: 384.2351 Da; putative annotation: N/A; putative formula: C22H32N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.342,"smiles":null,"spectrum_id":"CCMSLIB00017260628","spectrum_index":26477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 181.2739 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.454,"smiles":null,"spectrum_id":"CCMSLIB00017260630","spectrum_index":26478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 70.0317 Da; putative annotation: N/A; putative formula: C4H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.158,"smiles":null,"spectrum_id":"CCMSLIB00017260632","spectrum_index":26479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 46.1896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.291,"smiles":null,"spectrum_id":"CCMSLIB00017260635","spectrum_index":26480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 371.185 Da; putative annotation: N/A; putative formula: C13H25N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.271,"smiles":null,"spectrum_id":"CCMSLIB00017260638","spectrum_index":26481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 771.3116 Da; putative annotation: N/A; putative formula: C40H45N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":934.372,"smiles":null,"spectrum_id":"CCMSLIB00017260639","spectrum_index":26482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 1-methyl-9H-beta-carbolin-7-yl ether (delta mass: 275.0644 Da; putative annotation: N/A; putative formula: C10H13NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.167,"smiles":null,"spectrum_id":"CCMSLIB00017260642","spectrum_index":26483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 317.1209 Da; putative annotation: N/A; putative formula: C9H11N13O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.192,"smiles":null,"spectrum_id":"CCMSLIB00017260644","spectrum_index":26484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 657.1909 Da; putative annotation: N/A; putative formula: C42H31N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":820.251,"smiles":null,"spectrum_id":"CCMSLIB00017260646","spectrum_index":26485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 134.0357 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.169,"smiles":null,"spectrum_id":"CCMSLIB00017260649","spectrum_index":26486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 149.0687 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.139,"smiles":null,"spectrum_id":"CCMSLIB00017260651","spectrum_index":26487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 78.0311 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017260654","spectrum_index":26488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(4-nitrobenzyl)ethanamine (delta mass: 78.0406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.16,"smiles":null,"spectrum_id":"CCMSLIB00017260656","spectrum_index":26489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 448.1636 Da; putative annotation: N/A; putative formula: C18H32N4O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.224,"smiles":null,"spectrum_id":"CCMSLIB00017260659","spectrum_index":26490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 454.8078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.878,"smiles":null,"spectrum_id":"CCMSLIB00017260661","spectrum_index":26491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 177.1001 Da; putative annotation: N/A; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.176,"smiles":null,"spectrum_id":"CCMSLIB00017260663","spectrum_index":26492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 78.0458 Da; putative annotation: N/A; putative formula: C6H6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.111,"smiles":null,"spectrum_id":"CCMSLIB00017260666","spectrum_index":26493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 698.419 Da; putative annotation: N/A; putative formula: C37H58N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.505,"smiles":null,"spectrum_id":"CCMSLIB00017260668","spectrum_index":26494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 59.0096 Da; putative annotation: N/A; putative formula: HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.159,"smiles":null,"spectrum_id":"CCMSLIB00017260671","spectrum_index":26495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 923.3074 Da; putative annotation: N/A; putative formula: C44H53N5O13S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1590.54,"smiles":null,"spectrum_id":"CCMSLIB00017260673","spectrum_index":26496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acridine-2,9-diol (delta mass: 18.0465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.117,"smiles":null,"spectrum_id":"CCMSLIB00017260675","spectrum_index":26497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 112.031 Da; putative annotation: N/A; putative formula: C9H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.128,"smiles":null,"spectrum_id":"CCMSLIB00017260678","spectrum_index":26498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 510.246 Da; putative annotation: N/A; putative formula: C24H34N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.311,"smiles":null,"spectrum_id":"CCMSLIB00017260681","spectrum_index":26499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 314.1882 Da; putative annotation: N/A; putative formula: C20H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.317,"smiles":null,"spectrum_id":"CCMSLIB00017260682","spectrum_index":26500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 329.2052 Da; putative annotation: N/A; putative formula: C16H32N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.276,"smiles":null,"spectrum_id":"CCMSLIB00017260685","spectrum_index":26501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 325.0761 Da; putative annotation: N/A; putative formula: C12H16N5O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.21,"smiles":null,"spectrum_id":"CCMSLIB00017260688","spectrum_index":26502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 74.0524 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.123,"smiles":null,"spectrum_id":"CCMSLIB00017260690","spectrum_index":26503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 630.6217 Da; putative annotation: N/A; putative formula: C45H78N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.693,"smiles":null,"spectrum_id":"CCMSLIB00017260692","spectrum_index":26504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU229303 2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP)|2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine|1-methyl-6-phenylimidazo[4,5-b]pyridin-2-amine (delta mass: 28.0292 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017260695","spectrum_index":26505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 179.0789 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.249,"smiles":null,"spectrum_id":"CCMSLIB00017260696","spectrum_index":26506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 352.0718 Da; putative annotation: N/A; putative formula: C17H21O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.131,"smiles":null,"spectrum_id":"CCMSLIB00017260699","spectrum_index":26507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 234.0997 Da; putative annotation: N/A; putative formula: C14H19O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.254,"smiles":null,"spectrum_id":"CCMSLIB00017260701","spectrum_index":26508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-nitro-1H-indole-2-carboxylate (delta mass: 18.0023 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.058,"smiles":null,"spectrum_id":"CCMSLIB00017260704","spectrum_index":26509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 562.0104 Da; putative annotation: N/A; putative formula: C22H18N4O6S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.108,"smiles":null,"spectrum_id":"CCMSLIB00017260706","spectrum_index":26510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 151.1355 Da; putative annotation: N/A; putative formula: C10H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.248,"smiles":null,"spectrum_id":"CCMSLIB00017260709","spectrum_index":26511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 205.068 Da; putative annotation: N/A; putative formula: C3H3N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.109,"smiles":null,"spectrum_id":"CCMSLIB00017260710","spectrum_index":26512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 163.0638 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.145,"smiles":null,"spectrum_id":"CCMSLIB00017260713","spectrum_index":26513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005843 Cinchonine|(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl)-quinolin-4-ylmethanol (delta mass: 355.3939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.574,"smiles":null,"spectrum_id":"CCMSLIB00017260716","spectrum_index":26514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 186.0682 Da; putative annotation: N/A; putative formula: C12H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.16,"smiles":null,"spectrum_id":"CCMSLIB00017260718","spectrum_index":26515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 1078.2616 Da; putative annotation: N/A; putative formula: C52H50N14OS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1388.37,"smiles":null,"spectrum_id":"CCMSLIB00017260720","spectrum_index":26516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.176,"smiles":null,"spectrum_id":"CCMSLIB00017260723","spectrum_index":26517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 90.0312 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.159,"smiles":null,"spectrum_id":"CCMSLIB00017260725","spectrum_index":26518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 59.1105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.187,"smiles":null,"spectrum_id":"CCMSLIB00017260727","spectrum_index":26519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 386.2364 Da; putative annotation: N/A; putative formula: C18H36N4OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.333,"smiles":null,"spectrum_id":"CCMSLIB00017260730","spectrum_index":26520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 127.0634 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.171,"smiles":null,"spectrum_id":"CCMSLIB00017260732","spectrum_index":26521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 420.2496 Da; putative annotation: N/A; putative formula: C21H36N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.31,"smiles":null,"spectrum_id":"CCMSLIB00017260735","spectrum_index":26522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 148.0757 Da; putative annotation: N/A; putative formula: C5H13N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.136,"smiles":null,"spectrum_id":"CCMSLIB00017260737","spectrum_index":26523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 339.1883 Da; putative annotation: N/A; putative formula: C19H25N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.269,"smiles":null,"spectrum_id":"CCMSLIB00017260740","spectrum_index":26524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 3.9887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":106.08,"smiles":null,"spectrum_id":"CCMSLIB00017260742","spectrum_index":26525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Benzimidazole-5-carboxylic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.045,"smiles":null,"spectrum_id":"CCMSLIB00017260744","spectrum_index":26526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 366.0737 Da; putative annotation: N/A; putative formula: C20H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.197,"smiles":null,"spectrum_id":"CCMSLIB00017260747","spectrum_index":26527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 42.0651 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.132,"smiles":null,"spectrum_id":"CCMSLIB00017260749","spectrum_index":26528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caffeic acid (delta mass: 94.0417 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017260751","spectrum_index":26529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 74.1229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.23,"smiles":null,"spectrum_id":"CCMSLIB00017260754","spectrum_index":26530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 69.0579 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.118,"smiles":null,"spectrum_id":"CCMSLIB00017260755","spectrum_index":26531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 114.0466 Da; putative annotation: N/A; putative formula: C9H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.221,"smiles":null,"spectrum_id":"CCMSLIB00017260758","spectrum_index":26532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 104.0374 Da; putative annotation: N/A; putative formula: C6H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.113,"smiles":null,"spectrum_id":"CCMSLIB00017260761","spectrum_index":26533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 160.1851 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.276,"smiles":null,"spectrum_id":"CCMSLIB00017260764","spectrum_index":26534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 146.0585 Da; putative annotation: N/A; putative formula: C7H14O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.197,"smiles":null,"spectrum_id":"CCMSLIB00017260765","spectrum_index":26535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 111.0358 Da; putative annotation: N/A; putative formula: C4H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.112,"smiles":null,"spectrum_id":"CCMSLIB00017260768","spectrum_index":26536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 175.0849 Da; putative annotation: N/A; putative formula: C7H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.172,"smiles":null,"spectrum_id":"CCMSLIB00017260771","spectrum_index":26537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 64.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.124,"smiles":null,"spectrum_id":"CCMSLIB00017260773","spectrum_index":26538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 28.8751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.94,"smiles":null,"spectrum_id":"CCMSLIB00017260775","spectrum_index":26539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.292,"smiles":null,"spectrum_id":"CCMSLIB00017260778","spectrum_index":26540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 574.4763 Da; putative annotation: N/A; putative formula: C40H62O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.524,"smiles":null,"spectrum_id":"CCMSLIB00017260780","spectrum_index":26541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asimilobine (delta mass: 56.0255 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.159,"smiles":null,"spectrum_id":"CCMSLIB00017260782","spectrum_index":26542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 30.0437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.078,"smiles":null,"spectrum_id":"CCMSLIB00017260785","spectrum_index":26543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 431.3044 Da; putative annotation: N/A; putative formula: C27H45NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.402,"smiles":null,"spectrum_id":"CCMSLIB00017260788","spectrum_index":26544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 130.0623 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.196,"smiles":null,"spectrum_id":"CCMSLIB00017260790","spectrum_index":26545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 501.3184 Da; putative annotation: N/A; putative formula: C32H43N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.467,"smiles":null,"spectrum_id":"CCMSLIB00017260792","spectrum_index":26546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 220.0854 Da; putative annotation: N/A; putative formula: C11H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.145,"smiles":null,"spectrum_id":"CCMSLIB00017260795","spectrum_index":26547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 12.0006 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.102,"smiles":null,"spectrum_id":"CCMSLIB00017260797","spectrum_index":26548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU288304 Norharmane|9H-pyrido[3,4-b]indole (delta mass: 29.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.087,"smiles":null,"spectrum_id":"CCMSLIB00017260799","spectrum_index":26549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 22.0202 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017260802","spectrum_index":26550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heteropeucenin, Methyl Ether (delta mass: 51.9985 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.126,"smiles":null,"spectrum_id":"CCMSLIB00017260804","spectrum_index":26551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 513.2794 Da; putative annotation: N/A; putative formula: C33H40NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.318,"smiles":null,"spectrum_id":"CCMSLIB00017260806","spectrum_index":26552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 113.0471 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.123,"smiles":null,"spectrum_id":"CCMSLIB00017260809","spectrum_index":26553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 85.0318 Da; putative annotation: N/A; putative formula: C7H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017260811","spectrum_index":26554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 144.0937 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.128,"smiles":null,"spectrum_id":"CCMSLIB00017260813","spectrum_index":26555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Leu (delta mass: 470.2898 Da; putative annotation: N/A; putative formula: C27H42N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.445,"smiles":null,"spectrum_id":"CCMSLIB00017260816","spectrum_index":26556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 145.9428 Da; putative annotation: N/A; putative formula: C3H2N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.009,"smiles":null,"spectrum_id":"CCMSLIB00017260818","spectrum_index":26557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 90.047 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.149,"smiles":null,"spectrum_id":"CCMSLIB00017260821","spectrum_index":26558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 132.0899 Da; putative annotation: N/A; putative formula: C5H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.177,"smiles":null,"spectrum_id":"CCMSLIB00017260824","spectrum_index":26559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetic acid - 30.0 eV (delta mass: 90.0499 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.121,"smiles":null,"spectrum_id":"CCMSLIB00017260825","spectrum_index":26560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-5-phenyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-one (delta mass: 46.0026 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.082,"smiles":null,"spectrum_id":"CCMSLIB00017260828","spectrum_index":26561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Difluoromethoxy)-1H-indole-2-carboxylic acid (delta mass: 18.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.058,"smiles":null,"spectrum_id":"CCMSLIB00017260830","spectrum_index":26562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 269.0748 Da; putative annotation: N/A; putative formula: C8H15NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.176,"smiles":null,"spectrum_id":"CCMSLIB00017260832","spectrum_index":26563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 163.1202 Da; putative annotation: N/A; putative formula: C8H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.253,"smiles":null,"spectrum_id":"CCMSLIB00017260835","spectrum_index":26564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Glu (delta mass: 113.0844 Da; putative annotation: L-Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017260837","spectrum_index":26565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Val (delta mass: 99.0684 Da; putative annotation: N-Methyl-.alpha.-aminoisobutyric acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.197,"smiles":null,"spectrum_id":"CCMSLIB00017260839","spectrum_index":26566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 144.0198 Da; putative annotation: Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.091,"smiles":null,"spectrum_id":"CCMSLIB00017260842","spectrum_index":26567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 193.1105 Da; putative annotation: Methoxamine; putative formula: C11H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.228,"smiles":null,"spectrum_id":"CCMSLIB00017260845","spectrum_index":26568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 324.106 Da; putative annotation: Lactulose - 30.0 eV; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.282,"smiles":null,"spectrum_id":"CCMSLIB00017260847","spectrum_index":26569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine - 40.0 eV (delta mass: 132.0575 Da; putative annotation: 3,4-Dimethylbenzoic acid; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.108,"smiles":null,"spectrum_id":"CCMSLIB00017260849","spectrum_index":26570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 147.0684 Da; putative annotation: Phenylalanine; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017260852","spectrum_index":26571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 924.5097 Da; putative annotation: Massbank:PR304330 Soyasaponin Bb; putative formula: C48H76O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1251.64,"smiles":null,"spectrum_id":"CCMSLIB00017260853","spectrum_index":26572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 153.1159 Da; putative annotation: Gabapentin; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.239,"smiles":null,"spectrum_id":"CCMSLIB00017260856","spectrum_index":26573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 271.1566 Da; putative annotation: Desbenzyldonepezil; putative formula: C17H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.237,"smiles":null,"spectrum_id":"CCMSLIB00017260859","spectrum_index":26574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 288.0841 Da; putative annotation: 2-(2-Oxo-2-(quinolin-3-ylamino)ethyl)benzoic acid; putative formula: C18H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017260861","spectrum_index":26575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:MSJ00168 alpha-Tocopherol|Vitamin E (delta mass: 79.0067 Da; putative annotation: N/A; putative formula: C4HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.395,"smiles":null,"spectrum_id":"CCMSLIB00017260863","spectrum_index":26576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 442.1394 Da; putative annotation: N/A; putative formula: C20H27O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":777.245,"smiles":null,"spectrum_id":"CCMSLIB00017260866","spectrum_index":26577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 377.176 Da; putative annotation: N/A; putative formula: C20H28NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.267,"smiles":null,"spectrum_id":"CCMSLIB00017260868","spectrum_index":26578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 152.0623 Da; putative annotation: N/A; putative formula: C12H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.186,"smiles":null,"spectrum_id":"CCMSLIB00017260870","spectrum_index":26579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 54.0394 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.131,"smiles":null,"spectrum_id":"CCMSLIB00017260873","spectrum_index":26580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 25.0026 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.083,"smiles":null,"spectrum_id":"CCMSLIB00017260876","spectrum_index":26581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 40.0 eV (delta mass: 131.0422 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.219,"smiles":null,"spectrum_id":"CCMSLIB00017260878","spectrum_index":26582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 148.0527 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.139,"smiles":null,"spectrum_id":"CCMSLIB00017260880","spectrum_index":26583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 155.2299 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.295,"smiles":null,"spectrum_id":"CCMSLIB00017260883","spectrum_index":26584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 923.487 Da; putative annotation: N/A; putative formula: C46H89N3O-1S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1104.56,"smiles":null,"spectrum_id":"CCMSLIB00017260886","spectrum_index":26585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 62.0161 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.145,"smiles":null,"spectrum_id":"CCMSLIB00017260887","spectrum_index":26586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100215 alpha-Methyl-DL-serine|DL-2-Methylserine|2-Amino-3-hydroxy-2-methylpropanoic Acid|DL-2-Amino-3-hydroxy-2-methylpropionic Acid|DL-alpha-(Hydroxymethyl)alanine|alpha-Methylserine (delta mass: 129.0253 Da; putative annotation: N/A; putative formula: C5H7NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.091,"smiles":null,"spectrum_id":"CCMSLIB00017260890","spectrum_index":26587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 172.1571 Da; putative annotation: N/A; putative formula: C9H20N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.237,"smiles":null,"spectrum_id":"CCMSLIB00017260893","spectrum_index":26588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine (delta mass: 53.04 Da; putative annotation: N/A; putative formula: C2H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.148,"smiles":null,"spectrum_id":"CCMSLIB00017260894","spectrum_index":26589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 128.1046 Da; putative annotation: N/A; putative formula: C5H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.232,"smiles":null,"spectrum_id":"CCMSLIB00017260897","spectrum_index":26590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-(1H-Indol-2-yl)-2-propenoic acid (delta mass: 16.0165 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017260900","spectrum_index":26591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 170.2429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.329,"smiles":null,"spectrum_id":"CCMSLIB00017260901","spectrum_index":26592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 97.9758 Da; putative annotation: N/A; putative formula: C2H-2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.013,"smiles":null,"spectrum_id":"CCMSLIB00017260904","spectrum_index":26593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 499.3489 Da; putative annotation: N/A; putative formula: C31H49NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.42,"smiles":null,"spectrum_id":"CCMSLIB00017260906","spectrum_index":26594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304040 p-Coumaraldehyde (delta mass: 102.068 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017260908","spectrum_index":26595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 108.0945 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.519,"smiles":null,"spectrum_id":"CCMSLIB00017260911","spectrum_index":26596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 358.2263 Da; putative annotation: N/A; putative formula: C21H30N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.323,"smiles":null,"spectrum_id":"CCMSLIB00017260913","spectrum_index":26597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 28.1153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.227,"smiles":null,"spectrum_id":"CCMSLIB00017260915","spectrum_index":26598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 75.1114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.171,"smiles":null,"spectrum_id":"CCMSLIB00017260918","spectrum_index":26599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zinterol (delta mass: 245.1714 Da; putative annotation: N/A; putative formula: C16H24NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.34,"smiles":null,"spectrum_id":"CCMSLIB00017260920","spectrum_index":26600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 515.1358 Da; putative annotation: N/A; putative formula: C26H22N5O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.177,"smiles":null,"spectrum_id":"CCMSLIB00017260923","spectrum_index":26601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 180.0597 Da; putative annotation: N/A; putative formula: C10H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.245,"smiles":null,"spectrum_id":"CCMSLIB00017260925","spectrum_index":26602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 239.1303 Da; putative annotation: N/A; putative formula: C10H18N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.222,"smiles":null,"spectrum_id":"CCMSLIB00017260928","spectrum_index":26603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 27.9923 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.104,"smiles":null,"spectrum_id":"CCMSLIB00017260931","spectrum_index":26604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lactose from NIST14 (delta mass: 410.2826 Da; putative annotation: N/A; putative formula: C20H38N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":753.406,"smiles":null,"spectrum_id":"CCMSLIB00017260933","spectrum_index":26605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 182.0514 Da; putative annotation: N/A; putative formula: C8H10N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.138,"smiles":null,"spectrum_id":"CCMSLIB00017260935","spectrum_index":26606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C5:0 (delta mass: 136.0583 Da; putative annotation: N/A; putative formula: C2H8N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.202,"smiles":null,"spectrum_id":"CCMSLIB00017260938","spectrum_index":26607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Chelidonine (delta mass: 18.0112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.145,"smiles":null,"spectrum_id":"CCMSLIB00017260940","spectrum_index":26608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 131.1124 Da; putative annotation: N/A; putative formula: C10H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.168,"smiles":null,"spectrum_id":"CCMSLIB00017260942","spectrum_index":26609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corynoline (delta mass: 56.0666 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.216,"smiles":null,"spectrum_id":"CCMSLIB00017260945","spectrum_index":26610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 239.1367 Da; putative annotation: N/A; putative formula: C13H23NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.192,"smiles":null,"spectrum_id":"CCMSLIB00017260947","spectrum_index":26611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 453.2592 Da; putative annotation: N/A; putative formula: C21H45NO3P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.429,"smiles":null,"spectrum_id":"CCMSLIB00017260950","spectrum_index":26612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 551.366 Da; putative annotation: N/A; putative formula: C32H49N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.437,"smiles":null,"spectrum_id":"CCMSLIB00017260952","spectrum_index":26613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 28.972 Da; putative annotation: N/A; putative formula: C13H18N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.011,"smiles":null,"spectrum_id":"CCMSLIB00017260955","spectrum_index":26614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 168.042 Da; putative annotation: N/A; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.081,"smiles":null,"spectrum_id":"CCMSLIB00017260957","spectrum_index":26615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Lys (delta mass: 100.0231 Da; putative annotation: N/A; putative formula: C2H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.22,"smiles":null,"spectrum_id":"CCMSLIB00017260959","spectrum_index":26616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 147.0319 Da; putative annotation: N/A; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.118,"smiles":null,"spectrum_id":"CCMSLIB00017260962","spectrum_index":26617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 923.9782 Da; putative annotation: N/A; putative formula: C64H125NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1105.05,"smiles":null,"spectrum_id":"CCMSLIB00017260964","spectrum_index":26618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 497.6435 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.704,"smiles":null,"spectrum_id":"CCMSLIB00017260967","spectrum_index":26619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 312.2671 Da; putative annotation: N/A; putative formula: C19H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.358,"smiles":null,"spectrum_id":"CCMSLIB00017260970","spectrum_index":26620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 276.2815 Da; putative annotation: N/A; putative formula: C20H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":885.552,"smiles":null,"spectrum_id":"CCMSLIB00017260972","spectrum_index":26621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 434.2337 Da; putative annotation: N/A; putative formula: C21H38O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.32,"smiles":null,"spectrum_id":"CCMSLIB00017260975","spectrum_index":26622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 124.0157 Da; putative annotation: N/A; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.144,"smiles":null,"spectrum_id":"CCMSLIB00017260977","spectrum_index":26623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 85.01 Da; putative annotation: N/A; putative formula: C2H3N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.086,"smiles":null,"spectrum_id":"CCMSLIB00017260979","spectrum_index":26624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 160.1099 Da; putative annotation: N/A; putative formula: C8H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.17,"smiles":null,"spectrum_id":"CCMSLIB00017260982","spectrum_index":26625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 86.0761 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.12,"smiles":null,"spectrum_id":"CCMSLIB00017260984","spectrum_index":26626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CINNAMIC ACID (delta mass: 60.0426 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.102,"smiles":null,"spectrum_id":"CCMSLIB00017260986","spectrum_index":26627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 86.0521 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017260989","spectrum_index":26628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 213.0987 Da; putative annotation: N/A; putative formula: C14H15NO-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.164,"smiles":null,"spectrum_id":"CCMSLIB00017260991","spectrum_index":26629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 11.9991 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.085,"smiles":null,"spectrum_id":"CCMSLIB00017260994","spectrum_index":26630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 135.1071 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.225,"smiles":null,"spectrum_id":"CCMSLIB00017260996","spectrum_index":26631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 128.2172 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.252,"smiles":null,"spectrum_id":"CCMSLIB00017260999","spectrum_index":26632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 127.1817 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.268,"smiles":null,"spectrum_id":"CCMSLIB00017261001","spectrum_index":26633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 132.0938 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.248,"smiles":null,"spectrum_id":"CCMSLIB00017261003","spectrum_index":26634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 24.0098 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.087,"smiles":null,"spectrum_id":"CCMSLIB00017261006","spectrum_index":26635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylnicotinic acid (delta mass: 28.0317 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.087,"smiles":null,"spectrum_id":"CCMSLIB00017261009","spectrum_index":26636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 14.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.1,"smiles":null,"spectrum_id":"CCMSLIB00017261011","spectrum_index":26637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 25.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.139,"smiles":null,"spectrum_id":"CCMSLIB00017261013","spectrum_index":26638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 126.0315 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.128,"smiles":null,"spectrum_id":"CCMSLIB00017261015","spectrum_index":26639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 132.0417 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.144,"smiles":null,"spectrum_id":"CCMSLIB00017261018","spectrum_index":26640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 192.036 Da; putative annotation: N/A; putative formula: C9H8N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.135,"smiles":null,"spectrum_id":"CCMSLIB00017261021","spectrum_index":26641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 24.0227 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.099,"smiles":null,"spectrum_id":"CCMSLIB00017261023","spectrum_index":26642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 308.1034 Da; putative annotation: N/A; putative formula: C13H25O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.199,"smiles":null,"spectrum_id":"CCMSLIB00017261025","spectrum_index":26643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 85.0455 Da; putative annotation: N/A; putative formula: C4H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.104,"smiles":null,"spectrum_id":"CCMSLIB00017261028","spectrum_index":26644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Gln (delta mass: 99.0687 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.214,"smiles":null,"spectrum_id":"CCMSLIB00017261031","spectrum_index":26645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 54.0105 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.07,"smiles":null,"spectrum_id":"CCMSLIB00017261032","spectrum_index":26646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 57.0703 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.13,"smiles":null,"spectrum_id":"CCMSLIB00017261035","spectrum_index":26647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 166.0993 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.227,"smiles":null,"spectrum_id":"CCMSLIB00017261036","spectrum_index":26648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.17,"smiles":null,"spectrum_id":"CCMSLIB00017261039","spectrum_index":26649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 63.0456 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017261042","spectrum_index":26650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 140.1567 Da; putative annotation: N/A; putative formula: C10H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.243,"smiles":null,"spectrum_id":"CCMSLIB00017261043","spectrum_index":26651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 112.0891 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.197,"smiles":null,"spectrum_id":"CCMSLIB00017261046","spectrum_index":26652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 163.0844 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.311,"smiles":null,"spectrum_id":"CCMSLIB00017261049","spectrum_index":26653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 68.998 Da; putative annotation: N/A; putative formula: CH-1N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.1,"smiles":null,"spectrum_id":"CCMSLIB00017261050","spectrum_index":26654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 58.8209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.897,"smiles":null,"spectrum_id":"CCMSLIB00017261053","spectrum_index":26655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 128.0485 Da; putative annotation: N/A; putative formula: C7H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.108,"smiles":null,"spectrum_id":"CCMSLIB00017261056","spectrum_index":26656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381117-01!2-amino-4-hydroxy-5-[[1-(4-methoxy-6-oxopyran-2-yl)-3-methylbutyl]amino]-5-oxopentanoic acid (delta mass: 27.9961 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.162,"smiles":null,"spectrum_id":"CCMSLIB00017261058","spectrum_index":26657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 444.2545 Da; putative annotation: N/A; putative formula: C23H40O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.356,"smiles":null,"spectrum_id":"CCMSLIB00017261060","spectrum_index":26658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 41.0285 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.104,"smiles":null,"spectrum_id":"CCMSLIB00017261063","spectrum_index":26659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 116.0466 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.2,"smiles":null,"spectrum_id":"CCMSLIB00017261065","spectrum_index":26660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 584.3534 Da; putative annotation: N/A; putative formula: C27H48N6O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.419,"smiles":null,"spectrum_id":"CCMSLIB00017261067","spectrum_index":26661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 57.0826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.148,"smiles":null,"spectrum_id":"CCMSLIB00017261070","spectrum_index":26662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cloethocarb (delta mass: 46.011 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.079,"smiles":null,"spectrum_id":"CCMSLIB00017261073","spectrum_index":26663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 221.09 Da; putative annotation: N/A; putative formula: C8H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.129,"smiles":null,"spectrum_id":"CCMSLIB00017261074","spectrum_index":26664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myrtucommulone B (delta mass: 18.0385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.25,"smiles":null,"spectrum_id":"CCMSLIB00017261077","spectrum_index":26665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 78.0455 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.132,"smiles":null,"spectrum_id":"CCMSLIB00017261080","spectrum_index":26666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 719.5545 Da; putative annotation: N/A; putative formula: C52H69N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.615,"smiles":null,"spectrum_id":"CCMSLIB00017261081","spectrum_index":26667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 717.5393 Da; putative annotation: N/A; putative formula: C39H75NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":880.599,"smiles":null,"spectrum_id":"CCMSLIB00017261084","spectrum_index":26668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 280.2414 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.365,"smiles":null,"spectrum_id":"CCMSLIB00017261087","spectrum_index":26669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 70.04 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.22,"smiles":null,"spectrum_id":"CCMSLIB00017261088","spectrum_index":26670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 177.838 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.898,"smiles":null,"spectrum_id":"CCMSLIB00017261091","spectrum_index":26671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 54.9982 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.121,"smiles":null,"spectrum_id":"CCMSLIB00017261094","spectrum_index":26672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 76.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.134,"smiles":null,"spectrum_id":"CCMSLIB00017261096","spectrum_index":26673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 28.9899 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.087,"smiles":null,"spectrum_id":"CCMSLIB00017261098","spectrum_index":26674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 27.9953 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017261101","spectrum_index":26675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 279.1093 Da; putative annotation: N/A; putative formula: C11H9N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.19,"smiles":null,"spectrum_id":"CCMSLIB00017261103","spectrum_index":26676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 128.0361 Da; putative annotation: N/A; putative formula: C8H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.154,"smiles":null,"spectrum_id":"CCMSLIB00017261106","spectrum_index":26677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 196.0891 Da; putative annotation: N/A; putative formula: C14H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017261109","spectrum_index":26678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 374.9196 Da; putative annotation: N/A; putative formula: C4H11NO11P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.0,"smiles":null,"spectrum_id":"CCMSLIB00017261111","spectrum_index":26679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 194.1677 Da; putative annotation: N/A; putative formula: C13H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.264,"smiles":null,"spectrum_id":"CCMSLIB00017261114","spectrum_index":26680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 44.0403 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.144,"smiles":null,"spectrum_id":"CCMSLIB00017261116","spectrum_index":26681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 360.1554 Da; putative annotation: N/A; putative formula: C17H24N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.263,"smiles":null,"spectrum_id":"CCMSLIB00017261119","spectrum_index":26682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 96.0688 Da; putative annotation: N/A; putative formula: C5H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.171,"smiles":null,"spectrum_id":"CCMSLIB00017261121","spectrum_index":26683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 244.1305 Da; putative annotation: N/A; putative formula: C12H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.217,"smiles":null,"spectrum_id":"CCMSLIB00017261124","spectrum_index":26684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORADRENALINE (delta mass: 64.0679 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.149,"smiles":null,"spectrum_id":"CCMSLIB00017261127","spectrum_index":26685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 189.1937 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.389,"smiles":null,"spectrum_id":"CCMSLIB00017261128","spectrum_index":26686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 15.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.186,"smiles":null,"spectrum_id":"CCMSLIB00017261131","spectrum_index":26687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 184.1209 Da; putative annotation: N/A; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.255,"smiles":null,"spectrum_id":"CCMSLIB00017261134","spectrum_index":26688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 236.0126 Da; putative annotation: N/A; putative formula: C15H8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.05,"smiles":null,"spectrum_id":"CCMSLIB00017261135","spectrum_index":26689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 571.3929 Da; putative annotation: N/A; putative formula: C40H49N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.432,"smiles":null,"spectrum_id":"CCMSLIB00017261138","spectrum_index":26690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 181.8153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.875,"smiles":null,"spectrum_id":"CCMSLIB00017261141","spectrum_index":26691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Diphenyl-1H-indole-7-carboxylic acid (delta mass: 129.0329 Da; putative annotation: N/A; putative formula: C7H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.151,"smiles":null,"spectrum_id":"CCMSLIB00017261143","spectrum_index":26692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 316.8841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.975,"smiles":null,"spectrum_id":"CCMSLIB00017261145","spectrum_index":26693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 133.9996 Da; putative annotation: N/A; putative formula: CH3N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.06,"smiles":null,"spectrum_id":"CCMSLIB00017261148","spectrum_index":26694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 149.1518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.183,"smiles":null,"spectrum_id":"CCMSLIB00017261150","spectrum_index":26695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 102.0275 Da; putative annotation: N/A; putative formula: H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.105,"smiles":null,"spectrum_id":"CCMSLIB00017261152","spectrum_index":26696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 92.0346 Da; putative annotation: N/A; putative formula: H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.1,"smiles":null,"spectrum_id":"CCMSLIB00017261155","spectrum_index":26697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 355.1693 Da; putative annotation: N/A; putative formula: C16H21N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.24,"smiles":null,"spectrum_id":"CCMSLIB00017261158","spectrum_index":26698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 120.9753 Da; putative annotation: N/A; putative formula: C2H4NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.023,"smiles":null,"spectrum_id":"CCMSLIB00017261159","spectrum_index":26699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Aminocarbonyl)-L-phenylalanine (delta mass: 32.0048 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.097,"smiles":null,"spectrum_id":"CCMSLIB00017261162","spectrum_index":26700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 272.1297 Da; putative annotation: N/A; putative formula: C13H17N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.201,"smiles":null,"spectrum_id":"CCMSLIB00017261165","spectrum_index":26701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 169.1077 Da; putative annotation: N/A; putative formula: C5H11N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.376,"smiles":null,"spectrum_id":"CCMSLIB00017261166","spectrum_index":26702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 220.1459 Da; putative annotation: N/A; putative formula: C14H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017261169","spectrum_index":26703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 73.057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.178,"smiles":null,"spectrum_id":"CCMSLIB00017261172","spectrum_index":26704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 285.2306 Da; putative annotation: N/A; putative formula: C16H31NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.291,"smiles":null,"spectrum_id":"CCMSLIB00017261173","spectrum_index":26705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-3-ylmethanamine (delta mass: 65.0283 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.115,"smiles":null,"spectrum_id":"CCMSLIB00017261176","spectrum_index":26706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 117.0589 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.161,"smiles":null,"spectrum_id":"CCMSLIB00017261179","spectrum_index":26707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 153.0423 Da; putative annotation: N/A; putative formula: C7H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.155,"smiles":null,"spectrum_id":"CCMSLIB00017261180","spectrum_index":26708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 169.9626 Da; putative annotation: N/A; putative formula: C3H7O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.044,"smiles":null,"spectrum_id":"CCMSLIB00017261183","spectrum_index":26709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 156.0361 Da; putative annotation: N/A; putative formula: C14H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.127,"smiles":null,"spectrum_id":"CCMSLIB00017261186","spectrum_index":26710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Acetyl-1-piperazinyl)-3-methylaniline (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.171,"smiles":null,"spectrum_id":"CCMSLIB00017261187","spectrum_index":26711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.113,"smiles":null,"spectrum_id":"CCMSLIB00017261190","spectrum_index":26712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 166.1214 Da; putative annotation: N/A; putative formula: C8H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.203,"smiles":null,"spectrum_id":"CCMSLIB00017261191","spectrum_index":26713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1181.6937 Da; putative annotation: N/A; putative formula: C59H107NO18S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1403.79,"smiles":null,"spectrum_id":"CCMSLIB00017261194","spectrum_index":26714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 409.2672 Da; putative annotation: N/A; putative formula: C19H39NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.327,"smiles":null,"spectrum_id":"CCMSLIB00017261197","spectrum_index":26715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 667.2817 Da; putative annotation: N/A; putative formula: C30H48N5O6P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.342,"smiles":null,"spectrum_id":"CCMSLIB00017261198","spectrum_index":26716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1128.7935 Da; putative annotation: N/A; putative formula: C64H120O7S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1350.89,"smiles":null,"spectrum_id":"CCMSLIB00017261201","spectrum_index":26717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 625.3089 Da; putative annotation: N/A; putative formula: C36H43N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.369,"smiles":null,"spectrum_id":"CCMSLIB00017261204","spectrum_index":26718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 14.0277 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.098,"smiles":null,"spectrum_id":"CCMSLIB00017261205","spectrum_index":26719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 185.0479 Da; putative annotation: N/A; putative formula: C11H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.145,"smiles":null,"spectrum_id":"CCMSLIB00017261208","spectrum_index":26720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 343.1692 Da; putative annotation: N/A; putative formula: C15H21N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.323,"smiles":null,"spectrum_id":"CCMSLIB00017261210","spectrum_index":26721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 1172.5558 Da; putative annotation: N/A; putative formula: C64H84O20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1353.63,"smiles":null,"spectrum_id":"CCMSLIB00017261212","spectrum_index":26722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 131.0737 Da; putative annotation: N/A; putative formula: C9H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.186,"smiles":null,"spectrum_id":"CCMSLIB00017261215","spectrum_index":26723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-His (delta mass: 131.0416 Da; putative annotation: N/A; putative formula: C5H11NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.14,"smiles":null,"spectrum_id":"CCMSLIB00017261217","spectrum_index":26724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 74.073 Da; putative annotation: N/A; putative formula: H6N6O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.122,"smiles":null,"spectrum_id":"CCMSLIB00017261219","spectrum_index":26725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 180.0707 Da; putative annotation: N/A; putative formula: C3H13N6O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.22,"smiles":null,"spectrum_id":"CCMSLIB00017261222","spectrum_index":26726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 299.1949 Da; putative annotation: N/A; putative formula: C15H30N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.25,"smiles":null,"spectrum_id":"CCMSLIB00017261224","spectrum_index":26727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 246.1378 Da; putative annotation: N/A; putative formula: C14H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.197,"smiles":null,"spectrum_id":"CCMSLIB00017261226","spectrum_index":26728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 21.9819 Da; putative annotation: N/A; putative formula: C2H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.042,"smiles":null,"spectrum_id":"CCMSLIB00017261229","spectrum_index":26729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 84.0209 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.092,"smiles":null,"spectrum_id":"CCMSLIB00017261231","spectrum_index":26730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 82.0512 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.105,"smiles":null,"spectrum_id":"CCMSLIB00017261233","spectrum_index":26731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 177.0961 Da; putative annotation: N/A; putative formula: C6H17N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.13,"smiles":null,"spectrum_id":"CCMSLIB00017261235","spectrum_index":26732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 222.1158 Da; putative annotation: N/A; putative formula: C15H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.265,"smiles":null,"spectrum_id":"CCMSLIB00017261238","spectrum_index":26733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 387.2622 Da; putative annotation: N/A; putative formula: C20H37NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.317,"smiles":null,"spectrum_id":"CCMSLIB00017261241","spectrum_index":26734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 18,20-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0,?.0?,?.0?,?]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaen-17-ol (delta mass: 42.0102 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.144,"smiles":null,"spectrum_id":"CCMSLIB00017261243","spectrum_index":26735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 103.0733 Da; putative annotation: N/A; putative formula: C3H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.16,"smiles":null,"spectrum_id":"CCMSLIB00017261245","spectrum_index":26736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 206.2237 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.31,"smiles":null,"spectrum_id":"CCMSLIB00017261248","spectrum_index":26737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 182.0943 Da; putative annotation: N/A; putative formula: C10H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.233,"smiles":null,"spectrum_id":"CCMSLIB00017261250","spectrum_index":26738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 120.0686 Da; putative annotation: N/A; putative formula: C7H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.129,"smiles":null,"spectrum_id":"CCMSLIB00017261252","spectrum_index":26739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxymirtazapine (delta mass: 192.0876 Da; putative annotation: N/A; putative formula: C6H8N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.248,"smiles":null,"spectrum_id":"CCMSLIB00017261255","spectrum_index":26740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 139.8927 Da; putative annotation: N/A; putative formula: H-2O3P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.0,"smiles":null,"spectrum_id":"CCMSLIB00017261256","spectrum_index":26741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 87.0684 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.233,"smiles":null,"spectrum_id":"CCMSLIB00017261259","spectrum_index":26742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 111.1906 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.376,"smiles":null,"spectrum_id":"CCMSLIB00017261261","spectrum_index":26743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 104.067 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.19,"smiles":null,"spectrum_id":"CCMSLIB00017261263","spectrum_index":26744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 58.042 Da; putative annotation: N/A; putative formula: C3H6O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017261266","spectrum_index":26745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Formoterol (delta mass: 60.041 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.222,"smiles":null,"spectrum_id":"CCMSLIB00017261267","spectrum_index":26746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethoxyethoxyethanol (delta mass: 131.0948 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.196,"smiles":null,"spectrum_id":"CCMSLIB00017261270","spectrum_index":26747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 544.221 Da; putative annotation: N/A; putative formula: C31H32N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":873.49,"smiles":null,"spectrum_id":"CCMSLIB00017261273","spectrum_index":26748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-(2-oxo-2-phenylethyl)-1,3-dihydro-2H-indol-2-one (delta mass: 75.0349 Da; putative annotation: N/A; putative formula: CH6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.132,"smiles":null,"spectrum_id":"CCMSLIB00017261274","spectrum_index":26749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 71.9296 Da; putative annotation: N/A; putative formula: CH-2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.99,"smiles":null,"spectrum_id":"CCMSLIB00017261277","spectrum_index":26750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 133.995 Da; putative annotation: N/A; putative formula: C4H7OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.034,"smiles":null,"spectrum_id":"CCMSLIB00017261280","spectrum_index":26751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 309.1583 Da; putative annotation: N/A; putative formula: C9H23N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.218,"smiles":null,"spectrum_id":"CCMSLIB00017261282","spectrum_index":26752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corynanthin (delta mass: 125.0573 Da; putative annotation: N/A; putative formula: CH3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.259,"smiles":null,"spectrum_id":"CCMSLIB00017261284","spectrum_index":26753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 438.1253 Da; putative annotation: 2-Oxo-2H-chromen-7-yl 6-O-.beta.-D-xylopyranosyl-.beta.-D-glucopyranoside; putative formula: C20H22O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.166,"smiles":null,"spectrum_id":"CCMSLIB00017261287","spectrum_index":26754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 195.0894 Da; putative annotation: Massbank:PR300659 Kainic acid; putative formula: C10H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.165,"smiles":null,"spectrum_id":"CCMSLIB00017261289","spectrum_index":26755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 113.0476 Da; putative annotation: (3R)-3-Hydroxy-L-proline; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017261292","spectrum_index":26756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 198.1007 Da; putative annotation: (1R,6R)-6-Benzylcyclohex-3-enecarboxylic acid; putative formula: C14H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.187,"smiles":null,"spectrum_id":"CCMSLIB00017261294","spectrum_index":26757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 176.046 Da; putative annotation: Caffeic acid methylester; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.095,"smiles":null,"spectrum_id":"CCMSLIB00017261297","spectrum_index":26758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 133.0389 Da; putative annotation: 8-Oxoadenine; putative formula: C5H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.215,"smiles":null,"spectrum_id":"CCMSLIB00017261299","spectrum_index":26759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-(pyridin-3-yl)quinazolin-4-amine (delta mass: 329.1603 Da; putative annotation: N/A; putative formula: C23H23NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.305,"smiles":null,"spectrum_id":"CCMSLIB00017261301","spectrum_index":26760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 78.0283 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.214,"smiles":null,"spectrum_id":"CCMSLIB00017261304","spectrum_index":26761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 56.0391 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.135,"smiles":null,"spectrum_id":"CCMSLIB00017261307","spectrum_index":26762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 111.098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.174,"smiles":null,"spectrum_id":"CCMSLIB00017261308","spectrum_index":26763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 79.966 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.09,"smiles":null,"spectrum_id":"CCMSLIB00017261311","spectrum_index":26764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 293.1117 Da; putative annotation: N/A; putative formula: C14H20N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.271,"smiles":null,"spectrum_id":"CCMSLIB00017261314","spectrum_index":26765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 570.215 Da; putative annotation: N/A; putative formula: C28H34N4O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.312,"smiles":null,"spectrum_id":"CCMSLIB00017261315","spectrum_index":26766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 209.1783 Da; putative annotation: N/A; putative formula: C13H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.447,"smiles":null,"spectrum_id":"CCMSLIB00017261318","spectrum_index":26767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 138.1963 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.262,"smiles":null,"spectrum_id":"CCMSLIB00017261321","spectrum_index":26768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 193.0584 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.155,"smiles":null,"spectrum_id":"CCMSLIB00017261322","spectrum_index":26769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.032,"smiles":null,"spectrum_id":"CCMSLIB00017261325","spectrum_index":26770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 294.3495 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.519,"smiles":null,"spectrum_id":"CCMSLIB00017261328","spectrum_index":26771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 921.5102 Da; putative annotation: N/A; putative formula: C49H71N5O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1102.58,"smiles":null,"spectrum_id":"CCMSLIB00017261329","spectrum_index":26772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Benz[g]indole-2-carboxylic acid (delta mass: 95.0698 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.14,"smiles":null,"spectrum_id":"CCMSLIB00017261332","spectrum_index":26773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 194.0948 Da; putative annotation: N/A; putative formula: C11H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.228,"smiles":null,"spectrum_id":"CCMSLIB00017261333","spectrum_index":26774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 249.1724 Da; putative annotation: N/A; putative formula: C15H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.321,"smiles":null,"spectrum_id":"CCMSLIB00017261336","spectrum_index":26775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 104.0375 Da; putative annotation: N/A; putative formula: C6H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017261339","spectrum_index":26776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 242.2034 Da; putative annotation: N/A; putative formula: C18H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.3,"smiles":null,"spectrum_id":"CCMSLIB00017261341","spectrum_index":26777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 56.9879 Da; putative annotation: N/A; putative formula: N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017261343","spectrum_index":26778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.065,"smiles":null,"spectrum_id":"CCMSLIB00017261345","spectrum_index":26779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 131.1042 Da; putative annotation: N/A; putative formula: CH9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.379,"smiles":null,"spectrum_id":"CCMSLIB00017261347","spectrum_index":26780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 156.1743 Da; putative annotation: N/A; putative formula: C8H20N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.25,"smiles":null,"spectrum_id":"CCMSLIB00017261349","spectrum_index":26781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 178.2066 Da; putative annotation: N/A; putative formula: C14H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.34,"smiles":null,"spectrum_id":"CCMSLIB00017261352","spectrum_index":26782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 26.0045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017261353","spectrum_index":26783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 129.0103 Da; putative annotation: N/A; putative formula: C2H3N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.07,"smiles":null,"spectrum_id":"CCMSLIB00017261356","spectrum_index":26784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetyl-5-hydroxy-3-methylphenyl .beta.-D-glucopyranoside (delta mass: 317.1108 Da; putative annotation: N/A; putative formula: C13H19NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.234,"smiles":null,"spectrum_id":"CCMSLIB00017261358","spectrum_index":26785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 274.105 Da; putative annotation: N/A; putative formula: C12H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.229,"smiles":null,"spectrum_id":"CCMSLIB00017261361","spectrum_index":26786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 12.0029 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.079,"smiles":null,"spectrum_id":"CCMSLIB00017261362","spectrum_index":26787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 160.0593 Da; putative annotation: N/A; putative formula: C4H8N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.13,"smiles":null,"spectrum_id":"CCMSLIB00017261365","spectrum_index":26788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 368.0968 Da; putative annotation: N/A; putative formula: C14H16N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.23,"smiles":null,"spectrum_id":"CCMSLIB00017261366","spectrum_index":26789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 176.0993 Da; putative annotation: N/A; putative formula: C15H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.159,"smiles":null,"spectrum_id":"CCMSLIB00017261369","spectrum_index":26790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 93.0419 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.119,"smiles":null,"spectrum_id":"CCMSLIB00017261370","spectrum_index":26791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 685.4199 Da; putative annotation: N/A; putative formula: C40H63NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.491,"smiles":null,"spectrum_id":"CCMSLIB00017261373","spectrum_index":26792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 42.1043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.191,"smiles":null,"spectrum_id":"CCMSLIB00017261375","spectrum_index":26793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 187.1361 Da; putative annotation: N/A; putative formula: C13H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.186,"smiles":null,"spectrum_id":"CCMSLIB00017261377","spectrum_index":26794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 202.1821 Da; putative annotation: N/A; putative formula: C14H22N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.269,"smiles":null,"spectrum_id":"CCMSLIB00017261379","spectrum_index":26795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 17.0987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.404,"smiles":null,"spectrum_id":"CCMSLIB00017261382","spectrum_index":26796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 341.1136 Da; putative annotation: N/A; putative formula: C17H11N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.162,"smiles":null,"spectrum_id":"CCMSLIB00017261384","spectrum_index":26797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 110.0344 Da; putative annotation: N/A; putative formula: C2H2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.073,"smiles":null,"spectrum_id":"CCMSLIB00017261385","spectrum_index":26798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 149.0819 Da; putative annotation: N/A; putative formula: C5H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.211,"smiles":null,"spectrum_id":"CCMSLIB00017261388","spectrum_index":26799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 784.4808 Da; putative annotation: N/A; putative formula: C43H68N4O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":965.552,"smiles":null,"spectrum_id":"CCMSLIB00017261390","spectrum_index":26800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU150901 Fluoxetine|N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine (delta mass: 71.9768 Da; putative annotation: N/A; putative formula: C2HOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.118,"smiles":null,"spectrum_id":"CCMSLIB00017261392","spectrum_index":26801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 662.2582 Da; putative annotation: N/A; putative formula: C47H30N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.339,"smiles":null,"spectrum_id":"CCMSLIB00017261395","spectrum_index":26802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 141.0801 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.157,"smiles":null,"spectrum_id":"CCMSLIB00017261398","spectrum_index":26803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 299.1547 Da; putative annotation: N/A; putative formula: C17H22N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.225,"smiles":null,"spectrum_id":"CCMSLIB00017261399","spectrum_index":26804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Skatole - 40.0 eV (delta mass: 1.9985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.079,"smiles":null,"spectrum_id":"CCMSLIB00017261402","spectrum_index":26805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 143.047 Da; putative annotation: N/A; putative formula: C8H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.134,"smiles":null,"spectrum_id":"CCMSLIB00017261403","spectrum_index":26806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diaveridine (delta mass: 34.0667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.201,"smiles":null,"spectrum_id":"CCMSLIB00017261406","spectrum_index":26807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 114.0584 Da; putative annotation: N/A; putative formula: C8H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.15,"smiles":null,"spectrum_id":"CCMSLIB00017261409","spectrum_index":26808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 227.1522 Da; putative annotation: N/A; putative formula: C12H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.264,"smiles":null,"spectrum_id":"CCMSLIB00017261410","spectrum_index":26809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 149.8465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.912,"smiles":null,"spectrum_id":"CCMSLIB00017261413","spectrum_index":26810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 138.074 Da; putative annotation: N/A; putative formula: C3H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.189,"smiles":null,"spectrum_id":"CCMSLIB00017261416","spectrum_index":26811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 576.2041 Da; putative annotation: N/A; putative formula: C22H28N10O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.253,"smiles":null,"spectrum_id":"CCMSLIB00017261418","spectrum_index":26812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 334.0516 Da; putative annotation: N/A; putative formula: C9H14N6O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.112,"smiles":null,"spectrum_id":"CCMSLIB00017261420","spectrum_index":26813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 8.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017261423","spectrum_index":26814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Val (delta mass: 297.1332 Da; putative annotation: N/A; putative formula: C14H23N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.304,"smiles":null,"spectrum_id":"CCMSLIB00017261425","spectrum_index":26815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304214 Indole-3-acetyl-L-alanine (delta mass: 45.0103 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.118,"smiles":null,"spectrum_id":"CCMSLIB00017261427","spectrum_index":26816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 146.0725 Da; putative annotation: N/A; putative formula: C4H11N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.143,"smiles":null,"spectrum_id":"CCMSLIB00017261430","spectrum_index":26817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 60.0291 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.071,"smiles":null,"spectrum_id":"CCMSLIB00017261432","spectrum_index":26818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 320.0513 Da; putative annotation: N/A; putative formula: C12H12N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.11,"smiles":null,"spectrum_id":"CCMSLIB00017261434","spectrum_index":26819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 260.0577 Da; putative annotation: N/A; putative formula: C8H12N4O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.134,"smiles":null,"spectrum_id":"CCMSLIB00017261437","spectrum_index":26820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 59.0734 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.112,"smiles":null,"spectrum_id":"CCMSLIB00017261438","spectrum_index":26821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 495.2929 Da; putative annotation: N/A; putative formula: C22H33N13O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.384,"smiles":null,"spectrum_id":"CCMSLIB00017261441","spectrum_index":26822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 52.0347 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.126,"smiles":null,"spectrum_id":"CCMSLIB00017261444","spectrum_index":26823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 42.0219 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.155,"smiles":null,"spectrum_id":"CCMSLIB00017261445","spectrum_index":26824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 173.0786 Da; putative annotation: N/A; putative formula: C8H16NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.228,"smiles":null,"spectrum_id":"CCMSLIB00017261448","spectrum_index":26825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 63.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.113,"smiles":null,"spectrum_id":"CCMSLIB00017261451","spectrum_index":26826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Keto-1-methyl-3H-imidazo[4,5-b]pyridin-6-yl)benzamide (delta mass: 174.3967 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.5,"smiles":null,"spectrum_id":"CCMSLIB00017261452","spectrum_index":26827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 60.0547 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.24,"smiles":null,"spectrum_id":"CCMSLIB00017261455","spectrum_index":26828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 158.1147 Da; putative annotation: N/A; putative formula: C2H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.248,"smiles":null,"spectrum_id":"CCMSLIB00017261457","spectrum_index":26829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltotetraose from NIST14 (delta mass: 207.1372 Da; putative annotation: N/A; putative formula: C11H17N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.366,"smiles":null,"spectrum_id":"CCMSLIB00017261459","spectrum_index":26830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 118.0269 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.123,"smiles":null,"spectrum_id":"CCMSLIB00017261462","spectrum_index":26831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 114.1764 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.252,"smiles":null,"spectrum_id":"CCMSLIB00017261465","spectrum_index":26832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 183.1525 Da; putative annotation: N/A; putative formula: C11H22NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.213,"smiles":null,"spectrum_id":"CCMSLIB00017261466","spectrum_index":26833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169534-02_C14H18O9_Ethanone, 1-[4-(beta-D-glucopyranosyloxy)-2,6-dihydroxyphenyl]- (delta mass: 146.0576 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.16,"smiles":null,"spectrum_id":"CCMSLIB00017261469","spectrum_index":26834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (delta mass: 358.1258 Da; putative annotation: N/A; putative formula: C16H22O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.27,"smiles":null,"spectrum_id":"CCMSLIB00017261472","spectrum_index":26835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tributyl citrate (delta mass: 59.0348 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.257,"smiles":null,"spectrum_id":"CCMSLIB00017261473","spectrum_index":26836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 295.1848 Da; putative annotation: N/A; putative formula: C20H26NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.338,"smiles":null,"spectrum_id":"CCMSLIB00017261476","spectrum_index":26837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 290.1156 Da; putative annotation: N/A; putative formula: C11H15N8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.186,"smiles":null,"spectrum_id":"CCMSLIB00017261478","spectrum_index":26838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 228.1476 Da; putative annotation: N/A; putative formula: C11H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.292,"smiles":null,"spectrum_id":"CCMSLIB00017261480","spectrum_index":26839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 957.4936 Da; putative annotation: N/A; putative formula: C61H71N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1120.55,"smiles":null,"spectrum_id":"CCMSLIB00017261483","spectrum_index":26840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 132.0397 Da; putative annotation: N/A; putative formula: C9H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.142,"smiles":null,"spectrum_id":"CCMSLIB00017261485","spectrum_index":26841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ332501 Epinephrine|4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol (delta mass: 92.0981 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.195,"smiles":null,"spectrum_id":"CCMSLIB00017261488","spectrum_index":26842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 138.0555 Da; putative annotation: N/A; putative formula: C5H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.182,"smiles":null,"spectrum_id":"CCMSLIB00017261490","spectrum_index":26843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-6-methoxy-2-methylspiro[3,4-dihydroisoquinoline-1,7'-6H-cyclopenta[g][1,3]benzodioxole]-8'-one (delta mass: 170.0992 Da; putative annotation: N/A; putative formula: C7H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.233,"smiles":null,"spectrum_id":"CCMSLIB00017261493","spectrum_index":26844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 454.3024 Da; putative annotation: N/A; putative formula: C36H38O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.373,"smiles":null,"spectrum_id":"CCMSLIB00017261495","spectrum_index":26845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 176.0845 Da; putative annotation: N/A; putative formula: C11H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.208,"smiles":null,"spectrum_id":"CCMSLIB00017261498","spectrum_index":26846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 28.024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017261500","spectrum_index":26847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 32.0048 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017261503","spectrum_index":26848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 70.0413 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.107,"smiles":null,"spectrum_id":"CCMSLIB00017261505","spectrum_index":26849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 635.3414 Da; putative annotation: N/A; putative formula: C45H41N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.439,"smiles":null,"spectrum_id":"CCMSLIB00017261507","spectrum_index":26850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 129.9241 Da; putative annotation: N/A; putative formula: C2H-1N2O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.015,"smiles":null,"spectrum_id":"CCMSLIB00017261510","spectrum_index":26851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 58.0418 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.133,"smiles":null,"spectrum_id":"CCMSLIB00017261512","spectrum_index":26852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 99.9794 Da; putative annotation: N/A; putative formula: C3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.039,"smiles":null,"spectrum_id":"CCMSLIB00017261515","spectrum_index":26853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 162.9627 Da; putative annotation: N/A; putative formula: CHN5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.139,"smiles":null,"spectrum_id":"CCMSLIB00017261517","spectrum_index":26854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 128.0623 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017261520","spectrum_index":26855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Felbinac (delta mass: 46.0068 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.098,"smiles":null,"spectrum_id":"CCMSLIB00017261522","spectrum_index":26856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 43.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017261525","spectrum_index":26857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 279.1471 Da; putative annotation: N/A; putative formula: C15H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.218,"smiles":null,"spectrum_id":"CCMSLIB00017261526","spectrum_index":26858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 185.2222 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.337,"smiles":null,"spectrum_id":"CCMSLIB00017261529","spectrum_index":26859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 271.1098 Da; putative annotation: N/A; putative formula: C12H14N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.185,"smiles":null,"spectrum_id":"CCMSLIB00017261530","spectrum_index":26860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301852 Norharman (delta mass: 256.2613 Da; putative annotation: N/A; putative formula: C14H32N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.337,"smiles":null,"spectrum_id":"CCMSLIB00017261533","spectrum_index":26861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 251.2252 Da; putative annotation: N/A; putative formula: C16H29NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.311,"smiles":null,"spectrum_id":"CCMSLIB00017261536","spectrum_index":26862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 552.4311 Da; putative annotation: N/A; putative formula: C33H61O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.468,"smiles":null,"spectrum_id":"CCMSLIB00017261538","spectrum_index":26863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 183.1207 Da; putative annotation: N/A; putative formula: C9H17N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.169,"smiles":null,"spectrum_id":"CCMSLIB00017261540","spectrum_index":26864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 102.0837 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.159,"smiles":null,"spectrum_id":"CCMSLIB00017261543","spectrum_index":26865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 129.0416 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.146,"smiles":null,"spectrum_id":"CCMSLIB00017261544","spectrum_index":26866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-hydroxy-1,7-diphenylhept-1-en-3-one (delta mass: 132.0859 Da; putative annotation: N/A; putative formula: CH8N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.24,"smiles":null,"spectrum_id":"CCMSLIB00017261547","spectrum_index":26867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 36.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.197,"smiles":null,"spectrum_id":"CCMSLIB00017261550","spectrum_index":26868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 88.0161 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.15,"smiles":null,"spectrum_id":"CCMSLIB00017261551","spectrum_index":26869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 130.0571 Da; putative annotation: N/A; putative formula: C5H10N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.191,"smiles":null,"spectrum_id":"CCMSLIB00017261554","spectrum_index":26870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 142.0787 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.165,"smiles":null,"spectrum_id":"CCMSLIB00017261557","spectrum_index":26871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 234.1538 Da; putative annotation: N/A; putative formula: C15H23P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.224,"smiles":null,"spectrum_id":"CCMSLIB00017261559","spectrum_index":26872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 78.0105 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.134,"smiles":null,"spectrum_id":"CCMSLIB00017261561","spectrum_index":26873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 209.0898 Da; putative annotation: N/A; putative formula: C7H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.223,"smiles":null,"spectrum_id":"CCMSLIB00017261564","spectrum_index":26874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 149.0864 Da; putative annotation: N/A; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.129,"smiles":null,"spectrum_id":"CCMSLIB00017261566","spectrum_index":26875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 564.3808 Da; putative annotation: N/A; putative formula: C28H56N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.451,"smiles":null,"spectrum_id":"CCMSLIB00017261569","spectrum_index":26876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-(4-Chlorophenyl)ethyl](methyl)amine (delta mass: 34.0288 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017261571","spectrum_index":26877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 130.0423 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017261574","spectrum_index":26878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 44.0628 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.128,"smiles":null,"spectrum_id":"CCMSLIB00017261576","spectrum_index":26879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 237.0981 Da; putative annotation: N/A; putative formula: C16H15NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":904.327,"smiles":null,"spectrum_id":"CCMSLIB00017261578","spectrum_index":26880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU229306 2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP)|2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine|1-methyl-6-phenylimidazo[4,5-b]pyridin-2-amine (delta mass: 80.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.156,"smiles":null,"spectrum_id":"CCMSLIB00017261581","spectrum_index":26881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 119.0371 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.118,"smiles":null,"spectrum_id":"CCMSLIB00017261583","spectrum_index":26882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 821.415 Da; putative annotation: N/A; putative formula: C50H55N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":976.485,"smiles":null,"spectrum_id":"CCMSLIB00017261585","spectrum_index":26883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:102040 (delta mass: 91.0474 Da; putative annotation: N/A; putative formula: H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.143,"smiles":null,"spectrum_id":"CCMSLIB00017261588","spectrum_index":26884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 130.0621 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.2,"smiles":null,"spectrum_id":"CCMSLIB00017261591","spectrum_index":26885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 129.0424 Da; putative annotation: N/A; putative formula: C5H7NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.092,"smiles":null,"spectrum_id":"CCMSLIB00017261593","spectrum_index":26886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 108.0768 Da; putative annotation: N/A; putative formula: C5H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.226,"smiles":null,"spectrum_id":"CCMSLIB00017261595","spectrum_index":26887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 492.1321 Da; putative annotation: N/A; putative formula: C29H20N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.194,"smiles":null,"spectrum_id":"CCMSLIB00017261598","spectrum_index":26888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 106.0841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.148,"smiles":null,"spectrum_id":"CCMSLIB00017261601","spectrum_index":26889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 100.0193 Da; putative annotation: N/A; putative formula: C3H5N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.095,"smiles":null,"spectrum_id":"CCMSLIB00017261604","spectrum_index":26890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carmoxirole (delta mass: 74.0444 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.251,"smiles":null,"spectrum_id":"CCMSLIB00017261605","spectrum_index":26891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 248.1696 Da; putative annotation: N/A; putative formula: C16H25P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.256,"smiles":null,"spectrum_id":"CCMSLIB00017261608","spectrum_index":26892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 675.2334 Da; putative annotation: N/A; putative formula: C24H41N3O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.294,"smiles":null,"spectrum_id":"CCMSLIB00017261611","spectrum_index":26893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 371.1977 Da; putative annotation: N/A; putative formula: C17H30N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.336,"smiles":null,"spectrum_id":"CCMSLIB00017261612","spectrum_index":26894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 306.0949 Da; putative annotation: N/A; putative formula: C12H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.207,"smiles":null,"spectrum_id":"CCMSLIB00017261615","spectrum_index":26895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 100.0678 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017261618","spectrum_index":26896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 44.974 Da; putative annotation: N/A; putative formula: NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.045,"smiles":null,"spectrum_id":"CCMSLIB00017261620","spectrum_index":26897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-(Difluoromethylthio)phenyl)-N-methylmethanamine (delta mass: 297.3168 Da; putative annotation: N/A; putative formula: C18H39N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.382,"smiles":null,"spectrum_id":"CCMSLIB00017261622","spectrum_index":26898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 93.0455 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.151,"smiles":null,"spectrum_id":"CCMSLIB00017261625","spectrum_index":26899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 23.0774 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.164,"smiles":null,"spectrum_id":"CCMSLIB00017261627","spectrum_index":26900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 246.0723 Da; putative annotation: N/A; putative formula: C7H14N6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.174,"smiles":null,"spectrum_id":"CCMSLIB00017261630","spectrum_index":26901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 507.2405 Da; putative annotation: N/A; putative formula: C25H37N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":817.354,"smiles":null,"spectrum_id":"CCMSLIB00017261632","spectrum_index":26902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Formyl-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.081,"smiles":null,"spectrum_id":"CCMSLIB00017261634","spectrum_index":26903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 271.1789 Da; putative annotation: N/A; putative formula: C15H29NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.25,"smiles":null,"spectrum_id":"CCMSLIB00017261637","spectrum_index":26904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 225.0925 Da; putative annotation: N/A; putative formula: C11H16NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.168,"smiles":null,"spectrum_id":"CCMSLIB00017261640","spectrum_index":26905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 174.1779 Da; putative annotation: N/A; putative formula: C14H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.259,"smiles":null,"spectrum_id":"CCMSLIB00017261642","spectrum_index":26906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 295.1783 Da; putative annotation: N/A; putative formula: C16H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.249,"smiles":null,"spectrum_id":"CCMSLIB00017261644","spectrum_index":26907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 564.422 Da; putative annotation: N/A; putative formula: C27H52N10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.461,"smiles":null,"spectrum_id":"CCMSLIB00017261647","spectrum_index":26908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 189.0998 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.233,"smiles":null,"spectrum_id":"CCMSLIB00017261649","spectrum_index":26909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 63.9914 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.099,"smiles":null,"spectrum_id":"CCMSLIB00017261651","spectrum_index":26910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 147.0507 Da; putative annotation: N/A; putative formula: C9H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.194,"smiles":null,"spectrum_id":"CCMSLIB00017261654","spectrum_index":26911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 17.9325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.008,"smiles":null,"spectrum_id":"CCMSLIB00017261655","spectrum_index":26912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 134.0365 Da; putative annotation: Vanillin; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.123,"smiles":null,"spectrum_id":"CCMSLIB00017261658","spectrum_index":26913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanylleucine (delta mass: 155.0947 Da; putative annotation: N-Acetyl-DL-leucine; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.234,"smiles":null,"spectrum_id":"CCMSLIB00017261661","spectrum_index":26914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 106.0421 Da; putative annotation: 2-Methylresorcinol; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017261662","spectrum_index":26915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 124.0637 Da; putative annotation: Piracetam; putative formula: C6H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.155,"smiles":null,"spectrum_id":"CCMSLIB00017261665","spectrum_index":26916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Ergothioneine (delta mass: 122.0365 Da; putative annotation: 3,5-Dihydroxybenzenemethanol; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.132,"smiles":null,"spectrum_id":"CCMSLIB00017261668","spectrum_index":26917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 312.2096 Da; putative annotation: 11-Hydroxy-.DELTA.9-tetrahydrocannabinol; putative formula: C21H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.333,"smiles":null,"spectrum_id":"CCMSLIB00017261669","spectrum_index":26918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 836.4552 Da; putative annotation: Ophiopogonin D; putative formula: C44H68O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":999.515,"smiles":null,"spectrum_id":"CCMSLIB00017261672","spectrum_index":26919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 136.0513 Da; putative annotation: Terrein; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.216,"smiles":null,"spectrum_id":"CCMSLIB00017261675","spectrum_index":26920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 65.0366 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.125,"smiles":null,"spectrum_id":"CCMSLIB00017261677","spectrum_index":26921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Tryptophan, methyl ester (delta mass: 84.0572 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.17,"smiles":null,"spectrum_id":"CCMSLIB00017261679","spectrum_index":26922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 143.2218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.302,"smiles":null,"spectrum_id":"CCMSLIB00017261682","spectrum_index":26923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 148.1074 Da; putative annotation: N/A; putative formula: C3H12N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.188,"smiles":null,"spectrum_id":"CCMSLIB00017261685","spectrum_index":26924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 67.0156 Da; putative annotation: N/A; putative formula: C2HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.111,"smiles":null,"spectrum_id":"CCMSLIB00017261686","spectrum_index":26925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Val (delta mass: 99.0707 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.216,"smiles":null,"spectrum_id":"CCMSLIB00017261689","spectrum_index":26926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 183.1506 Da; putative annotation: N/A; putative formula: C8H17N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017261692","spectrum_index":26927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 205.1356 Da; putative annotation: N/A; putative formula: C8H20N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.202,"smiles":null,"spectrum_id":"CCMSLIB00017261694","spectrum_index":26928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 41.0487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.161,"smiles":null,"spectrum_id":"CCMSLIB00017261696","spectrum_index":26929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 93.526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.654,"smiles":null,"spectrum_id":"CCMSLIB00017261699","spectrum_index":26930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 40.0539 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.103,"smiles":null,"spectrum_id":"CCMSLIB00017261702","spectrum_index":26931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 88.0152 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.081,"smiles":null,"spectrum_id":"CCMSLIB00017261704","spectrum_index":26932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 428.2914 Da; putative annotation: N/A; putative formula: C21H41N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":933.468,"smiles":null,"spectrum_id":"CCMSLIB00017261706","spectrum_index":26933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 943.5141 Da; putative annotation: N/A; putative formula: C47H77NO18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1124.58,"smiles":null,"spectrum_id":"CCMSLIB00017261709","spectrum_index":26934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 707.4241 Da; putative annotation: N/A; putative formula: C51H53N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.495,"smiles":null,"spectrum_id":"CCMSLIB00017261711","spectrum_index":26935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 462.1575 Da; putative annotation: N/A; putative formula: C21H26N4O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.228,"smiles":null,"spectrum_id":"CCMSLIB00017261714","spectrum_index":26936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 91.0421 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.082,"smiles":null,"spectrum_id":"CCMSLIB00017261716","spectrum_index":26937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 342.1195 Da; putative annotation: N/A; putative formula: C22H18N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.346,"smiles":null,"spectrum_id":"CCMSLIB00017261718","spectrum_index":26938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 180.0665 Da; putative annotation: N/A; putative formula: C5H13N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.309,"smiles":null,"spectrum_id":"CCMSLIB00017261721","spectrum_index":26939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 829.2346 Da; putative annotation: N/A; putative formula: C34H39N9O14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":992.295,"smiles":null,"spectrum_id":"CCMSLIB00017261724","spectrum_index":26940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltopentaose from NIST14 (delta mass: 144.0377 Da; putative annotation: N/A; putative formula: C5H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.32,"smiles":null,"spectrum_id":"CCMSLIB00017261725","spectrum_index":26941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 306.0954 Da; putative annotation: N/A; putative formula: C15H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.219,"smiles":null,"spectrum_id":"CCMSLIB00017261728","spectrum_index":26942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 200.0317 Da; putative annotation: N/A; putative formula: C8H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.071,"smiles":null,"spectrum_id":"CCMSLIB00017261731","spectrum_index":26943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 119.073 Da; putative annotation: N/A; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.138,"smiles":null,"spectrum_id":"CCMSLIB00017261732","spectrum_index":26944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Bromo-1H-pyrrolo[3,2-c]pyridine (delta mass: 97.995 Da; putative annotation: N/A; putative formula: C3H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.966,"smiles":null,"spectrum_id":"CCMSLIB00017261735","spectrum_index":26945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.221,"smiles":null,"spectrum_id":"CCMSLIB00017261738","spectrum_index":26946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 437.1325 Da; putative annotation: N/A; putative formula: C23H24N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.203,"smiles":null,"spectrum_id":"CCMSLIB00017261740","spectrum_index":26947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 101.0481 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.129,"smiles":null,"spectrum_id":"CCMSLIB00017261742","spectrum_index":26948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 355.2916 Da; putative annotation: N/A; putative formula: C21H41NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.37,"smiles":null,"spectrum_id":"CCMSLIB00017261745","spectrum_index":26949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S-Carboxymethyl-L-cysteine CollisionEnergy:102040 (delta mass: 137.0475 Da; putative annotation: N/A; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.08,"smiles":null,"spectrum_id":"CCMSLIB00017261747","spectrum_index":26950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 467.1648 Da; putative annotation: N/A; putative formula: C19H33NO8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.225,"smiles":null,"spectrum_id":"CCMSLIB00017261750","spectrum_index":26951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 55.0421 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.102,"smiles":null,"spectrum_id":"CCMSLIB00017261752","spectrum_index":26952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 137.0918 Da; putative annotation: N/A; putative formula: C7H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.173,"smiles":null,"spectrum_id":"CCMSLIB00017261755","spectrum_index":26953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 53.0484 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.129,"smiles":null,"spectrum_id":"CCMSLIB00017261757","spectrum_index":26954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 366.0995 Da; putative annotation: N/A; putative formula: C17H15N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.233,"smiles":null,"spectrum_id":"CCMSLIB00017261760","spectrum_index":26955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 47.0276 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.106,"smiles":null,"spectrum_id":"CCMSLIB00017261762","spectrum_index":26956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 157.0828 Da; putative annotation: N/A; putative formula: C2H7N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.18,"smiles":null,"spectrum_id":"CCMSLIB00017261764","spectrum_index":26957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 324.1056 Da; putative annotation: N/A; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.229,"smiles":null,"spectrum_id":"CCMSLIB00017261767","spectrum_index":26958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxy-2,2,6,6-tetramethyl-4-[2-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]propyl]cyclohex-4-ene-1,3-dione (delta mass: 260.1283 Da; putative annotation: N/A; putative formula: C13H26O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.35,"smiles":null,"spectrum_id":"CCMSLIB00017261770","spectrum_index":26959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 128.0835 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.144,"smiles":null,"spectrum_id":"CCMSLIB00017261772","spectrum_index":26960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 84.0564 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.116,"smiles":null,"spectrum_id":"CCMSLIB00017261774","spectrum_index":26961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 108.021 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.076,"smiles":null,"spectrum_id":"CCMSLIB00017261777","spectrum_index":26962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 523.3715 Da; putative annotation: N/A; putative formula: C26H53NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.432,"smiles":null,"spectrum_id":"CCMSLIB00017261778","spectrum_index":26963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 781.3928 Da; putative annotation: N/A; putative formula: C39H56N7O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.453,"smiles":null,"spectrum_id":"CCMSLIB00017261781","spectrum_index":26964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 507.139 Da; putative annotation: N/A; putative formula: C24H21N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.199,"smiles":null,"spectrum_id":"CCMSLIB00017261784","spectrum_index":26965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 262.1205 Da; putative annotation: N/A; putative formula: C15H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.191,"smiles":null,"spectrum_id":"CCMSLIB00017261786","spectrum_index":26966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 96.032 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.092,"smiles":null,"spectrum_id":"CCMSLIB00017261788","spectrum_index":26967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 299.2824 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.353,"smiles":null,"spectrum_id":"CCMSLIB00017261791","spectrum_index":26968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1222.0641 Da; putative annotation: N/A; putative formula: C54H34N10O13S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1444.16,"smiles":null,"spectrum_id":"CCMSLIB00017261793","spectrum_index":26969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 55.0843 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.165,"smiles":null,"spectrum_id":"CCMSLIB00017261795","spectrum_index":26970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 197.5088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.6,"smiles":null,"spectrum_id":"CCMSLIB00017261798","spectrum_index":26971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 28.5134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.548,"smiles":null,"spectrum_id":"CCMSLIB00017261801","spectrum_index":26972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 50.0633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.222,"smiles":null,"spectrum_id":"CCMSLIB00017261802","spectrum_index":26973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 82.0416 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017261805","spectrum_index":26974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 353.2449 Da; putative annotation: N/A; putative formula: C18H27N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.393,"smiles":null,"spectrum_id":"CCMSLIB00017261808","spectrum_index":26975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Omeprazole sulfide (delta mass: 296.2353 Da; putative annotation: N/A; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.362,"smiles":null,"spectrum_id":"CCMSLIB00017261809","spectrum_index":26976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 101.1213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.265,"smiles":null,"spectrum_id":"CCMSLIB00017261812","spectrum_index":26977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 354.3861 Da; putative annotation: N/A; putative formula: C20H46N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.425,"smiles":null,"spectrum_id":"CCMSLIB00017261815","spectrum_index":26978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 182.1035 Da; putative annotation: N/A; putative formula: C5H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.263,"smiles":null,"spectrum_id":"CCMSLIB00017261816","spectrum_index":26979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 160.0372 Da; putative annotation: N/A; putative formula: C6H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.097,"smiles":null,"spectrum_id":"CCMSLIB00017261819","spectrum_index":26980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 212.1868 Da; putative annotation: N/A; putative formula: C8H20N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.221,"smiles":null,"spectrum_id":"CCMSLIB00017261821","spectrum_index":26981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 318.2685 Da; putative annotation: N/A; putative formula: C20H34N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.46,"smiles":null,"spectrum_id":"CCMSLIB00017261823","spectrum_index":26982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 26.0616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.142,"smiles":null,"spectrum_id":"CCMSLIB00017261826","spectrum_index":26983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 213.0845 Da; putative annotation: N/A; putative formula: C9H16N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.181,"smiles":null,"spectrum_id":"CCMSLIB00017261828","spectrum_index":26984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 423.2134 Da; putative annotation: N/A; putative formula: C17H34N3O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.31,"smiles":null,"spectrum_id":"CCMSLIB00017261830","spectrum_index":26985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 346.1863 Da; putative annotation: N/A; putative formula: C15H22N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.263,"smiles":null,"spectrum_id":"CCMSLIB00017261833","spectrum_index":26986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.124,"smiles":null,"spectrum_id":"CCMSLIB00017261836","spectrum_index":26987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin D (delta mass: 240.1922 Da; putative annotation: N/A; putative formula: C8H20N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.378,"smiles":null,"spectrum_id":"CCMSLIB00017261838","spectrum_index":26988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 162.0846 Da; putative annotation: N/A; putative formula: C6H16N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.275,"smiles":null,"spectrum_id":"CCMSLIB00017261840","spectrum_index":26989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 150.0877 Da; putative annotation: N/A; putative formula: C10H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.19,"smiles":null,"spectrum_id":"CCMSLIB00017261843","spectrum_index":26990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-Pro (delta mass: 43.0055 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.139,"smiles":null,"spectrum_id":"CCMSLIB00017261846","spectrum_index":26991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 209.0999 Da; putative annotation: N/A; putative formula: C3H7N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.141,"smiles":null,"spectrum_id":"CCMSLIB00017261847","spectrum_index":26992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 164.0462 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.128,"smiles":null,"spectrum_id":"CCMSLIB00017261850","spectrum_index":26993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 321.1423 Da; putative annotation: N/A; putative formula: C13H23NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.223,"smiles":null,"spectrum_id":"CCMSLIB00017261852","spectrum_index":26994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-O-Methylinosine; AIF; CE0; MS2Dec (delta mass: 160.0773 Da; putative annotation: N/A; putative formula: C6H13N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.181,"smiles":null,"spectrum_id":"CCMSLIB00017261854","spectrum_index":26995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 39.0116 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017261857","spectrum_index":26996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 256.2401 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.316,"smiles":null,"spectrum_id":"CCMSLIB00017261860","spectrum_index":26997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 54.0087 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.095,"smiles":null,"spectrum_id":"CCMSLIB00017261862","spectrum_index":26998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 301.2221 Da; putative annotation: N/A; putative formula: C12H27N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.371,"smiles":null,"spectrum_id":"CCMSLIB00017261864","spectrum_index":26999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 24.0722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.294,"smiles":null,"spectrum_id":"CCMSLIB00017261866","spectrum_index":27000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 329.1118 Da; putative annotation: N/A; putative formula: C15H23NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.182,"smiles":null,"spectrum_id":"CCMSLIB00017261869","spectrum_index":27001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 77.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.171,"smiles":null,"spectrum_id":"CCMSLIB00017261872","spectrum_index":27002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 347.1229 Da; putative annotation: N/A; putative formula: C15H17N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.236,"smiles":null,"spectrum_id":"CCMSLIB00017261873","spectrum_index":27003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 368.1843 Da; putative annotation: N/A; putative formula: C20H32O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.271,"smiles":null,"spectrum_id":"CCMSLIB00017261876","spectrum_index":27004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 392.111 Da; putative annotation: N/A; putative formula: C14H17N8O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.15,"smiles":null,"spectrum_id":"CCMSLIB00017261879","spectrum_index":27005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 243.1473 Da; putative annotation: N/A; putative formula: C12H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.223,"smiles":null,"spectrum_id":"CCMSLIB00017261880","spectrum_index":27006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 96.0364 Da; putative annotation: N/A; putative formula: C9H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.096,"smiles":null,"spectrum_id":"CCMSLIB00017261883","spectrum_index":27007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 41.0227 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.192,"smiles":null,"spectrum_id":"CCMSLIB00017261885","spectrum_index":27008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminohexanoic acid (delta mass: 42.0295 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.131,"smiles":null,"spectrum_id":"CCMSLIB00017261887","spectrum_index":27009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S)-4-Amino-5-hydroxypentanoic acid (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017261890","spectrum_index":27010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 74.0543 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.13,"smiles":null,"spectrum_id":"CCMSLIB00017261891","spectrum_index":27011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 74.0521 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.107,"smiles":null,"spectrum_id":"CCMSLIB00017261894","spectrum_index":27012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 825.4546 Da; putative annotation: N/A; putative formula: C39H71NO15S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1006.53,"smiles":null,"spectrum_id":"CCMSLIB00017261897","spectrum_index":27013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 378.1705 Da; putative annotation: N/A; putative formula: C22H18N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.236,"smiles":null,"spectrum_id":"CCMSLIB00017261899","spectrum_index":27014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 40.0642 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017261901","spectrum_index":27015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 365.1061 Da; putative annotation: N/A; putative formula: C14H24NO6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.24,"smiles":null,"spectrum_id":"CCMSLIB00017261904","spectrum_index":27016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 54.0465 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.222,"smiles":null,"spectrum_id":"CCMSLIB00017261907","spectrum_index":27017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]- (delta mass: 15.0712 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.264,"smiles":null,"spectrum_id":"CCMSLIB00017261909","spectrum_index":27018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 172.1105 Da; putative annotation: N/A; putative formula: C9H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.208,"smiles":null,"spectrum_id":"CCMSLIB00017261911","spectrum_index":27019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 487.3138 Da; putative annotation: N/A; putative formula: C30H41N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.385,"smiles":null,"spectrum_id":"CCMSLIB00017261914","spectrum_index":27020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 310.0793 Da; putative annotation: N/A; putative formula: C15H19O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.15,"smiles":null,"spectrum_id":"CCMSLIB00017261916","spectrum_index":27021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 55.0057 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.086,"smiles":null,"spectrum_id":"CCMSLIB00017261918","spectrum_index":27022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 64.0149 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.117,"smiles":null,"spectrum_id":"CCMSLIB00017261921","spectrum_index":27023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]- (delta mass: 66.0816 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.274,"smiles":null,"spectrum_id":"CCMSLIB00017261924","spectrum_index":27024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 100.0778 Da; putative annotation: N/A; putative formula: C6H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017261926","spectrum_index":27025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 977.342 Da; putative annotation: N/A; putative formula: C53H51N7O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1644.57,"smiles":null,"spectrum_id":"CCMSLIB00017261928","spectrum_index":27026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 869.636 Da; putative annotation: N/A; putative formula: C56H87NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1536.87,"smiles":null,"spectrum_id":"CCMSLIB00017261931","spectrum_index":27027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 959.2117 Da; putative annotation: N/A; putative formula: C52H41N5O8S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1251.31,"smiles":null,"spectrum_id":"CCMSLIB00017261934","spectrum_index":27028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 542.182 Da; putative annotation: N/A; putative formula: C25H34O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.242,"smiles":null,"spectrum_id":"CCMSLIB00017261935","spectrum_index":27029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 72.0209 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.081,"smiles":null,"spectrum_id":"CCMSLIB00017261938","spectrum_index":27030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 27.9991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.127,"smiles":null,"spectrum_id":"CCMSLIB00017261941","spectrum_index":27031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 83.0735 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.134,"smiles":null,"spectrum_id":"CCMSLIB00017261942","spectrum_index":27032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 142.0992 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.279,"smiles":null,"spectrum_id":"CCMSLIB00017261945","spectrum_index":27033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 55.0786 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.133,"smiles":null,"spectrum_id":"CCMSLIB00017261948","spectrum_index":27034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 477.3305 Da; putative annotation: N/A; putative formula: C27H48N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.367,"smiles":null,"spectrum_id":"CCMSLIB00017261950","spectrum_index":27035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imazaquin (delta mass: 311.1472 Da; putative annotation: N/A; putative formula: C16H26NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.281,"smiles":null,"spectrum_id":"CCMSLIB00017261952","spectrum_index":27036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 345.0872 Da; putative annotation: N/A; putative formula: C19H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.158,"smiles":null,"spectrum_id":"CCMSLIB00017261955","spectrum_index":27037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 78.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017261957","spectrum_index":27038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dehydro-16-epi-vincamine (delta mass: 352.179 Da; putative annotation: N/A; putative formula: C21H24N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.365,"smiles":null,"spectrum_id":"CCMSLIB00017261959","spectrum_index":27039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 45.0433 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.218,"smiles":null,"spectrum_id":"CCMSLIB00017261962","spectrum_index":27040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yohimbic acid (delta mass: 18.1287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.315,"smiles":null,"spectrum_id":"CCMSLIB00017261964","spectrum_index":27041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 122.5176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.557,"smiles":null,"spectrum_id":"CCMSLIB00017261966","spectrum_index":27042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.102,"smiles":null,"spectrum_id":"CCMSLIB00017261969","spectrum_index":27043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 264.0941 Da; putative annotation: N/A; putative formula: C21H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.181,"smiles":null,"spectrum_id":"CCMSLIB00017261971","spectrum_index":27044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 70.0436 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.318,"smiles":null,"spectrum_id":"CCMSLIB00017261973","spectrum_index":27045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maclurin (delta mass: 122.0569 Da; putative annotation: N/A; putative formula: C8H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.112,"smiles":null,"spectrum_id":"CCMSLIB00017261976","spectrum_index":27046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 312.2083 Da; putative annotation: N/A; putative formula: C21H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.332,"smiles":null,"spectrum_id":"CCMSLIB00017261978","spectrum_index":27047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 1036.8315 Da; putative annotation: N/A; putative formula: C65H112O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1346.94,"smiles":null,"spectrum_id":"CCMSLIB00017261980","spectrum_index":27048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 243.1474 Da; putative annotation: N/A; putative formula: C12H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.218,"smiles":null,"spectrum_id":"CCMSLIB00017261983","spectrum_index":27049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 127.0628 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.212,"smiles":null,"spectrum_id":"CCMSLIB00017261984","spectrum_index":27050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ332502 Epinephrine|4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol (delta mass: 22.9541 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.051,"smiles":null,"spectrum_id":"CCMSLIB00017261987","spectrum_index":27051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 46.0199 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017261990","spectrum_index":27052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 807.3841 Da; putative annotation: N/A; putative formula: C31H60N11O8P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1029.48,"smiles":null,"spectrum_id":"CCMSLIB00017261992","spectrum_index":27053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 278.0942 Da; putative annotation: N/A; putative formula: C18H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.259,"smiles":null,"spectrum_id":"CCMSLIB00017261994","spectrum_index":27054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 17.0327 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.115,"smiles":null,"spectrum_id":"CCMSLIB00017261997","spectrum_index":27055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 87.9252 Da; putative annotation: N/A; putative formula: CH-2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.006,"smiles":null,"spectrum_id":"CCMSLIB00017262000","spectrum_index":27056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 146.0691 Da; putative annotation: N/A; putative formula: C5H10N2O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.156,"smiles":null,"spectrum_id":"CCMSLIB00017262001","spectrum_index":27057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 607.3925 Da; putative annotation: N/A; putative formula: C43H49N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.453,"smiles":null,"spectrum_id":"CCMSLIB00017262004","spectrum_index":27058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 129.0639 Da; putative annotation: N/A; putative formula: C3H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.197,"smiles":null,"spectrum_id":"CCMSLIB00017262006","spectrum_index":27059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 154.099 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.222,"smiles":null,"spectrum_id":"CCMSLIB00017262008","spectrum_index":27060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 156.0194 Da; putative annotation: N/A; putative formula: C4H5N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.091,"smiles":null,"spectrum_id":"CCMSLIB00017262011","spectrum_index":27061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 45.9876 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.032,"smiles":null,"spectrum_id":"CCMSLIB00017262012","spectrum_index":27062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 366.3123 Da; putative annotation: N/A; putative formula: C23H42O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.388,"smiles":null,"spectrum_id":"CCMSLIB00017262015","spectrum_index":27063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 303.1336 Da; putative annotation: N/A; putative formula: C14H17N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.204,"smiles":null,"spectrum_id":"CCMSLIB00017262018","spectrum_index":27064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 108.0941 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.384,"smiles":null,"spectrum_id":"CCMSLIB00017262020","spectrum_index":27065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 40.9942 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.133,"smiles":null,"spectrum_id":"CCMSLIB00017262022","spectrum_index":27066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 142.0777 Da; putative annotation: N/A; putative formula: C5H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017262025","spectrum_index":27067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 20.0 eV (delta mass: 254.0222 Da; putative annotation: N/A; putative formula: C7H6N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.108,"smiles":null,"spectrum_id":"CCMSLIB00017262027","spectrum_index":27068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 199.1243 Da; putative annotation: N/A; putative formula: C9H18N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.294,"smiles":null,"spectrum_id":"CCMSLIB00017262030","spectrum_index":27069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 444.2572 Da; putative annotation: N/A; putative formula: C22H41N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.328,"smiles":null,"spectrum_id":"CCMSLIB00017262032","spectrum_index":27070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 160.9914 Da; putative annotation: N/A; putative formula: C4H-1N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.046,"smiles":null,"spectrum_id":"CCMSLIB00017262034","spectrum_index":27071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 78.0825 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.195,"smiles":null,"spectrum_id":"CCMSLIB00017262037","spectrum_index":27072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 114.0473 Da; putative annotation: N/A; putative formula: C9H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.102,"smiles":null,"spectrum_id":"CCMSLIB00017262039","spectrum_index":27073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 68.0708 Da; putative annotation: N/A; putative formula: C4H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.186,"smiles":null,"spectrum_id":"CCMSLIB00017262041","spectrum_index":27074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Leu (delta mass: 226.1689 Da; putative annotation: Leu-Leu; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.339,"smiles":null,"spectrum_id":"CCMSLIB00017262044","spectrum_index":27075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 176.0468 Da; putative annotation: 3-Hydroxy-4-methoxycinnamic acid; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.107,"smiles":null,"spectrum_id":"CCMSLIB00017262047","spectrum_index":27076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 169.0754 Da; putative annotation: Massbank:LU106301 6-Phenyl-1,3,5-triazine-2,4-diamine; putative formula: C9H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.188,"smiles":null,"spectrum_id":"CCMSLIB00017262049","spectrum_index":27077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 210.1256 Da; putative annotation: trans-Traumatic acid; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.186,"smiles":null,"spectrum_id":"CCMSLIB00017262051","spectrum_index":27078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 529.2241 Da; putative annotation: Massbank:EQ301602 Darunavir|N-[(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl(sulfanilyl)amino]propyl]carbamic acid [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ester; putative formula: C27H35N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.305,"smiles":null,"spectrum_id":"CCMSLIB00017262054","spectrum_index":27079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ozagrel (delta mass: 114.0417 Da; putative annotation: 3-Ureidopropionic acid; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.139,"smiles":null,"spectrum_id":"CCMSLIB00017262057","spectrum_index":27080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 284.0326 Da; putative annotation: Morin; putative formula: C15H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.093,"smiles":null,"spectrum_id":"CCMSLIB00017262060","spectrum_index":27081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 148.0734 Da; putative annotation: L-Fucitol; putative formula: C6H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.154,"smiles":null,"spectrum_id":"CCMSLIB00017262061","spectrum_index":27082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 222.1613 Da; putative annotation: Dicyclohexyl(hydroxy)acetic acid; putative formula: C14H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.259,"smiles":null,"spectrum_id":"CCMSLIB00017262064","spectrum_index":27083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 177.0794 Da; putative annotation: N-Hydroxy-3,4-methylenedioxyamphetamine; putative formula: C10H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.166,"smiles":null,"spectrum_id":"CCMSLIB00017262067","spectrum_index":27084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 148.056 Da; putative annotation: N/A; putative formula: C6H12O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.147,"smiles":null,"spectrum_id":"CCMSLIB00017262069","spectrum_index":27085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 314.099 Da; putative annotation: N/A; putative formula: C19H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.248,"smiles":null,"spectrum_id":"CCMSLIB00017262071","spectrum_index":27086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-1-(4-phenoxyphenyl)methanamine (delta mass: 151.0213 Da; putative annotation: N/A; putative formula: C4H10NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.144,"smiles":null,"spectrum_id":"CCMSLIB00017262074","spectrum_index":27087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 132.0158 Da; putative annotation: N/A; putative formula: C5H9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.149,"smiles":null,"spectrum_id":"CCMSLIB00017262077","spectrum_index":27088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 157.1315 Da; putative annotation: N/A; putative formula: C6H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.212,"smiles":null,"spectrum_id":"CCMSLIB00017262079","spectrum_index":27089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 118.0629 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.159,"smiles":null,"spectrum_id":"CCMSLIB00017262081","spectrum_index":27090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 69.0042 Da; putative annotation: N/A; putative formula: C3H3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.112,"smiles":null,"spectrum_id":"CCMSLIB00017262084","spectrum_index":27091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 779.4447 Da; putative annotation: N/A; putative formula: C35H66N5O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.515,"smiles":null,"spectrum_id":"CCMSLIB00017262086","spectrum_index":27092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 557.2323 Da; putative annotation: N/A; putative formula: C36H35N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.366,"smiles":null,"spectrum_id":"CCMSLIB00017262088","spectrum_index":27093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-3-yl)propanenitrile (delta mass: 62.001 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.093,"smiles":null,"spectrum_id":"CCMSLIB00017262091","spectrum_index":27094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 99.0386 Da; putative annotation: N/A; putative formula: C3H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.172,"smiles":null,"spectrum_id":"CCMSLIB00017262094","spectrum_index":27095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paxilline (delta mass: 50.0451 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.293,"smiles":null,"spectrum_id":"CCMSLIB00017262095","spectrum_index":27096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 130.0243 Da; putative annotation: N/A; putative formula: C9H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.067,"smiles":null,"spectrum_id":"CCMSLIB00017262098","spectrum_index":27097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 359.1428 Da; putative annotation: N/A; putative formula: C12H25NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.239,"smiles":null,"spectrum_id":"CCMSLIB00017262100","spectrum_index":27098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Difluoro-1H-indole-2-carboxylic acid (delta mass: 14.0192 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.055,"smiles":null,"spectrum_id":"CCMSLIB00017262102","spectrum_index":27099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 421.116 Da; putative annotation: N/A; putative formula: C23H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.197,"smiles":null,"spectrum_id":"CCMSLIB00017262105","spectrum_index":27100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 104.0344 Da; putative annotation: N/A; putative formula: CH4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.132,"smiles":null,"spectrum_id":"CCMSLIB00017262107","spectrum_index":27101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.06,"smiles":null,"spectrum_id":"CCMSLIB00017262109","spectrum_index":27102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 60.0315 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.048,"smiles":null,"spectrum_id":"CCMSLIB00017262112","spectrum_index":27103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 32.1367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.218,"smiles":null,"spectrum_id":"CCMSLIB00017262115","spectrum_index":27104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 54.0289 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.072,"smiles":null,"spectrum_id":"CCMSLIB00017262118","spectrum_index":27105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 584.1816 Da; putative annotation: N/A; putative formula: C34H28N6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.252,"smiles":null,"spectrum_id":"CCMSLIB00017262120","spectrum_index":27106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-carbinol CollisionEnergy:205060 (delta mass: 197.9499 Da; putative annotation: N/A; putative formula: C5H2N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.026,"smiles":null,"spectrum_id":"CCMSLIB00017262122","spectrum_index":27107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 71.98 Da; putative annotation: N/A; putative formula: CN2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017262125","spectrum_index":27108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 44.9253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.99,"smiles":null,"spectrum_id":"CCMSLIB00017262127","spectrum_index":27109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 68.048 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.217,"smiles":null,"spectrum_id":"CCMSLIB00017262130","spectrum_index":27110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 90.0096 Da; putative annotation: N/A; putative formula: H3N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.08,"smiles":null,"spectrum_id":"CCMSLIB00017262132","spectrum_index":27111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 565.3841 Da; putative annotation: N/A; putative formula: C29H51N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.455,"smiles":null,"spectrum_id":"CCMSLIB00017262135","spectrum_index":27112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 436.1712 Da; putative annotation: N/A; putative formula: C20H31N4OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.231,"smiles":null,"spectrum_id":"CCMSLIB00017262137","spectrum_index":27113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 130.0156 Da; putative annotation: N/A; putative formula: CH3N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.154,"smiles":null,"spectrum_id":"CCMSLIB00017262139","spectrum_index":27114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 760.4402 Da; putative annotation: N/A; putative formula: C48H56N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.5,"smiles":null,"spectrum_id":"CCMSLIB00017262142","spectrum_index":27115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 38.0155 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017262145","spectrum_index":27116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Crotonoside (delta mass: 50.0298 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.129,"smiles":null,"spectrum_id":"CCMSLIB00017262146","spectrum_index":27117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 134.0614 Da; putative annotation: N/A; putative formula: C4H11N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.164,"smiles":null,"spectrum_id":"CCMSLIB00017262149","spectrum_index":27118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dexmedetomidine (delta mass: 80.0725 Da; putative annotation: N/A; putative formula: C5H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.211,"smiles":null,"spectrum_id":"CCMSLIB00017262152","spectrum_index":27119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000859935-01!beta;-Carboline-3-carboxylic acid N-methylamide (delta mass: 58.0055 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.103,"smiles":null,"spectrum_id":"CCMSLIB00017262155","spectrum_index":27120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 189.0633 Da; putative annotation: N/A; putative formula: C7H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.139,"smiles":null,"spectrum_id":"CCMSLIB00017262156","spectrum_index":27121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thiamine thiozole (delta mass: 167.0552 Da; putative annotation: N/A; putative formula: C4H5N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.103,"smiles":null,"spectrum_id":"CCMSLIB00017262159","spectrum_index":27122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 96.057 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.232,"smiles":null,"spectrum_id":"CCMSLIB00017262162","spectrum_index":27123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 778.4486 Da; putative annotation: N/A; putative formula: C42H66O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":959.519,"smiles":null,"spectrum_id":"CCMSLIB00017262163","spectrum_index":27124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 543.4346 Da; putative annotation: N/A; putative formula: C38H58NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.604,"smiles":null,"spectrum_id":"CCMSLIB00017262166","spectrum_index":27125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 101.047 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.15,"smiles":null,"spectrum_id":"CCMSLIB00017262169","spectrum_index":27126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 63.0709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.159,"smiles":null,"spectrum_id":"CCMSLIB00017262170","spectrum_index":27127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 74.0612 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.356,"smiles":null,"spectrum_id":"CCMSLIB00017262173","spectrum_index":27128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 84.0234 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.095,"smiles":null,"spectrum_id":"CCMSLIB00017262176","spectrum_index":27129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 99.068 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.191,"smiles":null,"spectrum_id":"CCMSLIB00017262177","spectrum_index":27130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 129.5487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.62,"smiles":null,"spectrum_id":"CCMSLIB00017262180","spectrum_index":27131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 213.961 Da; putative annotation: N/A; putative formula: C4H-2N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.0,"smiles":null,"spectrum_id":"CCMSLIB00017262181","spectrum_index":27132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 421.1974 Da; putative annotation: N/A; putative formula: C20H23N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.294,"smiles":null,"spectrum_id":"CCMSLIB00017262184","spectrum_index":27133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 62.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.097,"smiles":null,"spectrum_id":"CCMSLIB00017262187","spectrum_index":27134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 102.0686 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.17,"smiles":null,"spectrum_id":"CCMSLIB00017262190","spectrum_index":27135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 134.0933 Da; putative annotation: N/A; putative formula: C2H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.127,"smiles":null,"spectrum_id":"CCMSLIB00017262191","spectrum_index":27136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 30.1298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.263,"smiles":null,"spectrum_id":"CCMSLIB00017262194","spectrum_index":27137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 196.0494 Da; putative annotation: N/A; putative formula: C9H12N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.136,"smiles":null,"spectrum_id":"CCMSLIB00017262197","spectrum_index":27138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017262198","spectrum_index":27139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 179.0794 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.176,"smiles":null,"spectrum_id":"CCMSLIB00017262201","spectrum_index":27140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 10.0212 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.097,"smiles":null,"spectrum_id":"CCMSLIB00017262203","spectrum_index":27141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 24.9669 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.027,"smiles":null,"spectrum_id":"CCMSLIB00017262206","spectrum_index":27142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 67.0424 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017262208","spectrum_index":27143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 31.0081 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.096,"smiles":null,"spectrum_id":"CCMSLIB00017262211","spectrum_index":27144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 135.1186 Da; putative annotation: N/A; putative formula: C8H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.183,"smiles":null,"spectrum_id":"CCMSLIB00017262213","spectrum_index":27145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 23.9919 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.047,"smiles":null,"spectrum_id":"CCMSLIB00017262216","spectrum_index":27146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE (delta mass: 66.0614 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.148,"smiles":null,"spectrum_id":"CCMSLIB00017262218","spectrum_index":27147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 25.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.149,"smiles":null,"spectrum_id":"CCMSLIB00017262221","spectrum_index":27148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 113.0839 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.149,"smiles":null,"spectrum_id":"CCMSLIB00017262224","spectrum_index":27149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 48.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.101,"smiles":null,"spectrum_id":"CCMSLIB00017262226","spectrum_index":27150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 59.0733 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.139,"smiles":null,"spectrum_id":"CCMSLIB00017262228","spectrum_index":27151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 129.0425 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.113,"smiles":null,"spectrum_id":"CCMSLIB00017262231","spectrum_index":27152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 27.9971 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.06,"smiles":null,"spectrum_id":"CCMSLIB00017262234","spectrum_index":27153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 30.0 eV (delta mass: 147.0532 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.129,"smiles":null,"spectrum_id":"CCMSLIB00017262237","spectrum_index":27154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 28.9321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.967,"smiles":null,"spectrum_id":"CCMSLIB00017262238","spectrum_index":27155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 87.0316 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.123,"smiles":null,"spectrum_id":"CCMSLIB00017262241","spectrum_index":27156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 228.111 Da; putative annotation: N/A; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.308,"smiles":null,"spectrum_id":"CCMSLIB00017262244","spectrum_index":27157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 62.0565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.18,"smiles":null,"spectrum_id":"CCMSLIB00017262246","spectrum_index":27158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 32.0239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.199,"smiles":null,"spectrum_id":"CCMSLIB00017262248","spectrum_index":27159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 345.1786 Da; putative annotation: N/A; putative formula: C19H24FN3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.249,"smiles":null,"spectrum_id":"CCMSLIB00017262251","spectrum_index":27160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 354.1227 Da; putative annotation: N/A; putative formula: C20H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.219,"smiles":null,"spectrum_id":"CCMSLIB00017262252","spectrum_index":27161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amorfrutin 2 (delta mass: 73.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.28,"smiles":null,"spectrum_id":"CCMSLIB00017262255","spectrum_index":27162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 274.117 Da; putative annotation: N/A; putative formula: C13H25P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.188,"smiles":null,"spectrum_id":"CCMSLIB00017262258","spectrum_index":27163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 792.4476 Da; putative annotation: N/A; putative formula: C56H60N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.518,"smiles":null,"spectrum_id":"CCMSLIB00017262259","spectrum_index":27164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine; LC-tDDA; CE10 (delta mass: 36.0766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.172,"smiles":null,"spectrum_id":"CCMSLIB00017262262","spectrum_index":27165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002983 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 18.0842 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.123,"smiles":null,"spectrum_id":"CCMSLIB00017262265","spectrum_index":27166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 176.0318 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.201,"smiles":null,"spectrum_id":"CCMSLIB00017262267","spectrum_index":27167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 38.0825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.159,"smiles":null,"spectrum_id":"CCMSLIB00017262269","spectrum_index":27168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 51.0473 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017262272","spectrum_index":27169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 9.9845 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.04,"smiles":null,"spectrum_id":"CCMSLIB00017262274","spectrum_index":27170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 109.0352 Da; putative annotation: N/A; putative formula: C6H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.126,"smiles":null,"spectrum_id":"CCMSLIB00017262276","spectrum_index":27171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 218.2397 Da; putative annotation: N/A; putative formula: C17H30O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.306,"smiles":null,"spectrum_id":"CCMSLIB00017262279","spectrum_index":27172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 60.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.16,"smiles":null,"spectrum_id":"CCMSLIB00017262281","spectrum_index":27173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 386.2276 Da; putative annotation: N/A; putative formula: C26H31N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.303,"smiles":null,"spectrum_id":"CCMSLIB00017262283","spectrum_index":27174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 72.0362 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.101,"smiles":null,"spectrum_id":"CCMSLIB00017262286","spectrum_index":27175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norisoboldine (delta mass: 126.0892 Da; putative annotation: N/A; putative formula: C5H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.228,"smiles":null,"spectrum_id":"CCMSLIB00017262289","spectrum_index":27176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 35.0122 Da; putative annotation: N/A; putative formula: C3HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.11,"smiles":null,"spectrum_id":"CCMSLIB00017262291","spectrum_index":27177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 86.0338 Da; putative annotation: N/A; putative formula: H2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.1,"smiles":null,"spectrum_id":"CCMSLIB00017262293","spectrum_index":27178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 23.9487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.04,"smiles":null,"spectrum_id":"CCMSLIB00017262296","spectrum_index":27179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:KO009109 Glucose_6-phosphate|Glucose 6-phosphate|D-Glucose 6-phosphate|Robison ester (delta mass: 574.1208 Da; putative annotation: N/A; putative formula: C34H26N2OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":835.158,"smiles":null,"spectrum_id":"CCMSLIB00017262299","spectrum_index":27180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 81.0428 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.124,"smiles":null,"spectrum_id":"CCMSLIB00017262302","spectrum_index":27181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 482.2616 Da; putative annotation: N/A; putative formula: C29H34N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1091.53,"smiles":null,"spectrum_id":"CCMSLIB00017262303","spectrum_index":27182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 120.065 Da; putative annotation: N/A; putative formula: C2H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.113,"smiles":null,"spectrum_id":"CCMSLIB00017262306","spectrum_index":27183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 65.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.164,"smiles":null,"spectrum_id":"CCMSLIB00017262308","spectrum_index":27184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 444.3447 Da; putative annotation: N/A; putative formula: C25H48O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.384,"smiles":null,"spectrum_id":"CCMSLIB00017262310","spectrum_index":27185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 156.1035 Da; putative annotation: N/A; putative formula: C11H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.274,"smiles":null,"spectrum_id":"CCMSLIB00017262313","spectrum_index":27186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 345.7243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.795,"smiles":null,"spectrum_id":"CCMSLIB00017262315","spectrum_index":27187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 100.0342 Da; putative annotation: N/A; putative formula: C5H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.094,"smiles":null,"spectrum_id":"CCMSLIB00017262317","spectrum_index":27188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 893.4897 Da; putative annotation: N/A; putative formula: C46H67N7O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1206.63,"smiles":null,"spectrum_id":"CCMSLIB00017262319","spectrum_index":27189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophol (delta mass: 115.0629 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.154,"smiles":null,"spectrum_id":"CCMSLIB00017262322","spectrum_index":27190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 131.0207 Da; putative annotation: N/A; putative formula: C4H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.048,"smiles":null,"spectrum_id":"CCMSLIB00017262324","spectrum_index":27191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 70.9904 Da; putative annotation: N/A; putative formula: C2H2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.061,"smiles":null,"spectrum_id":"CCMSLIB00017262326","spectrum_index":27192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 148.1096 Da; putative annotation: N/A; putative formula: C8H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.201,"smiles":null,"spectrum_id":"CCMSLIB00017262329","spectrum_index":27193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 63.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.212,"smiles":null,"spectrum_id":"CCMSLIB00017262330","spectrum_index":27194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 737.5161 Da; putative annotation: N/A; putative formula: C36H67N9O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1047.63,"smiles":null,"spectrum_id":"CCMSLIB00017262333","spectrum_index":27195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 870.3282 Da; putative annotation: N/A; putative formula: C46H42N14O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1180.44,"smiles":null,"spectrum_id":"CCMSLIB00017262336","spectrum_index":27196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 450.0568 Da; putative annotation: N/A; putative formula: C19H20N2O5P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.128,"smiles":null,"spectrum_id":"CCMSLIB00017262338","spectrum_index":27197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 347.2674 Da; putative annotation: N/A; putative formula: C18H37NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.338,"smiles":null,"spectrum_id":"CCMSLIB00017262340","spectrum_index":27198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 104.0611 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.142,"smiles":null,"spectrum_id":"CCMSLIB00017262342","spectrum_index":27199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7,8-Tetramethyl-2-(.beta.-carboxyethyl)-6-hydroxychroman (delta mass: 214.0995 Da; putative annotation: N/A; putative formula: C14H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.259,"smiles":null,"spectrum_id":"CCMSLIB00017262345","spectrum_index":27200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 14.0388 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.146,"smiles":null,"spectrum_id":"CCMSLIB00017262348","spectrum_index":27201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 32.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.118,"smiles":null,"spectrum_id":"CCMSLIB00017262349","spectrum_index":27202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(2-Nitrophenyl)-1,3-propanediamine (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.119,"smiles":null,"spectrum_id":"CCMSLIB00017262352","spectrum_index":27203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 249.1268 Da; putative annotation: N/A; putative formula: C16H15N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.296,"smiles":null,"spectrum_id":"CCMSLIB00017262355","spectrum_index":27204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 379.1942 Da; putative annotation: N/A; putative formula: C19H31N3OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.344,"smiles":null,"spectrum_id":"CCMSLIB00017262357","spectrum_index":27205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 612.4479 Da; putative annotation: N/A; putative formula: C41H60N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.529,"smiles":null,"spectrum_id":"CCMSLIB00017262359","spectrum_index":27206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 321.1325 Da; putative annotation: N/A; putative formula: C15H19N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.219,"smiles":null,"spectrum_id":"CCMSLIB00017262362","spectrum_index":27207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 43.0403 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.1,"smiles":null,"spectrum_id":"CCMSLIB00017262365","spectrum_index":27208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-n-benzoyl-2-hydroxy-2-phenylethylamine (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017262366","spectrum_index":27209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 128.0609 Da; putative annotation: N/A; putative formula: C4H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.237,"smiles":null,"spectrum_id":"CCMSLIB00017262369","spectrum_index":27210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 194.0696 Da; putative annotation: N/A; putative formula: C2H10N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.156,"smiles":null,"spectrum_id":"CCMSLIB00017262371","spectrum_index":27211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 36.0716 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.152,"smiles":null,"spectrum_id":"CCMSLIB00017262373","spectrum_index":27212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 179.0797 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.187,"smiles":null,"spectrum_id":"CCMSLIB00017262376","spectrum_index":27213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 143.0347 Da; putative annotation: N/A; putative formula: C5HN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.115,"smiles":null,"spectrum_id":"CCMSLIB00017262377","spectrum_index":27214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 315.2783 Da; putative annotation: N/A; putative formula: C19H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.584,"smiles":null,"spectrum_id":"CCMSLIB00017262380","spectrum_index":27215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 126.9967 Da; putative annotation: N/A; putative formula: C2HN5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.083,"smiles":null,"spectrum_id":"CCMSLIB00017262381","spectrum_index":27216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 106.0416 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.154,"smiles":null,"spectrum_id":"CCMSLIB00017262384","spectrum_index":27217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apabetalone (delta mass: 41.0337 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.194,"smiles":null,"spectrum_id":"CCMSLIB00017262387","spectrum_index":27218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 73.0026 Da; putative annotation: N/A; putative formula: C4H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.057,"smiles":null,"spectrum_id":"CCMSLIB00017262388","spectrum_index":27219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[[3-[(2S)-2-Amino-2-carboxyethyl]-2,6-diketo-pyrimidin-1-yl]methyl]benzoic acid (delta mass: 136.068 Da; putative annotation: N/A; putative formula: C12H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.171,"smiles":null,"spectrum_id":"CCMSLIB00017262391","spectrum_index":27220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 77.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.138,"smiles":null,"spectrum_id":"CCMSLIB00017262394","spectrum_index":27221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 56.0388 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.167,"smiles":null,"spectrum_id":"CCMSLIB00017262396","spectrum_index":27222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 585.4099 Da; putative annotation: N/A; putative formula: C39H56NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.47,"smiles":null,"spectrum_id":"CCMSLIB00017262398","spectrum_index":27223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 163.0634 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.166,"smiles":null,"spectrum_id":"CCMSLIB00017262401","spectrum_index":27224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 767.4824 Da; putative annotation: N/A; putative formula: C41H69NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.542,"smiles":null,"spectrum_id":"CCMSLIB00017262404","spectrum_index":27225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 162.0427 Da; putative annotation: N/A; putative formula: C8H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.103,"smiles":null,"spectrum_id":"CCMSLIB00017262405","spectrum_index":27226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 61.0152 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.096,"smiles":null,"spectrum_id":"CCMSLIB00017262408","spectrum_index":27227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 438.3497 Da; putative annotation: N/A; putative formula: C30H46O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.398,"smiles":null,"spectrum_id":"CCMSLIB00017262410","spectrum_index":27228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Didodecyl 3,3'-thiodipropionate oxide from NIST14 - Hydroxylated variant ? (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.434,"smiles":null,"spectrum_id":"CCMSLIB00017262412","spectrum_index":27229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 32.9311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.991,"smiles":null,"spectrum_id":"CCMSLIB00017262415","spectrum_index":27230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 252.1152 Da; putative annotation: N/A; putative formula: C17H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.191,"smiles":null,"spectrum_id":"CCMSLIB00017262418","spectrum_index":27231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 91.9848 Da; putative annotation: N/A; putative formula: C2H5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.045,"smiles":null,"spectrum_id":"CCMSLIB00017262419","spectrum_index":27232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 57.0326 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.099,"smiles":null,"spectrum_id":"CCMSLIB00017262422","spectrum_index":27233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 48.07 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.135,"smiles":null,"spectrum_id":"CCMSLIB00017262423","spectrum_index":27234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 311.0299 Da; putative annotation: N/A; putative formula: C14H9N5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.09,"smiles":null,"spectrum_id":"CCMSLIB00017262426","spectrum_index":27235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 64.0052 Da; putative annotation: N/A; putative formula: C3N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.133,"smiles":null,"spectrum_id":"CCMSLIB00017262429","spectrum_index":27236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 17.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.149,"smiles":null,"spectrum_id":"CCMSLIB00017262432","spectrum_index":27237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 545.1947 Da; putative annotation: N/A; putative formula: C25H31N5O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.255,"smiles":null,"spectrum_id":"CCMSLIB00017262433","spectrum_index":27238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 40.0313 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.123,"smiles":null,"spectrum_id":"CCMSLIB00017262436","spectrum_index":27239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 113.0851 Da; putative annotation: Massbank:PB000396 Isoleucine|2-amino-3-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.219,"smiles":null,"spectrum_id":"CCMSLIB00017262439","spectrum_index":27240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 153.1147 Da; putative annotation: Gabapentin; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.196,"smiles":null,"spectrum_id":"CCMSLIB00017262440","spectrum_index":27241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Lys (delta mass: 128.0943 Da; putative annotation: Massbank:RP001101 L-Lysine; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.25,"smiles":null,"spectrum_id":"CCMSLIB00017262443","spectrum_index":27242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Glu (delta mass: 101.048 Da; putative annotation: L-Threonine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.177,"smiles":null,"spectrum_id":"CCMSLIB00017262445","spectrum_index":27243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 162.053 Da; putative annotation: Spectral Match to D-(+)-Mannose from NIST14; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.177,"smiles":null,"spectrum_id":"CCMSLIB00017262447","spectrum_index":27244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 173.1199 Da; putative annotation: N-Ethylbuphedrone; putative formula: C12H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.269,"smiles":null,"spectrum_id":"CCMSLIB00017262450","spectrum_index":27245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 372.2669 Da; putative annotation: 12-Ketodeoxycholic acid; putative formula: C24H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.358,"smiles":null,"spectrum_id":"CCMSLIB00017262451","spectrum_index":27246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 139.0983 Da; putative annotation: 3-Piperidin-4-ylpropanoic acid; putative formula: C8H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.2,"smiles":null,"spectrum_id":"CCMSLIB00017262454","spectrum_index":27247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 284.1773 Da; putative annotation: 19-Hydroxyandrost-4-ene-3,17-dione; putative formula: C19H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.248,"smiles":null,"spectrum_id":"CCMSLIB00017262457","spectrum_index":27248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 164.0837 Da; putative annotation: 3-(2-Methylphenoxy)propane-1,2-diol; putative formula: C10H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.233,"smiles":null,"spectrum_id":"CCMSLIB00017262459","spectrum_index":27249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Glu (delta mass: 248.0899 Da; putative annotation: 1-(3-carboxypropyl)-3,7-dimethylxanthine; putative formula: C11H12N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.209,"smiles":null,"spectrum_id":"CCMSLIB00017262461","spectrum_index":27250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 144.0212 Da; putative annotation: (4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.15,"smiles":null,"spectrum_id":"CCMSLIB00017262464","spectrum_index":27251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 368.1621 Da; putative annotation: N/A; putative formula: C22H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.259,"smiles":null,"spectrum_id":"CCMSLIB00017262467","spectrum_index":27252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 24.008 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.144,"smiles":null,"spectrum_id":"CCMSLIB00017262468","spectrum_index":27253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380167-01!3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015] (delta mass: 92.0106 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.165,"smiles":null,"spectrum_id":"CCMSLIB00017262471","spectrum_index":27254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Fluoro-4-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione (delta mass: 71.0282 Da; putative annotation: N/A; putative formula: C3H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.1,"smiles":null,"spectrum_id":"CCMSLIB00017262474","spectrum_index":27255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ser-Lys (delta mass: 83.0735 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.271,"smiles":null,"spectrum_id":"CCMSLIB00017262475","spectrum_index":27256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 284.2713 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.336,"smiles":null,"spectrum_id":"CCMSLIB00017262478","spectrum_index":27257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 309.1209 Da; putative annotation: N/A; putative formula: C15H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.244,"smiles":null,"spectrum_id":"CCMSLIB00017262481","spectrum_index":27258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 161.1204 Da; putative annotation: N/A; putative formula: C11H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.207,"smiles":null,"spectrum_id":"CCMSLIB00017262482","spectrum_index":27259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005843 Cinchonine|(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl)-quinolin-4-ylmethanol (delta mass: 347.2397 Da; putative annotation: N/A; putative formula: C20H33N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.42,"smiles":null,"spectrum_id":"CCMSLIB00017262485","spectrum_index":27260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 99.0317 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.134,"smiles":null,"spectrum_id":"CCMSLIB00017262488","spectrum_index":27261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 286.1243 Da; putative annotation: N/A; putative formula: C15H26O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.195,"smiles":null,"spectrum_id":"CCMSLIB00017262489","spectrum_index":27262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 169.0724 Da; putative annotation: N/A; putative formula: C4H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.19,"smiles":null,"spectrum_id":"CCMSLIB00017262492","spectrum_index":27263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 777.3198 Da; putative annotation: N/A; putative formula: C43H47N5O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":958.391,"smiles":null,"spectrum_id":"CCMSLIB00017262495","spectrum_index":27264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 227.0795 Da; putative annotation: N/A; putative formula: C11H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.155,"smiles":null,"spectrum_id":"CCMSLIB00017262496","spectrum_index":27265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 430.2305 Da; putative annotation: N/A; putative formula: C25H30N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.322,"smiles":null,"spectrum_id":"CCMSLIB00017262499","spectrum_index":27266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 428.2295 Da; putative annotation: N/A; putative formula: C21H24N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.288,"smiles":null,"spectrum_id":"CCMSLIB00017262502","spectrum_index":27267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Difluoromethoxy)-1H-indole-2-carboxylic acid (delta mass: 59.0591 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.106,"smiles":null,"spectrum_id":"CCMSLIB00017262503","spectrum_index":27268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Bromo-1H-pyrrolo[3,2-c]pyridine (delta mass: 99.9924 Da; putative annotation: N/A; putative formula: CHN4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.963,"smiles":null,"spectrum_id":"CCMSLIB00017262506","spectrum_index":27269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 152.0468 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.127,"smiles":null,"spectrum_id":"CCMSLIB00017262509","spectrum_index":27270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 168.0375 Da; putative annotation: N/A; putative formula: C7H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.15,"smiles":null,"spectrum_id":"CCMSLIB00017262510","spectrum_index":27271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 359.3406 Da; putative annotation: N/A; putative formula: C22H41N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.421,"smiles":null,"spectrum_id":"CCMSLIB00017262513","spectrum_index":27272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 74.0728 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.195,"smiles":null,"spectrum_id":"CCMSLIB00017262516","spectrum_index":27273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 83.0732 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.197,"smiles":null,"spectrum_id":"CCMSLIB00017262517","spectrum_index":27274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 131.0404 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.164,"smiles":null,"spectrum_id":"CCMSLIB00017262520","spectrum_index":27275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol (delta mass: 353.1472 Da; putative annotation: N/A; putative formula: C17H23NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.28,"smiles":null,"spectrum_id":"CCMSLIB00017262523","spectrum_index":27276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 293.1897 Da; putative annotation: N/A; putative formula: C11H29N5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.256,"smiles":null,"spectrum_id":"CCMSLIB00017262524","spectrum_index":27277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 181.0819 Da; putative annotation: N/A; putative formula: C4H7N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.257,"smiles":null,"spectrum_id":"CCMSLIB00017262527","spectrum_index":27278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 117.0523 Da; putative annotation: N/A; putative formula: C3H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.186,"smiles":null,"spectrum_id":"CCMSLIB00017262530","spectrum_index":27279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 170.1192 Da; putative annotation: N/A; putative formula: C12H14N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.185,"smiles":null,"spectrum_id":"CCMSLIB00017262531","spectrum_index":27280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 177.0454 Da; putative annotation: N/A; putative formula: C8H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.137,"smiles":null,"spectrum_id":"CCMSLIB00017262534","spectrum_index":27281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 583.2983 Da; putative annotation: N/A; putative formula: C34H41N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.49,"smiles":null,"spectrum_id":"CCMSLIB00017262535","spectrum_index":27282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 70.0422 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017262538","spectrum_index":27283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 318.2328 Da; putative annotation: N/A; putative formula: C17H35O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.298,"smiles":null,"spectrum_id":"CCMSLIB00017262541","spectrum_index":27284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 158.0673 Da; putative annotation: N/A; putative formula: C6H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.154,"smiles":null,"spectrum_id":"CCMSLIB00017262542","spectrum_index":27285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 62.0513 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.127,"smiles":null,"spectrum_id":"CCMSLIB00017262545","spectrum_index":27286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 233.1931 Da; putative annotation: N/A; putative formula: C14H23N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.285,"smiles":null,"spectrum_id":"CCMSLIB00017262548","spectrum_index":27287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 130.0656 Da; putative annotation: N/A; putative formula: C5H11N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.147,"smiles":null,"spectrum_id":"CCMSLIB00017262550","spectrum_index":27288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 115.1342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.263,"smiles":null,"spectrum_id":"CCMSLIB00017262552","spectrum_index":27289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 92.0632 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.202,"smiles":null,"spectrum_id":"CCMSLIB00017262555","spectrum_index":27290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 503.1852 Da; putative annotation: N/A; putative formula: C24H25N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.222,"smiles":null,"spectrum_id":"CCMSLIB00017262558","spectrum_index":27291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 505.4704 Da; putative annotation: N/A; putative formula: C26H55N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.509,"smiles":null,"spectrum_id":"CCMSLIB00017262559","spectrum_index":27292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Miglitol (delta mass: 82.0418 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017262562","spectrum_index":27293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 238.23 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.338,"smiles":null,"spectrum_id":"CCMSLIB00017262565","spectrum_index":27294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 139.0839 Da; putative annotation: N/A; putative formula: C5H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.17,"smiles":null,"spectrum_id":"CCMSLIB00017262566","spectrum_index":27295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 61.9912 Da; putative annotation: N/A; putative formula: C3H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.135,"smiles":null,"spectrum_id":"CCMSLIB00017262569","spectrum_index":27296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 648.242 Da; putative annotation: N/A; putative formula: C38H32N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.323,"smiles":null,"spectrum_id":"CCMSLIB00017262572","spectrum_index":27297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 389.256 Da; putative annotation: N/A; putative formula: C23H35NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.385,"smiles":null,"spectrum_id":"CCMSLIB00017262573","spectrum_index":27298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 61.1519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.186,"smiles":null,"spectrum_id":"CCMSLIB00017262576","spectrum_index":27299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 50.0357 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.133,"smiles":null,"spectrum_id":"CCMSLIB00017262579","spectrum_index":27300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (2Z)-2-cyano-3-(1H-indol-3-yl)prop-2-enoate (delta mass: 18.0099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.107,"smiles":null,"spectrum_id":"CCMSLIB00017262580","spectrum_index":27301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-5-Phenyl-2,4-pentadienoic acid (delta mass: 37.9788 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.054,"smiles":null,"spectrum_id":"CCMSLIB00017262583","spectrum_index":27302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 96.0278 Da; putative annotation: N/A; putative formula: N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.124,"smiles":null,"spectrum_id":"CCMSLIB00017262586","spectrum_index":27303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 36.9953 Da; putative annotation: N/A; putative formula: C2H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.071,"smiles":null,"spectrum_id":"CCMSLIB00017262587","spectrum_index":27304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 165.1148 Da; putative annotation: N/A; putative formula: C10H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.154,"smiles":null,"spectrum_id":"CCMSLIB00017262590","spectrum_index":27305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of P-OCTOPAMINE (delta mass: 8.9899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.076,"smiles":null,"spectrum_id":"CCMSLIB00017262592","spectrum_index":27306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 65.0641 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.182,"smiles":null,"spectrum_id":"CCMSLIB00017262594","spectrum_index":27307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 404.6403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1071.87,"smiles":null,"spectrum_id":"CCMSLIB00017262597","spectrum_index":27308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 827.2906 Da; putative annotation: N/A; putative formula: C56H47NP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1332.47,"smiles":null,"spectrum_id":"CCMSLIB00017262598","spectrum_index":27309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 569.548 Da; putative annotation: N/A; putative formula: C34H71N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.619,"smiles":null,"spectrum_id":"CCMSLIB00017262601","spectrum_index":27310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 57.0182 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.068,"smiles":null,"spectrum_id":"CCMSLIB00017262604","spectrum_index":27311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 46.0052 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.149,"smiles":null,"spectrum_id":"CCMSLIB00017262607","spectrum_index":27312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 30.0147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.092,"smiles":null,"spectrum_id":"CCMSLIB00017262608","spectrum_index":27313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 88.0241 Da; putative annotation: N/A; putative formula: C2H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.126,"smiles":null,"spectrum_id":"CCMSLIB00017262611","spectrum_index":27314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 226.0869 Da; putative annotation: N/A; putative formula: C10H15N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.168,"smiles":null,"spectrum_id":"CCMSLIB00017262612","spectrum_index":27315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 35.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.129,"smiles":null,"spectrum_id":"CCMSLIB00017262615","spectrum_index":27316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 32.0136 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.111,"smiles":null,"spectrum_id":"CCMSLIB00017262618","spectrum_index":27317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 508.4909 Da; putative annotation: N/A; putative formula: C31H64N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.563,"smiles":null,"spectrum_id":"CCMSLIB00017262619","spectrum_index":27318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 25.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.116,"smiles":null,"spectrum_id":"CCMSLIB00017262622","spectrum_index":27319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 197.1282 Da; putative annotation: N/A; putative formula: C8H15N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.241,"smiles":null,"spectrum_id":"CCMSLIB00017262625","spectrum_index":27320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 284.1973 Da; putative annotation: N/A; putative formula: C20H28O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.278,"smiles":null,"spectrum_id":"CCMSLIB00017262626","spectrum_index":27321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-uridine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.087,"smiles":null,"spectrum_id":"CCMSLIB00017262629","spectrum_index":27322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP011101 Methyl trans-cinnamic acid|4-Methylcinnamic acid|(E)-3-(4-methylphenyl)prop-2-enoic acid (delta mass: 264.0623 Da; putative annotation: N/A; putative formula: C7H13N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.138,"smiles":null,"spectrum_id":"CCMSLIB00017262632","spectrum_index":27323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 43.9898 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.086,"smiles":null,"spectrum_id":"CCMSLIB00017262633","spectrum_index":27324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 84.0577 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017262636","spectrum_index":27325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 67.0856 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.161,"smiles":null,"spectrum_id":"CCMSLIB00017262639","spectrum_index":27326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 40.0191 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.086,"smiles":null,"spectrum_id":"CCMSLIB00017262640","spectrum_index":27327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 490.1107 Da; putative annotation: N/A; putative formula: C23H22O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.171,"smiles":null,"spectrum_id":"CCMSLIB00017262643","spectrum_index":27328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eglumegad (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.139,"smiles":null,"spectrum_id":"CCMSLIB00017262646","spectrum_index":27329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-Hydroxy-4,6-dimethoxyacetophenone\"\" (delta mass: 138.1416 Da; putative annotation: N/A; putative formula: C10H18)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.222,"smiles":null,"spectrum_id":"CCMSLIB00017262647","spectrum_index":27330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 449.1917 Da; putative annotation: N/A; putative formula: C21H31N5O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.304,"smiles":null,"spectrum_id":"CCMSLIB00017262650","spectrum_index":27331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)- (delta mass: 294.0779 Da; putative annotation: N/A; putative formula: C14H19N2O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.147,"smiles":null,"spectrum_id":"CCMSLIB00017262651","spectrum_index":27332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 81.0581 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017262654","spectrum_index":27333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol, 1-[2-(2,4-dimethylphenyl)diazenyl]- (delta mass: 234.0322 Da; putative annotation: N/A; putative formula: C7H12N2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.166,"smiles":null,"spectrum_id":"CCMSLIB00017262657","spectrum_index":27334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 71.0443 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.178,"smiles":null,"spectrum_id":"CCMSLIB00017262658","spectrum_index":27335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 15.0161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.149,"smiles":null,"spectrum_id":"CCMSLIB00017262661","spectrum_index":27336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 636.2662 Da; putative annotation: N/A; putative formula: C46H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":965.535,"smiles":null,"spectrum_id":"CCMSLIB00017262664","spectrum_index":27337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Pro-Lys from NIST14 (delta mass: 128.0581 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.292,"smiles":null,"spectrum_id":"CCMSLIB00017262666","spectrum_index":27338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 279.1416 Da; putative annotation: N/A; putative formula: C14H23N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.238,"smiles":null,"spectrum_id":"CCMSLIB00017262668","spectrum_index":27339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 228.136 Da; putative annotation: N/A; putative formula: C12H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.201,"smiles":null,"spectrum_id":"CCMSLIB00017262671","spectrum_index":27340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 456.2354 Da; putative annotation: N/A; putative formula: C21H24N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.405,"smiles":null,"spectrum_id":"CCMSLIB00017262673","spectrum_index":27341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacetonitrile (delta mass: 304.2139 Da; putative annotation: N/A; putative formula: C18H28N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.29,"smiles":null,"spectrum_id":"CCMSLIB00017262675","spectrum_index":27342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 119.0442 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.12,"smiles":null,"spectrum_id":"CCMSLIB00017262678","spectrum_index":27343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 105.0801 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.151,"smiles":null,"spectrum_id":"CCMSLIB00017262680","spectrum_index":27344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 45.9943 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.102,"smiles":null,"spectrum_id":"CCMSLIB00017262682","spectrum_index":27345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 115.9558 Da; putative annotation: N/A; putative formula: C3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.061,"smiles":null,"spectrum_id":"CCMSLIB00017262685","spectrum_index":27346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 118.0778 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.19,"smiles":null,"spectrum_id":"CCMSLIB00017262688","spectrum_index":27347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Benzyloxy)-1H-indole (delta mass: 117.9346 Da; putative annotation: N/A; putative formula: C6H-2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.042,"smiles":null,"spectrum_id":"CCMSLIB00017262689","spectrum_index":27348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 544.4491 Da; putative annotation: N/A; putative formula: C35H60O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.536,"smiles":null,"spectrum_id":"CCMSLIB00017262692","spectrum_index":27349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 633.4235 Da; putative annotation: N/A; putative formula: C31H64N5O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.494,"smiles":null,"spectrum_id":"CCMSLIB00017262695","spectrum_index":27350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 414.2018 Da; putative annotation: N/A; putative formula: C28H30OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.262,"smiles":null,"spectrum_id":"CCMSLIB00017262696","spectrum_index":27351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 811.472 Da; putative annotation: N/A; putative formula: C42H69NO14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":992.543,"smiles":null,"spectrum_id":"CCMSLIB00017262699","spectrum_index":27352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 87.0208 Da; putative annotation: N/A; putative formula: C5HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.108,"smiles":null,"spectrum_id":"CCMSLIB00017262702","spectrum_index":27353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 71.0751 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.198,"smiles":null,"spectrum_id":"CCMSLIB00017262705","spectrum_index":27354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 372.1238 Da; putative annotation: N/A; putative formula: C19H21N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.184,"smiles":null,"spectrum_id":"CCMSLIB00017262706","spectrum_index":27355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 44.9132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.067,"smiles":null,"spectrum_id":"CCMSLIB00017262709","spectrum_index":27356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 168.1149 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017262712","spectrum_index":27357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 60.0 eV (delta mass: 116.8219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.924,"smiles":null,"spectrum_id":"CCMSLIB00017262713","spectrum_index":27358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 105.0632 Da; putative annotation: N/A; putative formula: CH7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.111,"smiles":null,"spectrum_id":"CCMSLIB00017262716","spectrum_index":27359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 307.1604 Da; putative annotation: N/A; putative formula: C19H22N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.288,"smiles":null,"spectrum_id":"CCMSLIB00017262718","spectrum_index":27360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 645.2284 Da; putative annotation: N/A; putative formula: C24H32N13O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1150.4,"smiles":null,"spectrum_id":"CCMSLIB00017262720","spectrum_index":27361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 269.2354 Da; putative annotation: N/A; putative formula: C16H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.241,"smiles":null,"spectrum_id":"CCMSLIB00017262723","spectrum_index":27362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 251.0643 Da; putative annotation: N/A; putative formula: C3H10N9O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.124,"smiles":null,"spectrum_id":"CCMSLIB00017262726","spectrum_index":27363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 42.0581 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.123,"smiles":null,"spectrum_id":"CCMSLIB00017262727","spectrum_index":27364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 147.1657 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.257,"smiles":null,"spectrum_id":"CCMSLIB00017262730","spectrum_index":27365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 627.5377 Da; putative annotation: N/A; putative formula: C44H69NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.609,"smiles":null,"spectrum_id":"CCMSLIB00017262732","spectrum_index":27366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 402.1043 Da; putative annotation: N/A; putative formula: C31H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.169,"smiles":null,"spectrum_id":"CCMSLIB00017262734","spectrum_index":27367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 69.0389 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.08,"smiles":null,"spectrum_id":"CCMSLIB00017262737","spectrum_index":27368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 148.0002 Da; putative annotation: N/A; putative formula: C4H4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.124,"smiles":null,"spectrum_id":"CCMSLIB00017262740","spectrum_index":27369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 27.022 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.057,"smiles":null,"spectrum_id":"CCMSLIB00017262741","spectrum_index":27370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 408.2608 Da; putative annotation: N/A; putative formula: C19H28N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.466,"smiles":null,"spectrum_id":"CCMSLIB00017262744","spectrum_index":27371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 50.0 eV (delta mass: 84.9797 Da; putative annotation: N/A; putative formula: C2H-1NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.082,"smiles":null,"spectrum_id":"CCMSLIB00017262747","spectrum_index":27372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 54.0467 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.117,"smiles":null,"spectrum_id":"CCMSLIB00017262748","spectrum_index":27373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 186.0487 Da; putative annotation: N/A; putative formula: C6H11N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.108,"smiles":null,"spectrum_id":"CCMSLIB00017262751","spectrum_index":27374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 17.1265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.233,"smiles":null,"spectrum_id":"CCMSLIB00017262754","spectrum_index":27375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 559.3944 Da; putative annotation: N/A; putative formula: C27H53N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.453,"smiles":null,"spectrum_id":"CCMSLIB00017262757","spectrum_index":27376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-(piperidin-4-yl)-1H-indole (delta mass: 42.0147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.144,"smiles":null,"spectrum_id":"CCMSLIB00017262758","spectrum_index":27377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 411.2121 Da; putative annotation: N/A; putative formula: C18H29N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.278,"smiles":null,"spectrum_id":"CCMSLIB00017262761","spectrum_index":27378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 9.9836 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.08,"smiles":null,"spectrum_id":"CCMSLIB00017262763","spectrum_index":27379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 1089.5253 Da; putative annotation: N/A; putative formula: C52H75N13O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1416.65,"smiles":null,"spectrum_id":"CCMSLIB00017262765","spectrum_index":27380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 503.2477 Da; putative annotation: N/A; putative formula: C22H37N3O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.355,"smiles":null,"spectrum_id":"CCMSLIB00017262768","spectrum_index":27381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 633.3597 Da; putative annotation: N/A; putative formula: C29H47N9O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.473,"smiles":null,"spectrum_id":"CCMSLIB00017262771","spectrum_index":27382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 244.1178 Da; putative annotation: N/A; putative formula: C10H20N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.195,"smiles":null,"spectrum_id":"CCMSLIB00017262772","spectrum_index":27383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 86.0368 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.134,"smiles":null,"spectrum_id":"CCMSLIB00017262775","spectrum_index":27384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 339.9945 Da; putative annotation: N/A; putative formula: C12H12N4S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.092,"smiles":null,"spectrum_id":"CCMSLIB00017262778","spectrum_index":27385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 60.0036 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.085,"smiles":null,"spectrum_id":"CCMSLIB00017262779","spectrum_index":27386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 445.4126 Da; putative annotation: N/A; putative formula: C27H51N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.473,"smiles":null,"spectrum_id":"CCMSLIB00017262782","spectrum_index":27387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 389.386 Da; putative annotation: N/A; putative formula: C24H47N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.457,"smiles":null,"spectrum_id":"CCMSLIB00017262784","spectrum_index":27388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 614.9862 Da; putative annotation: N/A; putative formula: C15H21NO19S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":837.083,"smiles":null,"spectrum_id":"CCMSLIB00017262786","spectrum_index":27389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 421.3416 Da; putative annotation: N/A; putative formula: C23H43N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.465,"smiles":null,"spectrum_id":"CCMSLIB00017262789","spectrum_index":27390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 906.4075 Da; putative annotation: N/A; putative formula: C40H69N4O13P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1069.47,"smiles":null,"spectrum_id":"CCMSLIB00017262790","spectrum_index":27391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2,2,6,6-tetramethyl-4-(2-methyl-1-(2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl)propyl)cyclohex-4-ene-1,3-dione (delta mass: 218.131 Da; putative annotation: N/A; putative formula: C14H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.353,"smiles":null,"spectrum_id":"CCMSLIB00017262793","spectrum_index":27392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methoxycarbonyl)but-3-enoic acid (delta mass: 24.0364 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.086,"smiles":null,"spectrum_id":"CCMSLIB00017262796","spectrum_index":27393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 217.0738 Da; putative annotation: N/A; putative formula: C12H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.15,"smiles":null,"spectrum_id":"CCMSLIB00017262797","spectrum_index":27394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 199.0632 Da; putative annotation: N/A; putative formula: C12H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.139,"smiles":null,"spectrum_id":"CCMSLIB00017262800","spectrum_index":27395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 161.069 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.193,"smiles":null,"spectrum_id":"CCMSLIB00017262803","spectrum_index":27396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 123.0082 Da; putative annotation: N/A; putative formula: C2H6NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.095,"smiles":null,"spectrum_id":"CCMSLIB00017262804","spectrum_index":27397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 143.0588 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.14,"smiles":null,"spectrum_id":"CCMSLIB00017262807","spectrum_index":27398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 43.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017262810","spectrum_index":27399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 14.0279 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.124,"smiles":null,"spectrum_id":"CCMSLIB00017262813","spectrum_index":27400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 52.0248 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.126,"smiles":null,"spectrum_id":"CCMSLIB00017262814","spectrum_index":27401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 18.0856 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.245,"smiles":null,"spectrum_id":"CCMSLIB00017262817","spectrum_index":27402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxamide, N-[1-(aminocarbonyl)-2,2-dimethylpropyl]-1-(4-hydroxypentyl)- (delta mass: 70.0487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.277,"smiles":null,"spectrum_id":"CCMSLIB00017262819","spectrum_index":27403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 173.0913 Da; putative annotation: N/A; putative formula: C5H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.184,"smiles":null,"spectrum_id":"CCMSLIB00017262821","spectrum_index":27404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1028.1267 Da; putative annotation: N/A; putative formula: C43H40N12O5S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1250.22,"smiles":null,"spectrum_id":"CCMSLIB00017262824","spectrum_index":27405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 119.0445 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.178,"smiles":null,"spectrum_id":"CCMSLIB00017262827","spectrum_index":27406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 7.4188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017262828","spectrum_index":27407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 146.109 Da; putative annotation: N/A; putative formula: C5H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.143,"smiles":null,"spectrum_id":"CCMSLIB00017262831","spectrum_index":27408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.14,"smiles":null,"spectrum_id":"CCMSLIB00017262834","spectrum_index":27409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxy-1H-indole-3-carbaldehyde (delta mass: 62.0005 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.071,"smiles":null,"spectrum_id":"CCMSLIB00017262835","spectrum_index":27410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.091,"smiles":null,"spectrum_id":"CCMSLIB00017262838","spectrum_index":27411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 56.015 Da; putative annotation: N/A; putative formula: N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.102,"smiles":null,"spectrum_id":"CCMSLIB00017262841","spectrum_index":27412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 14.017 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.097,"smiles":null,"spectrum_id":"CCMSLIB00017262842","spectrum_index":27413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylhistamine CollisionEnergy:102040 (delta mass: 169.1241 Da; putative annotation: N/A; putative formula: C13H15NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017262845","spectrum_index":27414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 72.0666 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.221,"smiles":null,"spectrum_id":"CCMSLIB00017262848","spectrum_index":27415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 73.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.201,"smiles":null,"spectrum_id":"CCMSLIB00017262849","spectrum_index":27416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 28.0292 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.199,"smiles":null,"spectrum_id":"CCMSLIB00017262852","spectrum_index":27417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 279.2647 Da; putative annotation: N/A; putative formula: C17H33N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.324,"smiles":null,"spectrum_id":"CCMSLIB00017262854","spectrum_index":27418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074902 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 32.019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.1,"smiles":null,"spectrum_id":"CCMSLIB00017262856","spectrum_index":27419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 45.0457 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.112,"smiles":null,"spectrum_id":"CCMSLIB00017262859","spectrum_index":27420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levallorphan (delta mass: 16.0178 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.219,"smiles":null,"spectrum_id":"CCMSLIB00017262862","spectrum_index":27421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACETALDEHYDE (delta mass: 42.9779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.054,"smiles":null,"spectrum_id":"CCMSLIB00017262863","spectrum_index":27422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 152.0248 Da; putative annotation: N/A; putative formula: C5H5N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.133,"smiles":null,"spectrum_id":"CCMSLIB00017262866","spectrum_index":27423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 18.9998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.05,"smiles":null,"spectrum_id":"CCMSLIB00017262868","spectrum_index":27424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 360.1581 Da; putative annotation: N/A; putative formula: C21H28OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.218,"smiles":null,"spectrum_id":"CCMSLIB00017262870","spectrum_index":27425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 36.0218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.081,"smiles":null,"spectrum_id":"CCMSLIB00017262873","spectrum_index":27426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetamide (delta mass: 104.0656 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.152,"smiles":null,"spectrum_id":"CCMSLIB00017262876","spectrum_index":27427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 55.0054 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.097,"smiles":null,"spectrum_id":"CCMSLIB00017262877","spectrum_index":27428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 61.0154 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.075,"smiles":null,"spectrum_id":"CCMSLIB00017262880","spectrum_index":27429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 150.0319 Da; putative annotation: Gallacetophenone; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.16,"smiles":null,"spectrum_id":"CCMSLIB00017262883","spectrum_index":27430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Prolylphenylalanine (delta mass: 260.1541 Da; putative annotation: Phe-Leu; putative formula: C15H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.293,"smiles":null,"spectrum_id":"CCMSLIB00017262884","spectrum_index":27431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine methyl ester (delta mass: 173.0508 Da; putative annotation: N-Acetyl-DL-methionine CollisionEnergy:102040; putative formula: C7H11NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.125,"smiles":null,"spectrum_id":"CCMSLIB00017262887","spectrum_index":27432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 101.0471 Da; putative annotation: O-Methyl-DL-serine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017262890","spectrum_index":27433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 242.1272 Da; putative annotation: Massbank:PR311045 Glutamylleucine; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.272,"smiles":null,"spectrum_id":"CCMSLIB00017262891","spectrum_index":27434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 558.3546 Da; putative annotation: Polyphyllin A; putative formula: C33H50O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.478,"smiles":null,"spectrum_id":"CCMSLIB00017262894","spectrum_index":27435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 128.0471 Da; putative annotation: 5-Methoxy-5-oxopentanoic acid CollisionEnergy:102040; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.086,"smiles":null,"spectrum_id":"CCMSLIB00017262897","spectrum_index":27436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(+)-1-Cyclohexylethylamine (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.165,"smiles":null,"spectrum_id":"CCMSLIB00017262898","spectrum_index":27437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 425.2042 Da; putative annotation: N/A; putative formula: C26H27N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.275,"smiles":null,"spectrum_id":"CCMSLIB00017262901","spectrum_index":27438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 148.0492 Da; putative annotation: N/A; putative formula: C5H12N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.126,"smiles":null,"spectrum_id":"CCMSLIB00017262903","spectrum_index":27439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Fluoro-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 29.0345 Da; putative annotation: N/A; putative formula: H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.132,"smiles":null,"spectrum_id":"CCMSLIB00017262905","spectrum_index":27440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 61.0337 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.12,"smiles":null,"spectrum_id":"CCMSLIB00017262908","spectrum_index":27441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 145.0734 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.206,"smiles":null,"spectrum_id":"CCMSLIB00017262911","spectrum_index":27442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 189.0986 Da; putative annotation: N/A; putative formula: C12H15NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.169,"smiles":null,"spectrum_id":"CCMSLIB00017262913","spectrum_index":27443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine 4-.beta.-D-glucuronide (delta mass: 119.0742 Da; putative annotation: N/A; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.193,"smiles":null,"spectrum_id":"CCMSLIB00017262915","spectrum_index":27444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 42.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.122,"smiles":null,"spectrum_id":"CCMSLIB00017262918","spectrum_index":27445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 98.0477 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.145,"smiles":null,"spectrum_id":"CCMSLIB00017262920","spectrum_index":27446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 102.0343 Da; putative annotation: N/A; putative formula: C3H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.115,"smiles":null,"spectrum_id":"CCMSLIB00017262922","spectrum_index":27447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Pro (delta mass: 71.0356 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.19,"smiles":null,"spectrum_id":"CCMSLIB00017262925","spectrum_index":27448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 223.0843 Da; putative annotation: N/A; putative formula: C11H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.155,"smiles":null,"spectrum_id":"CCMSLIB00017262926","spectrum_index":27449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 75.0473 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.128,"smiles":null,"spectrum_id":"CCMSLIB00017262929","spectrum_index":27450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 238.0773 Da; putative annotation: N/A; putative formula: C3H10N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.143,"smiles":null,"spectrum_id":"CCMSLIB00017262932","spectrum_index":27451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdesmethoxycurcumin (delta mass: 297.1279 Da; putative annotation: N/A; putative formula: C10H24N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.24,"smiles":null,"spectrum_id":"CCMSLIB00017262935","spectrum_index":27452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 140.0507 Da; putative annotation: N/A; putative formula: C6H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.155,"smiles":null,"spectrum_id":"CCMSLIB00017262936","spectrum_index":27453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 271.1088 Da; putative annotation: N/A; putative formula: C11H18N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.179,"smiles":null,"spectrum_id":"CCMSLIB00017262939","spectrum_index":27454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 370.2529 Da; putative annotation: N/A; putative formula: C25H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.339,"smiles":null,"spectrum_id":"CCMSLIB00017262941","spectrum_index":27455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 918.5348 Da; putative annotation: N/A; putative formula: C43H78N6O13S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1052.63,"smiles":null,"spectrum_id":"CCMSLIB00017262943","spectrum_index":27456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 46.0303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.153,"smiles":null,"spectrum_id":"CCMSLIB00017262946","spectrum_index":27457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 178.1355 Da; putative annotation: N/A; putative formula: C12H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.269,"smiles":null,"spectrum_id":"CCMSLIB00017262948","spectrum_index":27458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 137.0209 Da; putative annotation: N/A; putative formula: CH-1N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.076,"smiles":null,"spectrum_id":"CCMSLIB00017262950","spectrum_index":27459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 74.0015 Da; putative annotation: N/A; putative formula: C3H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.061,"smiles":null,"spectrum_id":"CCMSLIB00017262953","spectrum_index":27460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 130.0509 Da; putative annotation: N/A; putative formula: C3H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.101,"smiles":null,"spectrum_id":"CCMSLIB00017262955","spectrum_index":27461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 57.0506 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.131,"smiles":null,"spectrum_id":"CCMSLIB00017262957","spectrum_index":27462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 28.0332 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.166,"smiles":null,"spectrum_id":"CCMSLIB00017262960","spectrum_index":27463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 98.1074 Da; putative annotation: N/A; putative formula: C7H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.236,"smiles":null,"spectrum_id":"CCMSLIB00017262961","spectrum_index":27464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AGMATINE (delta mass: 68.0623 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.191,"smiles":null,"spectrum_id":"CCMSLIB00017262964","spectrum_index":27465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-tert-Butyl-2,4-dihydroxybenzophenone (delta mass: 60.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017262967","spectrum_index":27466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Arg (delta mass: 270.0849 Da; putative annotation: N/A; putative formula: C7H22N4O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.246,"smiles":null,"spectrum_id":"CCMSLIB00017262968","spectrum_index":27467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 345.2509 Da; putative annotation: N/A; putative formula: C18H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.42,"smiles":null,"spectrum_id":"CCMSLIB00017262971","spectrum_index":27468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 231.0899 Da; putative annotation: N/A; putative formula: C6H13N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.176,"smiles":null,"spectrum_id":"CCMSLIB00017262974","spectrum_index":27469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 97.0526 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.123,"smiles":null,"spectrum_id":"CCMSLIB00017262975","spectrum_index":27470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 116.5463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.611,"smiles":null,"spectrum_id":"CCMSLIB00017262978","spectrum_index":27471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 16.9991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017262981","spectrum_index":27472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 131.0733 Da; putative annotation: N/A; putative formula: C9H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.165,"smiles":null,"spectrum_id":"CCMSLIB00017262982","spectrum_index":27473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 46.0572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.138,"smiles":null,"spectrum_id":"CCMSLIB00017262985","spectrum_index":27474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1105.5329 Da; putative annotation: N/A; putative formula: C54H75N9O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1268.59,"smiles":null,"spectrum_id":"CCMSLIB00017262988","spectrum_index":27475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 122.0735 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.155,"smiles":null,"spectrum_id":"CCMSLIB00017262990","spectrum_index":27476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 463.3148 Da; putative annotation: N/A; putative formula: C23H45NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.385,"smiles":null,"spectrum_id":"CCMSLIB00017262992","spectrum_index":27477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminoindole (delta mass: 166.9872 Da; putative annotation: N/A; putative formula: C7H5NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.063,"smiles":null,"spectrum_id":"CCMSLIB00017262994","spectrum_index":27478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 201.0841 Da; putative annotation: N/A; putative formula: C9H17NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.139,"smiles":null,"spectrum_id":"CCMSLIB00017262997","spectrum_index":27479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 42.15 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.299,"smiles":null,"spectrum_id":"CCMSLIB00017262998","spectrum_index":27480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.113,"smiles":null,"spectrum_id":"CCMSLIB00017263001","spectrum_index":27481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 60.0164 Da; putative annotation: N/A; putative formula: CH4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.066,"smiles":null,"spectrum_id":"CCMSLIB00017263004","spectrum_index":27482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 317.0774 Da; putative annotation: N/A; putative formula: C14H7N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.169,"smiles":null,"spectrum_id":"CCMSLIB00017263005","spectrum_index":27483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-[3-(Benzyloxy)benzyl]-1H-tetrazole-1,5-diamine (delta mass: 90.0572 Da; putative annotation: N/A; putative formula: C6H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.203,"smiles":null,"spectrum_id":"CCMSLIB00017263008","spectrum_index":27484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 394.2739 Da; putative annotation: N/A; putative formula: C17H34N10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.366,"smiles":null,"spectrum_id":"CCMSLIB00017263011","spectrum_index":27485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 35.0375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.145,"smiles":null,"spectrum_id":"CCMSLIB00017263012","spectrum_index":27486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 110.0367 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.091,"smiles":null,"spectrum_id":"CCMSLIB00017263015","spectrum_index":27487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 114.0833 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017263018","spectrum_index":27488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1079.5531 Da; putative annotation: N/A; putative formula: C52H81N5O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1260.62,"smiles":null,"spectrum_id":"CCMSLIB00017263021","spectrum_index":27489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Pro from NIST14 (delta mass: 99.069 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.172,"smiles":null,"spectrum_id":"CCMSLIB00017263022","spectrum_index":27490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 136.0419 Da; putative annotation: N/A; putative formula: C2H8N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.108,"smiles":null,"spectrum_id":"CCMSLIB00017263025","spectrum_index":27491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-crinamine (delta mass: 18.0093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.148,"smiles":null,"spectrum_id":"CCMSLIB00017263027","spectrum_index":27492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 39.0753 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.182,"smiles":null,"spectrum_id":"CCMSLIB00017263029","spectrum_index":27493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE (delta mass: 45.0174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.104,"smiles":null,"spectrum_id":"CCMSLIB00017263032","spectrum_index":27494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 120.1668 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.248,"smiles":null,"spectrum_id":"CCMSLIB00017263035","spectrum_index":27495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU159002 Benzoylecgonine|(3S,4R)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid (delta mass: 125.0838 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.223,"smiles":null,"spectrum_id":"CCMSLIB00017263037","spectrum_index":27496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 480.1278 Da; putative annotation: N/A; putative formula: C33H21O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.188,"smiles":null,"spectrum_id":"CCMSLIB00017263039","spectrum_index":27497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 126.2129 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.294,"smiles":null,"spectrum_id":"CCMSLIB00017263042","spectrum_index":27498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 42.0504 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.189,"smiles":null,"spectrum_id":"CCMSLIB00017263044","spectrum_index":27499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 100.0529 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.155,"smiles":null,"spectrum_id":"CCMSLIB00017263046","spectrum_index":27500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 160.0542 Da; putative annotation: N/A; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.219,"smiles":null,"spectrum_id":"CCMSLIB00017263049","spectrum_index":27501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 21.8815 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.973,"smiles":null,"spectrum_id":"CCMSLIB00017263051","spectrum_index":27502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 169.1092 Da; putative annotation: N/A; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.206,"smiles":null,"spectrum_id":"CCMSLIB00017263053","spectrum_index":27503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 211.0693 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.166,"smiles":null,"spectrum_id":"CCMSLIB00017263056","spectrum_index":27504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 109.9001 Da; putative annotation: N/A; putative formula: O-1P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.059,"smiles":null,"spectrum_id":"CCMSLIB00017263057","spectrum_index":27505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 23.9985 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.074,"smiles":null,"spectrum_id":"CCMSLIB00017263060","spectrum_index":27506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 26.062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.149,"smiles":null,"spectrum_id":"CCMSLIB00017263063","spectrum_index":27507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Arabinose (delta mass: 36.0 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.06,"smiles":null,"spectrum_id":"CCMSLIB00017263065","spectrum_index":27508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ticarcillin (delta mass: 180.0377 Da; putative annotation: N/A; putative formula: C6H13O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.09,"smiles":null,"spectrum_id":"CCMSLIB00017263067","spectrum_index":27509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 71.0332 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.104,"smiles":null,"spectrum_id":"CCMSLIB00017263070","spectrum_index":27510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 105.0788 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.248,"smiles":null,"spectrum_id":"CCMSLIB00017263071","spectrum_index":27511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 23.0162 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017263074","spectrum_index":27512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 43.0035 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.054,"smiles":null,"spectrum_id":"CCMSLIB00017263077","spectrum_index":27513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-HYDANTOIN (delta mass: 89.0365 Da; putative annotation: N/A; putative formula: C5H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017263078","spectrum_index":27514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(-)-Threose (delta mass: 46.0208 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.07,"smiles":null,"spectrum_id":"CCMSLIB00017263081","spectrum_index":27515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 80.0261 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017263084","spectrum_index":27516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 82.053 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.124,"smiles":null,"spectrum_id":"CCMSLIB00017263085","spectrum_index":27517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.154,"smiles":null,"spectrum_id":"CCMSLIB00017263088","spectrum_index":27518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.06,"smiles":null,"spectrum_id":"CCMSLIB00017263091","spectrum_index":27519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2,2,2-trifluoroethanamine (delta mass: 134.1119 Da; putative annotation: N/A; putative formula: H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.196,"smiles":null,"spectrum_id":"CCMSLIB00017263092","spectrum_index":27520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 43.9899 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017263095","spectrum_index":27521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 270.0742 Da; putative annotation: N/A; putative formula: C12H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.155,"smiles":null,"spectrum_id":"CCMSLIB00017263098","spectrum_index":27522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 166.0124 Da; putative annotation: N/A; putative formula: C5H10O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.108,"smiles":null,"spectrum_id":"CCMSLIB00017263099","spectrum_index":27523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310825 N-Fructosyl isoleucine (delta mass: 162.052 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.207,"smiles":null,"spectrum_id":"CCMSLIB00017263102","spectrum_index":27524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 14.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.149,"smiles":null,"spectrum_id":"CCMSLIB00017263105","spectrum_index":27525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 152.068 Da; putative annotation: N/A; putative formula: C2H4N10O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.138,"smiles":null,"spectrum_id":"CCMSLIB00017263108","spectrum_index":27526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 128.0471 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.118,"smiles":null,"spectrum_id":"CCMSLIB00017263110","spectrum_index":27527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 66.0036 Da; putative annotation: N/A; putative formula: C4H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.127,"smiles":null,"spectrum_id":"CCMSLIB00017263112","spectrum_index":27528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 414.1869 Da; putative annotation: N/A; putative formula: C17H30N6O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.353,"smiles":null,"spectrum_id":"CCMSLIB00017263115","spectrum_index":27529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 273.9621 Da; putative annotation: N/A; putative formula: C10H10OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.027,"smiles":null,"spectrum_id":"CCMSLIB00017263118","spectrum_index":27530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 126.0312 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.208,"smiles":null,"spectrum_id":"CCMSLIB00017263119","spectrum_index":27531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 924.7021 Da; putative annotation: N/A; putative formula: C53H92N6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1062.79,"smiles":null,"spectrum_id":"CCMSLIB00017263122","spectrum_index":27532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017263125","spectrum_index":27533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norisoboldine (delta mass: 49.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.181,"smiles":null,"spectrum_id":"CCMSLIB00017263128","spectrum_index":27534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 247.1185 Da; putative annotation: N/A; putative formula: C10H13N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.178,"smiles":null,"spectrum_id":"CCMSLIB00017263130","spectrum_index":27535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 116.0113 Da; putative annotation: N/A; putative formula: C4H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.103,"smiles":null,"spectrum_id":"CCMSLIB00017263133","spectrum_index":27536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 69.042 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.123,"smiles":null,"spectrum_id":"CCMSLIB00017263135","spectrum_index":27537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 272.1263 Da; putative annotation: N/A; putative formula: C19H16N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.228,"smiles":null,"spectrum_id":"CCMSLIB00017263137","spectrum_index":27538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 183.2389 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.434,"smiles":null,"spectrum_id":"CCMSLIB00017263140","spectrum_index":27539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 126.1039 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.185,"smiles":null,"spectrum_id":"CCMSLIB00017263143","spectrum_index":27540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 114.0873 Da; putative annotation: N/A; putative formula: C7H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.221,"smiles":null,"spectrum_id":"CCMSLIB00017263145","spectrum_index":27541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 473.1817 Da; putative annotation: N/A; putative formula: C21H32NO9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":978.358,"smiles":null,"spectrum_id":"CCMSLIB00017263147","spectrum_index":27542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 350.1878 Da; putative annotation: N/A; putative formula: C15H30N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.337,"smiles":null,"spectrum_id":"CCMSLIB00017263150","spectrum_index":27543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 474.2252 Da; putative annotation: N/A; putative formula: C26H34O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.29,"smiles":null,"spectrum_id":"CCMSLIB00017263153","spectrum_index":27544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 160.1255 Da; putative annotation: N/A; putative formula: C12H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.196,"smiles":null,"spectrum_id":"CCMSLIB00017263155","spectrum_index":27545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1170.2345 Da; putative annotation: N/A; putative formula: C51H50N10O15S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1392.33,"smiles":null,"spectrum_id":"CCMSLIB00017263158","spectrum_index":27546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 285.0159 Da; putative annotation: N/A; putative formula: C10H12N3OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.066,"smiles":null,"spectrum_id":"CCMSLIB00017263160","spectrum_index":27547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 87.0315 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.107,"smiles":null,"spectrum_id":"CCMSLIB00017263163","spectrum_index":27548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 413.4246 Da; putative annotation: N/A; putative formula: C22H51N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.52,"smiles":null,"spectrum_id":"CCMSLIB00017263165","spectrum_index":27549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 122.0377 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.16,"smiles":null,"spectrum_id":"CCMSLIB00017263168","spectrum_index":27550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 66.0105 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.134,"smiles":null,"spectrum_id":"CCMSLIB00017263170","spectrum_index":27551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-nitro-1H-imidazole-5-carboxylate (delta mass: 56.0709 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.122,"smiles":null,"spectrum_id":"CCMSLIB00017263173","spectrum_index":27552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 294.2552 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.379,"smiles":null,"spectrum_id":"CCMSLIB00017263175","spectrum_index":27553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 252.2457 Da; putative annotation: N/A; putative formula: C17H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.299,"smiles":null,"spectrum_id":"CCMSLIB00017263178","spectrum_index":27554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.098,"smiles":null,"spectrum_id":"CCMSLIB00017263181","spectrum_index":27555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 224.1163 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.229,"smiles":null,"spectrum_id":"CCMSLIB00017263182","spectrum_index":27556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 662.2427 Da; putative annotation: N/A; putative formula: C32H43N2O9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.356,"smiles":null,"spectrum_id":"CCMSLIB00017263185","spectrum_index":27557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 231.1467 Da; putative annotation: N/A; putative formula: C11H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.217,"smiles":null,"spectrum_id":"CCMSLIB00017263188","spectrum_index":27558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 373.1171 Da; putative annotation: N/A; putative formula: C20H23NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.167,"smiles":null,"spectrum_id":"CCMSLIB00017263190","spectrum_index":27559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 43.0901 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.187,"smiles":null,"spectrum_id":"CCMSLIB00017263192","spectrum_index":27560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 90.0458 Da; putative annotation: N/A; putative formula: CH7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.132,"smiles":null,"spectrum_id":"CCMSLIB00017263195","spectrum_index":27561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 90.0104 Da; putative annotation: N/A; putative formula: C6H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017263198","spectrum_index":27562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole (delta mass: 131.1279 Da; putative annotation: N/A; putative formula: C3H13N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.196,"smiles":null,"spectrum_id":"CCMSLIB00017263200","spectrum_index":27563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 32.093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.195,"smiles":null,"spectrum_id":"CCMSLIB00017263203","spectrum_index":27564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 361.2769 Da; putative annotation: N/A; putative formula: C26H35N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.348,"smiles":null,"spectrum_id":"CCMSLIB00017263205","spectrum_index":27565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 74.0617 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.201,"smiles":null,"spectrum_id":"CCMSLIB00017263207","spectrum_index":27566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 130.0263 Da; putative annotation: N/A; putative formula: C5H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.108,"smiles":null,"spectrum_id":"CCMSLIB00017263210","spectrum_index":27567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 74.0316 Da; putative annotation: N/A; putative formula: C2H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.077,"smiles":null,"spectrum_id":"CCMSLIB00017263213","spectrum_index":27568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 926.4865 Da; putative annotation: N/A; putative formula: C52H70N4O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1107.56,"smiles":null,"spectrum_id":"CCMSLIB00017263214","spectrum_index":27569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 653.2798 Da; putative annotation: N/A; putative formula: C36H35N11S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.35,"smiles":null,"spectrum_id":"CCMSLIB00017263217","spectrum_index":27570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 640.4792 Da; putative annotation: N/A; putative formula: C43H64N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.56,"smiles":null,"spectrum_id":"CCMSLIB00017263219","spectrum_index":27571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 412.1843 Da; putative annotation: N/A; putative formula: C19H28N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.307,"smiles":null,"spectrum_id":"CCMSLIB00017263221","spectrum_index":27572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 69.0578 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017263224","spectrum_index":27573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 199.0609 Da; putative annotation: N/A; putative formula: C8H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.33,"smiles":null,"spectrum_id":"CCMSLIB00017263227","spectrum_index":27574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 102.0317 Da; putative annotation: N/A; putative formula: C4H6O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.097,"smiles":null,"spectrum_id":"CCMSLIB00017263229","spectrum_index":27575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 160.0888 Da; putative annotation: N/A; putative formula: C11H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017263232","spectrum_index":27576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002408 Hordenine|4-[2-(dimethylamino)ethyl]phenol (delta mass: 59.0373 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.16,"smiles":null,"spectrum_id":"CCMSLIB00017263234","spectrum_index":27577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 97.9749 Da; putative annotation: N/A; putative formula: C2H-2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.151,"smiles":null,"spectrum_id":"CCMSLIB00017263237","spectrum_index":27578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 154.1931 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.273,"smiles":null,"spectrum_id":"CCMSLIB00017263239","spectrum_index":27579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Diethyl-1,3,4,9-tetrahydro-4-oxo-pyrano[3,4-b]indole-1-acetic acid methyl ester (delta mass: 89.065 Da; putative annotation: N/A; putative formula: C7H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.219,"smiles":null,"spectrum_id":"CCMSLIB00017263242","spectrum_index":27580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 836.4552 Da; putative annotation: N/A; putative formula: C44H68O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":999.515,"smiles":null,"spectrum_id":"CCMSLIB00017263244","spectrum_index":27581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 709.2434 Da; putative annotation: N/A; putative formula: C32H44N3O11PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1053.43,"smiles":null,"spectrum_id":"CCMSLIB00017263247","spectrum_index":27582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Benzyloxy)-1H-indol-3-yl]acetonitrile (delta mass: 153.0883 Da; putative annotation: N/A; putative formula: C3H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.206,"smiles":null,"spectrum_id":"CCMSLIB00017263250","spectrum_index":27583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 57.0209 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.092,"smiles":null,"spectrum_id":"CCMSLIB00017263252","spectrum_index":27584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 1209.3242 Da; putative annotation: N/A; putative formula: C72H59NO11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1593.47,"smiles":null,"spectrum_id":"CCMSLIB00017263254","spectrum_index":27585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 49.0 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.048,"smiles":null,"spectrum_id":"CCMSLIB00017263257","spectrum_index":27586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 153.1028 Da; putative annotation: N/A; putative formula: C6H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.191,"smiles":null,"spectrum_id":"CCMSLIB00017263260","spectrum_index":27587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 128.0601 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.162,"smiles":null,"spectrum_id":"CCMSLIB00017263261","spectrum_index":27588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ribitol (delta mass: 124.1406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017263264","spectrum_index":27589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.065,"smiles":null,"spectrum_id":"CCMSLIB00017263267","spectrum_index":27590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 152.0668 Da; putative annotation: N/A; putative formula: C2H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.195,"smiles":null,"spectrum_id":"CCMSLIB00017263269","spectrum_index":27591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 102.0932 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.196,"smiles":null,"spectrum_id":"CCMSLIB00017263272","spectrum_index":27592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 41.0148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017263274","spectrum_index":27593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 724.6342 Da; putative annotation: N/A; putative formula: C44H80N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1317.91,"smiles":null,"spectrum_id":"CCMSLIB00017263277","spectrum_index":27594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 301.2618 Da; putative annotation: N/A; putative formula: C17H35NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.328,"smiles":null,"spectrum_id":"CCMSLIB00017263280","spectrum_index":27595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 17.0569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.18,"smiles":null,"spectrum_id":"CCMSLIB00017263283","spectrum_index":27596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 111.0338 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.073,"smiles":null,"spectrum_id":"CCMSLIB00017263284","spectrum_index":27597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Threonylleucine (isomer of 809, 926) (delta mass: 113.0839 Da; putative annotation: Massbank:PB000396 Isoleucine|2-amino-3-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.233,"smiles":null,"spectrum_id":"CCMSLIB00017263287","spectrum_index":27598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.gamma.-Glutamyl-L-glutamic acid (delta mass: 240.0743 Da; putative annotation: Massbank:FIO00297 3-Hydroxy-beta-lapachone; putative formula: C15H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.177,"smiles":null,"spectrum_id":"CCMSLIB00017263290","spectrum_index":27599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381059-01!5-[5-(3,5-dihydroxydecanoyloxy)-3-hydroxydecanoyl]oxy-3-hydroxydecanoic acid (delta mass: 150.1039 Da; putative annotation: (+)-trans-Chrysanthemic acid; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.498,"smiles":null,"spectrum_id":"CCMSLIB00017263293","spectrum_index":27600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 92.0378 Da; putative annotation: 4-Pyrimidinylmethanol; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.092,"smiles":null,"spectrum_id":"CCMSLIB00017263295","spectrum_index":27601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 294.132 Da; putative annotation: Phenylalanylphenylalanine; AIF; CE30; MS2Dec; putative formula: C18H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.223,"smiles":null,"spectrum_id":"CCMSLIB00017263298","spectrum_index":27602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 162.0319 Da; putative annotation: Caffeic Acid; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.082,"smiles":null,"spectrum_id":"CCMSLIB00017263300","spectrum_index":27603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 173.1204 Da; putative annotation: 3-Methylbuphedrone; putative formula: C12H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.269,"smiles":null,"spectrum_id":"CCMSLIB00017263303","spectrum_index":27604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 114.0303 Da; putative annotation: Glutaric acid; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.101,"smiles":null,"spectrum_id":"CCMSLIB00017263306","spectrum_index":27605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 308.1729 Da; putative annotation: N/A; putative formula: C18H29PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.244,"smiles":null,"spectrum_id":"CCMSLIB00017263308","spectrum_index":27606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 153.0761 Da; putative annotation: N/A; putative formula: C4H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.205,"smiles":null,"spectrum_id":"CCMSLIB00017263310","spectrum_index":27607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 971.3018 Da; putative annotation: N/A; putative formula: C39H49N13O13S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1250.4,"smiles":null,"spectrum_id":"CCMSLIB00017263313","spectrum_index":27608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 112.0518 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.153,"smiles":null,"spectrum_id":"CCMSLIB00017263316","spectrum_index":27609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 372.2123 Da; putative annotation: N/A; putative formula: C23H32O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.304,"smiles":null,"spectrum_id":"CCMSLIB00017263319","spectrum_index":27610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 17.0113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.15,"smiles":null,"spectrum_id":"CCMSLIB00017263320","spectrum_index":27611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 341.3103 Da; putative annotation: N/A; putative formula: C21H43NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.382,"smiles":null,"spectrum_id":"CCMSLIB00017263323","spectrum_index":27612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match] (delta mass: 422.2671 Da; putative annotation: N/A; putative formula: C24H38O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":751.536,"smiles":null,"spectrum_id":"CCMSLIB00017263326","spectrum_index":27613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.102,"smiles":null,"spectrum_id":"CCMSLIB00017263329","spectrum_index":27614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 78.0107 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.161,"smiles":null,"spectrum_id":"CCMSLIB00017263330","spectrum_index":27615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 102.0527 Da; putative annotation: N/A; putative formula: C2H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.191,"smiles":null,"spectrum_id":"CCMSLIB00017263333","spectrum_index":27616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP022901 D-Sorbitol|Sorbo|(3S,4S,5R)-hexane-1,2,3,4,5,6-hexol (delta mass: 146.0358 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.122,"smiles":null,"spectrum_id":"CCMSLIB00017263336","spectrum_index":27617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 40.0211 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.108,"smiles":null,"spectrum_id":"CCMSLIB00017263339","spectrum_index":27618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 104.0702 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.157,"smiles":null,"spectrum_id":"CCMSLIB00017263340","spectrum_index":27619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 240.1884 Da; putative annotation: N/A; putative formula: C18H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.312,"smiles":null,"spectrum_id":"CCMSLIB00017263343","spectrum_index":27620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 586.219 Da; putative annotation: N/A; putative formula: C39H30N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1121.49,"smiles":null,"spectrum_id":"CCMSLIB00017263346","spectrum_index":27621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MELIBIOSE (delta mass: 158.035 Da; putative annotation: N/A; putative formula: C4H7N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.159,"smiles":null,"spectrum_id":"CCMSLIB00017263349","spectrum_index":27622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 102.0238 Da; putative annotation: N/A; putative formula: C4H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.216,"smiles":null,"spectrum_id":"CCMSLIB00017263350","spectrum_index":27623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 11.016 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.066,"smiles":null,"spectrum_id":"CCMSLIB00017263353","spectrum_index":27624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 12.0551 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.12,"smiles":null,"spectrum_id":"CCMSLIB00017263356","spectrum_index":27625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 41.0373 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.108,"smiles":null,"spectrum_id":"CCMSLIB00017263357","spectrum_index":27626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 64.0676 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.294,"smiles":null,"spectrum_id":"CCMSLIB00017263360","spectrum_index":27627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 572.3345 Da; putative annotation: N/A; putative formula: C28H53N4O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.405,"smiles":null,"spectrum_id":"CCMSLIB00017263363","spectrum_index":27628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxobenzo[cd]indol-1(2H)-yl)acetic acid (delta mass: 41.1567 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.222,"smiles":null,"spectrum_id":"CCMSLIB00017263364","spectrum_index":27629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 225.1461 Da; putative annotation: N/A; putative formula: C11H19N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.227,"smiles":null,"spectrum_id":"CCMSLIB00017263367","spectrum_index":27630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 399.0823 Da; putative annotation: N/A; putative formula: C18H17N5O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.18,"smiles":null,"spectrum_id":"CCMSLIB00017263368","spectrum_index":27631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Dimethyl-4-nitro-1H-pyrazole-5-carboxylic acid (delta mass: 32.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017263371","spectrum_index":27632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-anilino-4(3H)-quinazolinone (delta mass: 220.055 Da; putative annotation: N/A; putative formula: C14H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.163,"smiles":null,"spectrum_id":"CCMSLIB00017263374","spectrum_index":27633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 692.3371 Da; putative annotation: N/A; putative formula: C45H48N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1019.47,"smiles":null,"spectrum_id":"CCMSLIB00017263376","spectrum_index":27634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 177.0794 Da; putative annotation: N/A; putative formula: C3H11N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.129,"smiles":null,"spectrum_id":"CCMSLIB00017263379","spectrum_index":27635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 187.1365 Da; putative annotation: N/A; putative formula: C13H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.186,"smiles":null,"spectrum_id":"CCMSLIB00017263381","spectrum_index":27636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isonicotinamide (delta mass: 28.0408 Da; putative annotation: N/A; putative formula: CH4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.096,"smiles":null,"spectrum_id":"CCMSLIB00017263383","spectrum_index":27637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of imbricatine (delta mass: 13.006 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.103,"smiles":null,"spectrum_id":"CCMSLIB00017263386","spectrum_index":27638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Isobutyl-2-(2-methyl-1H-indol-1-yl)acetamide (delta mass: 31.0452 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.21,"smiles":null,"spectrum_id":"CCMSLIB00017263389","spectrum_index":27639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 669.4837 Da; putative annotation: N/A; putative formula: C39H75NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.554,"smiles":null,"spectrum_id":"CCMSLIB00017263390","spectrum_index":27640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 503.1997 Da; putative annotation: N/A; putative formula: C35H25N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.239,"smiles":null,"spectrum_id":"CCMSLIB00017263393","spectrum_index":27641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 84.0559 Da; putative annotation: N/A; putative formula: CH4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.12,"smiles":null,"spectrum_id":"CCMSLIB00017263396","spectrum_index":27642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 144.0525 Da; putative annotation: N/A; putative formula: C7H13O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.134,"smiles":null,"spectrum_id":"CCMSLIB00017263397","spectrum_index":27643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 119.7632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.841,"smiles":null,"spectrum_id":"CCMSLIB00017263400","spectrum_index":27644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethoxy-2(1H)-quinolinone (delta mass: 670.2843 Da; putative annotation: N/A; putative formula: C46H34N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":876.365,"smiles":null,"spectrum_id":"CCMSLIB00017263402","spectrum_index":27645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 18.001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.103,"smiles":null,"spectrum_id":"CCMSLIB00017263404","spectrum_index":27646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 23.0162 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.071,"smiles":null,"spectrum_id":"CCMSLIB00017263407","spectrum_index":27647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 241.056 Da; putative annotation: N/A; putative formula: C6H7N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.158,"smiles":null,"spectrum_id":"CCMSLIB00017263410","spectrum_index":27648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 119.0735 Da; putative annotation: N/A; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.165,"smiles":null,"spectrum_id":"CCMSLIB00017263411","spectrum_index":27649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-proline (delta mass: 122.0212 Da; putative annotation: N/A; putative formula: C3H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.107,"smiles":null,"spectrum_id":"CCMSLIB00017263414","spectrum_index":27650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 64.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.221,"smiles":null,"spectrum_id":"CCMSLIB00017263417","spectrum_index":27651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 90.0471 Da; putative annotation: N/A; putative formula: C7H6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.129,"smiles":null,"spectrum_id":"CCMSLIB00017263418","spectrum_index":27652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gln (delta mass: 110.051 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.17,"smiles":null,"spectrum_id":"CCMSLIB00017263421","spectrum_index":27653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 110.9897 Da; putative annotation: N/A; putative formula: C3HN3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.107,"smiles":null,"spectrum_id":"CCMSLIB00017263424","spectrum_index":27654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 103.0633 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.117,"smiles":null,"spectrum_id":"CCMSLIB00017263427","spectrum_index":27655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 123.9925 Da; putative annotation: N/A; putative formula: C2H5O4P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.053,"smiles":null,"spectrum_id":"CCMSLIB00017263428","spectrum_index":27656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 132.1129 Da; putative annotation: N/A; putative formula: C3H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.173,"smiles":null,"spectrum_id":"CCMSLIB00017263431","spectrum_index":27657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 120.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.132,"smiles":null,"spectrum_id":"CCMSLIB00017263434","spectrum_index":27658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 917.4898 Da; putative annotation: N/A; putative formula: C48H67N7O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1098.56,"smiles":null,"spectrum_id":"CCMSLIB00017263437","spectrum_index":27659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Blood Group H Trisaccharide (delta mass: 492.1421 Da; putative annotation: N/A; putative formula: C27H24O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1022.35,"smiles":null,"spectrum_id":"CCMSLIB00017263439","spectrum_index":27660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 191.097 Da; putative annotation: N/A; putative formula: C11H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.202,"smiles":null,"spectrum_id":"CCMSLIB00017263442","spectrum_index":27661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 92.0511 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017263444","spectrum_index":27662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 144.1308 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.18,"smiles":null,"spectrum_id":"CCMSLIB00017263447","spectrum_index":27663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 87.0217 Da; putative annotation: N/A; putative formula: C5HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.113,"smiles":null,"spectrum_id":"CCMSLIB00017263449","spectrum_index":27664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 94.0055 Da; putative annotation: N/A; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.107,"smiles":null,"spectrum_id":"CCMSLIB00017263452","spectrum_index":27665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 39.0452 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.096,"smiles":null,"spectrum_id":"CCMSLIB00017263455","spectrum_index":27666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 64.0537 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.15,"smiles":null,"spectrum_id":"CCMSLIB00017263456","spectrum_index":27667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 197.09 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.129,"smiles":null,"spectrum_id":"CCMSLIB00017263459","spectrum_index":27668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 190.075 Da; putative annotation: N/A; putative formula: C10H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.156,"smiles":null,"spectrum_id":"CCMSLIB00017263461","spectrum_index":27669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 390.3776 Da; putative annotation: N/A; putative formula: C27H51O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.444,"smiles":null,"spectrum_id":"CCMSLIB00017263464","spectrum_index":27670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300892 Cinchonine (delta mass: 44.0358 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.216,"smiles":null,"spectrum_id":"CCMSLIB00017263467","spectrum_index":27671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100300 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole (delta mass: 1.5377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.585,"smiles":null,"spectrum_id":"CCMSLIB00017263469","spectrum_index":27672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 58.0887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.128,"smiles":null,"spectrum_id":"CCMSLIB00017263472","spectrum_index":27673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 72.0456 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.122,"smiles":null,"spectrum_id":"CCMSLIB00017263474","spectrum_index":27674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 103.0252 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.09,"smiles":null,"spectrum_id":"CCMSLIB00017263477","spectrum_index":27675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371604 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 37.0353 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.106,"smiles":null,"spectrum_id":"CCMSLIB00017263478","spectrum_index":27676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 35.0772 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.169,"smiles":null,"spectrum_id":"CCMSLIB00017263481","spectrum_index":27677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 87.0684 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.128,"smiles":null,"spectrum_id":"CCMSLIB00017263484","spectrum_index":27678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 651.5504 Da; putative annotation: N/A; putative formula: C45H69N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":837.622,"smiles":null,"spectrum_id":"CCMSLIB00017263486","spectrum_index":27679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 226.0979 Da; putative annotation: N/A; putative formula: C9H15N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.195,"smiles":null,"spectrum_id":"CCMSLIB00017263489","spectrum_index":27680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 18.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017263491","spectrum_index":27681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 59.0396 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.121,"smiles":null,"spectrum_id":"CCMSLIB00017263494","spectrum_index":27682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 84.033 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.13,"smiles":null,"spectrum_id":"CCMSLIB00017263496","spectrum_index":27683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 42.0536 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.161,"smiles":null,"spectrum_id":"CCMSLIB00017263498","spectrum_index":27684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00178646-02!2,4-dihydroxyheptadecyl acetate [IIN-based: Match] (delta mass: 48.0372 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.322,"smiles":null,"spectrum_id":"CCMSLIB00017263501","spectrum_index":27685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 216.1096 Da; putative annotation: N/A; putative formula: C11H21PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.212,"smiles":null,"spectrum_id":"CCMSLIB00017263503","spectrum_index":27686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 255.2556 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.352,"smiles":null,"spectrum_id":"CCMSLIB00017263505","spectrum_index":27687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 98.0375 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.098,"smiles":null,"spectrum_id":"CCMSLIB00017263508","spectrum_index":27688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 174.1063 Da; putative annotation: N/A; putative formula: C5H14N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.261,"smiles":null,"spectrum_id":"CCMSLIB00017263510","spectrum_index":27689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 601.3227 Da; putative annotation: N/A; putative formula: C37H47NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":831.419,"smiles":null,"spectrum_id":"CCMSLIB00017263513","spectrum_index":27690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 241.9767 Da; putative annotation: N/A; putative formula: C5H11N2OPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.017,"smiles":null,"spectrum_id":"CCMSLIB00017263515","spectrum_index":27691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-Gentiobiose (delta mass: 249.174 Da; putative annotation: N/A; putative formula: C15H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.297,"smiles":null,"spectrum_id":"CCMSLIB00017263517","spectrum_index":27692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 208.2028 Da; putative annotation: N/A; putative formula: C12H24N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.372,"smiles":null,"spectrum_id":"CCMSLIB00017263520","spectrum_index":27693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-aminobenzoate (delta mass: 31.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.102,"smiles":null,"spectrum_id":"CCMSLIB00017263523","spectrum_index":27694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 54.0436 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.139,"smiles":null,"spectrum_id":"CCMSLIB00017263524","spectrum_index":27695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 15.9947 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.123,"smiles":null,"spectrum_id":"CCMSLIB00017263527","spectrum_index":27696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Ethyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)acetic acid (delta mass: 64.0194 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.128,"smiles":null,"spectrum_id":"CCMSLIB00017263530","spectrum_index":27697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Dimethyl-4-nitro-1H-pyrazole-5-carboxylic acid (delta mass: 103.1041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.155,"smiles":null,"spectrum_id":"CCMSLIB00017263531","spectrum_index":27698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 17.226 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.28,"smiles":null,"spectrum_id":"CCMSLIB00017263534","spectrum_index":27699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 88.0045 Da; putative annotation: N/A; putative formula: C5N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.101,"smiles":null,"spectrum_id":"CCMSLIB00017263536","spectrum_index":27700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 66.0107 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.097,"smiles":null,"spectrum_id":"CCMSLIB00017263539","spectrum_index":27701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 172.9607 Da; putative annotation: N/A; putative formula: C5H3NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.099,"smiles":null,"spectrum_id":"CCMSLIB00017263541","spectrum_index":27702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 208.051 Da; putative annotation: N/A; putative formula: C14H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.131,"smiles":null,"spectrum_id":"CCMSLIB00017263543","spectrum_index":27703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 212.0947 Da; putative annotation: N/A; putative formula: C13H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.181,"smiles":null,"spectrum_id":"CCMSLIB00017263546","spectrum_index":27704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 9.3694 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.44,"smiles":null,"spectrum_id":"CCMSLIB00017263548","spectrum_index":27705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 707.3744 Da; putative annotation: N/A; putative formula: C34H53N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.445,"smiles":null,"spectrum_id":"CCMSLIB00017263550","spectrum_index":27706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 72.0365 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017263553","spectrum_index":27707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 63.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.092,"smiles":null,"spectrum_id":"CCMSLIB00017263554","spectrum_index":27708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU229303 2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP)|2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine|1-methyl-6-phenylimidazo[4,5-b]pyridin-2-amine (delta mass: 44.0333 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.147,"smiles":null,"spectrum_id":"CCMSLIB00017263557","spectrum_index":27709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 64.0244 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.069,"smiles":null,"spectrum_id":"CCMSLIB00017263560","spectrum_index":27710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 103.0094 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.07,"smiles":null,"spectrum_id":"CCMSLIB00017263562","spectrum_index":27711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 280.2044 Da; putative annotation: N/A; putative formula: C17H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.27,"smiles":null,"spectrum_id":"CCMSLIB00017263564","spectrum_index":27712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 29.0265 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.118,"smiles":null,"spectrum_id":"CCMSLIB00017263567","spectrum_index":27713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 59.1311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.29,"smiles":null,"spectrum_id":"CCMSLIB00017263569","spectrum_index":27714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 469.2972 Da; putative annotation: N/A; putative formula: C24H43N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.368,"smiles":null,"spectrum_id":"CCMSLIB00017263571","spectrum_index":27715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of heliocurassavicine n-oxyde (delta mass: 319.0931 Da; putative annotation: N/A; putative formula: C14H9N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.289,"smiles":null,"spectrum_id":"CCMSLIB00017263573","spectrum_index":27716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 66.0831 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.216,"smiles":null,"spectrum_id":"CCMSLIB00017263576","spectrum_index":27717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 149.0687 Da; putative annotation: N/A; putative formula: C5H11NO4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.124,"smiles":null,"spectrum_id":"CCMSLIB00017263579","spectrum_index":27718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 53.0837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.159,"smiles":null,"spectrum_id":"CCMSLIB00017263580","spectrum_index":27719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 356.1764 Da; putative annotation: N/A; putative formula: C19H25N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.263,"smiles":null,"spectrum_id":"CCMSLIB00017263583","spectrum_index":27720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 202.0927 Da; putative annotation: N/A; putative formula: C12H14N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.216,"smiles":null,"spectrum_id":"CCMSLIB00017263586","spectrum_index":27721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucrose (delta mass: 647.2241 Da; putative annotation: N/A; putative formula: C41H33N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.348,"smiles":null,"spectrum_id":"CCMSLIB00017263588","spectrum_index":27722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 84.0573 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.117,"smiles":null,"spectrum_id":"CCMSLIB00017263590","spectrum_index":27723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 154.0991 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.268,"smiles":null,"spectrum_id":"CCMSLIB00017263593","spectrum_index":27724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 457.2103 Da; putative annotation: N/A; putative formula: C25H31NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.312,"smiles":null,"spectrum_id":"CCMSLIB00017263595","spectrum_index":27725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 16.0674 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.148,"smiles":null,"spectrum_id":"CCMSLIB00017263597","spectrum_index":27726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 128.0618 Da; putative annotation: N/A; putative formula: C4H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017263599","spectrum_index":27727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 129.9187 Da; putative annotation: N/A; putative formula: C3H-2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.01,"smiles":null,"spectrum_id":"CCMSLIB00017263602","spectrum_index":27728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine; AIF; CE30; CorrDec (delta mass: 61.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.139,"smiles":null,"spectrum_id":"CCMSLIB00017263604","spectrum_index":27729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 297.2875 Da; putative annotation: N/A; putative formula: C16H35N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.374,"smiles":null,"spectrum_id":"CCMSLIB00017263606","spectrum_index":27730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 275.1734 Da; putative annotation: N/A; putative formula: C13H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.233,"smiles":null,"spectrum_id":"CCMSLIB00017263609","spectrum_index":27731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 279.1406 Da; putative annotation: N/A; putative formula: C14H21N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.181,"smiles":null,"spectrum_id":"CCMSLIB00017263611","spectrum_index":27732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 121.0207 Da; putative annotation: N/A; putative formula: C3H9NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.112,"smiles":null,"spectrum_id":"CCMSLIB00017263613","spectrum_index":27733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 109.0637 Da; putative annotation: N/A; putative formula: C5H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.16,"smiles":null,"spectrum_id":"CCMSLIB00017263616","spectrum_index":27734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:205060 (delta mass: 44.0083 Da; putative annotation: N/A; putative formula: C2H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.068,"smiles":null,"spectrum_id":"CCMSLIB00017263619","spectrum_index":27735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 142.0972 Da; putative annotation: N/A; putative formula: C4H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.178,"smiles":null,"spectrum_id":"CCMSLIB00017263621","spectrum_index":27736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 133.0579 Da; putative annotation: N/A; putative formula: C5H13NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.113,"smiles":null,"spectrum_id":"CCMSLIB00017263624","spectrum_index":27737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 248.0991 Da; putative annotation: N/A; putative formula: C6H16N8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.186,"smiles":null,"spectrum_id":"CCMSLIB00017263626","spectrum_index":27738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 154.0207 Da; putative annotation: N/A; putative formula: C14H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.112,"smiles":null,"spectrum_id":"CCMSLIB00017263629","spectrum_index":27739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 224.1252 Da; putative annotation: N/A; putative formula: C13H22O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.232,"smiles":null,"spectrum_id":"CCMSLIB00017263631","spectrum_index":27740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 223.1211 Da; putative annotation: N/A; putative formula: C12H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.202,"smiles":null,"spectrum_id":"CCMSLIB00017263634","spectrum_index":27741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 156.0427 Da; putative annotation: N/A; putative formula: C7H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.139,"smiles":null,"spectrum_id":"CCMSLIB00017263637","spectrum_index":27742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 119.0578 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.207,"smiles":null,"spectrum_id":"CCMSLIB00017263640","spectrum_index":27743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 381.05 Da; putative annotation: N/A; putative formula: C13H15N7OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.147,"smiles":null,"spectrum_id":"CCMSLIB00017263642","spectrum_index":27744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methanesulfonamide, N-[3-(9H-carbazol-9-yl)-2-hydroxypropyl]-N-(2-furanylmethyl)- (delta mass: 260.2839 Da; putative annotation: N/A; putative formula: C20H36O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.421,"smiles":null,"spectrum_id":"CCMSLIB00017263644","spectrum_index":27745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 83.0735 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017263646","spectrum_index":27746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 968.4557 Da; putative annotation: N/A; putative formula: C53H56N14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1190.55,"smiles":null,"spectrum_id":"CCMSLIB00017263649","spectrum_index":27747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hypaphorine (delta mass: 46.0669 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.211,"smiles":null,"spectrum_id":"CCMSLIB00017263650","spectrum_index":27748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Methoxy-5H-dibenzo[b,f]azepine (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.117,"smiles":null,"spectrum_id":"CCMSLIB00017263653","spectrum_index":27749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 25.0081 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.089,"smiles":null,"spectrum_id":"CCMSLIB00017263655","spectrum_index":27750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 15.9948 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.076,"smiles":null,"spectrum_id":"CCMSLIB00017263657","spectrum_index":27751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 256.0848 Da; putative annotation: N/A; putative formula: C14H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.16,"smiles":null,"spectrum_id":"CCMSLIB00017263659","spectrum_index":27752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 84.0578 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.16,"smiles":null,"spectrum_id":"CCMSLIB00017263662","spectrum_index":27753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 294.1621 Da; putative annotation: N/A; putative formula: C20H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.242,"smiles":null,"spectrum_id":"CCMSLIB00017263664","spectrum_index":27754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 27.0928 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.134,"smiles":null,"spectrum_id":"CCMSLIB00017263667","spectrum_index":27755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 616.5521 Da; putative annotation: N/A; putative formula: C35H68N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.643,"smiles":null,"spectrum_id":"CCMSLIB00017263670","spectrum_index":27756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2,3-dione (delta mass: 15.0924 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.122,"smiles":null,"spectrum_id":"CCMSLIB00017263673","spectrum_index":27757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindole (delta mass: 30.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.128,"smiles":null,"spectrum_id":"CCMSLIB00017263676","spectrum_index":27758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 428.3294 Da; putative annotation: N/A; putative formula: C28H44O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.4,"smiles":null,"spectrum_id":"CCMSLIB00017263679","spectrum_index":27759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 54.0333 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.136,"smiles":null,"spectrum_id":"CCMSLIB00017263681","spectrum_index":27760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 122.0565 Da; putative annotation: N/A; putative formula: C8H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.137,"smiles":null,"spectrum_id":"CCMSLIB00017263683","spectrum_index":27761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 925.3277 Da; putative annotation: N/A; putative formula: C62H39N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1147.42,"smiles":null,"spectrum_id":"CCMSLIB00017263686","spectrum_index":27762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 76.0588 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.107,"smiles":null,"spectrum_id":"CCMSLIB00017263689","spectrum_index":27763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 481.3551 Da; putative annotation: N/A; putative formula: C25H48N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.451,"smiles":null,"spectrum_id":"CCMSLIB00017263691","spectrum_index":27764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 88.0498 Da; putative annotation: N/A; putative formula: H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.209,"smiles":null,"spectrum_id":"CCMSLIB00017263693","spectrum_index":27765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dichlorokynurenic acid (delta mass: 23.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.998,"smiles":null,"spectrum_id":"CCMSLIB00017263696","spectrum_index":27766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSAMINE (delta mass: 113.0835 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.17,"smiles":null,"spectrum_id":"CCMSLIB00017263699","spectrum_index":27767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 11.0007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017263700","spectrum_index":27768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 5.9958 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.066,"smiles":null,"spectrum_id":"CCMSLIB00017263703","spectrum_index":27769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 31.0408 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.19,"smiles":null,"spectrum_id":"CCMSLIB00017263706","spectrum_index":27770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 199.0456 Da; putative annotation: N/A; putative formula: C12H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.111,"smiles":null,"spectrum_id":"CCMSLIB00017263708","spectrum_index":27771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 22.8856 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.956,"smiles":null,"spectrum_id":"CCMSLIB00017263710","spectrum_index":27772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 328.4701 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.593,"smiles":null,"spectrum_id":"CCMSLIB00017263713","spectrum_index":27773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 190.8864 Da; putative annotation: N/A; putative formula: HNO3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.947,"smiles":null,"spectrum_id":"CCMSLIB00017263716","spectrum_index":27774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 215.8218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.861,"smiles":null,"spectrum_id":"CCMSLIB00017263718","spectrum_index":27775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vindolinine (delta mass: 162.0528 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.244,"smiles":null,"spectrum_id":"CCMSLIB00017263721","spectrum_index":27776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 101.0504 Da; putative annotation: N/A; putative formula: C3H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.131,"smiles":null,"spectrum_id":"CCMSLIB00017263723","spectrum_index":27777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dioxy-creatinine - 40.0 eV (delta mass: 35.0299 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.08,"smiles":null,"spectrum_id":"CCMSLIB00017263726","spectrum_index":27778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 84.0351 Da; putative annotation: N/A; putative formula: C8H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.137,"smiles":null,"spectrum_id":"CCMSLIB00017263728","spectrum_index":27779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 284.1156 Da; putative annotation: N/A; putative formula: C8H20N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.217,"smiles":null,"spectrum_id":"CCMSLIB00017263731","spectrum_index":27780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 166.279 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.376,"smiles":null,"spectrum_id":"CCMSLIB00017263733","spectrum_index":27781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 116.0439 Da; putative annotation: N/A; putative formula: CH4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.155,"smiles":null,"spectrum_id":"CCMSLIB00017263735","spectrum_index":27782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 299.2784 Da; putative annotation: D-ribo-Phytosphingosine; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":966.508,"smiles":null,"spectrum_id":"CCMSLIB00017263738","spectrum_index":27783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 145.05 Da; putative annotation: 3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.147,"smiles":null,"spectrum_id":"CCMSLIB00017263741","spectrum_index":27784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 113.0843 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017263743","spectrum_index":27785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 169.0736 Da; putative annotation: Ethyl 2-acetamido-3-oxobutanoate; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.186,"smiles":null,"spectrum_id":"CCMSLIB00017263746","spectrum_index":27786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01042 Hexahydrocurcumin (delta mass: 136.0498 Da; putative annotation: 2-(2-Hydroxyethoxy)phenol; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.23,"smiles":null,"spectrum_id":"CCMSLIB00017263749","spectrum_index":27787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 280.2385 Da; putative annotation: 6-Oxooctadecanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.314,"smiles":null,"spectrum_id":"CCMSLIB00017263751","spectrum_index":27788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 330.219 Da; putative annotation: (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid; putative formula: C21H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.343,"smiles":null,"spectrum_id":"CCMSLIB00017263753","spectrum_index":27789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 92.0259 Da; putative annotation: Hydroquinone; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.097,"smiles":null,"spectrum_id":"CCMSLIB00017263756","spectrum_index":27790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 748.4399 Da; putative annotation: NCGC00347737-02_C41H66O13_Olean-12-en-28-oic acid, 3-[(2-O-beta-D-glucopyranosyl-alpha-L-arabinopyranosyl)oxy]-23-hydroxy-, (5xi,9xi)-; putative formula: C41H64O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":929.511,"smiles":null,"spectrum_id":"CCMSLIB00017263759","spectrum_index":27791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 113.0853 Da; putative annotation: L-Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.256,"smiles":null,"spectrum_id":"CCMSLIB00017263761","spectrum_index":27792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 98.0729 Da; putative annotation: Diethylacetic acid; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.159,"smiles":null,"spectrum_id":"CCMSLIB00017263764","spectrum_index":27793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 113.0664 Da; putative annotation: N/A; putative formula: C6H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.142,"smiles":null,"spectrum_id":"CCMSLIB00017263766","spectrum_index":27794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 230.1882 Da; putative annotation: N/A; putative formula: C13H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017263768","spectrum_index":27795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 264.0748 Da; putative annotation: N/A; putative formula: C12H12N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.14,"smiles":null,"spectrum_id":"CCMSLIB00017263771","spectrum_index":27796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 972.3179 Da; putative annotation: N/A; putative formula: C50H48N6O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1153.39,"smiles":null,"spectrum_id":"CCMSLIB00017263774","spectrum_index":27797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 98.0421 Da; putative annotation: N/A; putative formula: C4H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.107,"smiles":null,"spectrum_id":"CCMSLIB00017263776","spectrum_index":27798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 1014.5024 Da; putative annotation: N/A; putative formula: C55H74N4O12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1195.57,"smiles":null,"spectrum_id":"CCMSLIB00017263779","spectrum_index":27799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 913.5033 Da; putative annotation: N/A; putative formula: C44H63N15O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1094.57,"smiles":null,"spectrum_id":"CCMSLIB00017263782","spectrum_index":27800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 666.3111 Da; putative annotation: N/A; putative formula: C31H46N4O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":995.497,"smiles":null,"spectrum_id":"CCMSLIB00017263783","spectrum_index":27801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 376.1681 Da; putative annotation: N/A; putative formula: C17H24N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.301,"smiles":null,"spectrum_id":"CCMSLIB00017263786","spectrum_index":27802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 83.9918 Da; putative annotation: N/A; putative formula: CN4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.058,"smiles":null,"spectrum_id":"CCMSLIB00017263789","spectrum_index":27803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 50.0522 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.176,"smiles":null,"spectrum_id":"CCMSLIB00017263792","spectrum_index":27804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 233.0904 Da; putative annotation: N/A; putative formula: C9H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.166,"smiles":null,"spectrum_id":"CCMSLIB00017263794","spectrum_index":27805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 106.05 Da; putative annotation: N/A; putative formula: CH6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.137,"smiles":null,"spectrum_id":"CCMSLIB00017263797","spectrum_index":27806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 130.1512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017263799","spectrum_index":27807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 16.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.212,"smiles":null,"spectrum_id":"CCMSLIB00017263801","spectrum_index":27808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000190 Meleagrin|Meleagrine (delta mass: 260.1053 Da; putative annotation: N/A; putative formula: C8H16N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.288,"smiles":null,"spectrum_id":"CCMSLIB00017263804","spectrum_index":27809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 190.1359 Da; putative annotation: N/A; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.217,"smiles":null,"spectrum_id":"CCMSLIB00017263806","spectrum_index":27810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 103.1935 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.274,"smiles":null,"spectrum_id":"CCMSLIB00017263808","spectrum_index":27811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 72.0773 Da; putative annotation: N/A; putative formula: C2H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.143,"smiles":null,"spectrum_id":"CCMSLIB00017263811","spectrum_index":27812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Methionine (delta mass: 60.0031 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.061,"smiles":null,"spectrum_id":"CCMSLIB00017263814","spectrum_index":27813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 632.2062 Da; putative annotation: N/A; putative formula: C32H36N6O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.266,"smiles":null,"spectrum_id":"CCMSLIB00017263817","spectrum_index":27814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 34.0054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017263819","spectrum_index":27815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 87.08 Da; putative annotation: N/A; putative formula: C3H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.145,"smiles":null,"spectrum_id":"CCMSLIB00017263821","spectrum_index":27816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 387.1998 Da; putative annotation: N/A; putative formula: C19H34NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.291,"smiles":null,"spectrum_id":"CCMSLIB00017263824","spectrum_index":27817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 356.1324 Da; putative annotation: N/A; putative formula: C16H25N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.214,"smiles":null,"spectrum_id":"CCMSLIB00017263827","spectrum_index":27818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 164.2139 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.274,"smiles":null,"spectrum_id":"CCMSLIB00017263829","spectrum_index":27819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 61.0133 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.089,"smiles":null,"spectrum_id":"CCMSLIB00017263831","spectrum_index":27820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 765.4147 Da; putative annotation: N/A; putative formula: C49H55N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.485,"smiles":null,"spectrum_id":"CCMSLIB00017263834","spectrum_index":27821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 566.469 Da; putative annotation: N/A; putative formula: C38H62O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.54,"smiles":null,"spectrum_id":"CCMSLIB00017263837","spectrum_index":27822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 144.1144 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017263839","spectrum_index":27823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dichlorokynurenic acid (delta mass: 16.9613 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.933,"smiles":null,"spectrum_id":"CCMSLIB00017263841","spectrum_index":27824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 47.0451 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.105,"smiles":null,"spectrum_id":"CCMSLIB00017263844","spectrum_index":27825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 41.0151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.112,"smiles":null,"spectrum_id":"CCMSLIB00017263846","spectrum_index":27826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 123.5832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.659,"smiles":null,"spectrum_id":"CCMSLIB00017263849","spectrum_index":27827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-[4-(Dimethylamino)benzylidene]-1,3-dihydro-2H-indol-2-one (delta mass: 15.0217 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.155,"smiles":null,"spectrum_id":"CCMSLIB00017263851","spectrum_index":27828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 93.9939 Da; putative annotation: N/A; putative formula: H3N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.085,"smiles":null,"spectrum_id":"CCMSLIB00017263854","spectrum_index":27829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 46.0208 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.113,"smiles":null,"spectrum_id":"CCMSLIB00017263856","spectrum_index":27830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 55.9903 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.066,"smiles":null,"spectrum_id":"CCMSLIB00017263858","spectrum_index":27831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 294.1 Da; putative annotation: N/A; putative formula: C9H18N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.224,"smiles":null,"spectrum_id":"CCMSLIB00017263861","spectrum_index":27832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 34.0386 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.146,"smiles":null,"spectrum_id":"CCMSLIB00017263864","spectrum_index":27833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 116.0497 Da; putative annotation: N/A; putative formula: C4H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.128,"smiles":null,"spectrum_id":"CCMSLIB00017263866","spectrum_index":27834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 73.0166 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.113,"smiles":null,"spectrum_id":"CCMSLIB00017263869","spectrum_index":27835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 296.1447 Da; putative annotation: N/A; putative formula: C16H24O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.247,"smiles":null,"spectrum_id":"CCMSLIB00017263871","spectrum_index":27836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 155.0685 Da; putative annotation: N/A; putative formula: C6H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.161,"smiles":null,"spectrum_id":"CCMSLIB00017263873","spectrum_index":27837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 173.1032 Da; putative annotation: N/A; putative formula: C4H11N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.19,"smiles":null,"spectrum_id":"CCMSLIB00017263876","spectrum_index":27838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amlexanox (delta mass: 258.1181 Da; putative annotation: N/A; putative formula: C9H19N6O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.221,"smiles":null,"spectrum_id":"CCMSLIB00017263879","spectrum_index":27839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.122,"smiles":null,"spectrum_id":"CCMSLIB00017263880","spectrum_index":27840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 10.0855 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.161,"smiles":null,"spectrum_id":"CCMSLIB00017263883","spectrum_index":27841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.154,"smiles":null,"spectrum_id":"CCMSLIB00017263886","spectrum_index":27842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 49.0316 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017263887","spectrum_index":27843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 99.0662 Da; putative annotation: N/A; putative formula: CH5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.132,"smiles":null,"spectrum_id":"CCMSLIB00017263890","spectrum_index":27844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 166.109 Da; putative annotation: N/A; putative formula: C5H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.196,"smiles":null,"spectrum_id":"CCMSLIB00017263893","spectrum_index":27845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zinterol (delta mass: 37.081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.25,"smiles":null,"spectrum_id":"CCMSLIB00017263894","spectrum_index":27846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385408-01_C17H17N5O2_3-(1H-Imidazol-4-ylmethyl)-6-(1H-indol-3-ylmethyl)-2,5-piperazinedione (delta mass: 98.0768 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.222,"smiles":null,"spectrum_id":"CCMSLIB00017263897","spectrum_index":27847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxindole CollisionEnergy:205060 (delta mass: 148.0541 Da; putative annotation: N/A; putative formula: C2H8N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.13,"smiles":null,"spectrum_id":"CCMSLIB00017263900","spectrum_index":27848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Pro (delta mass: 71.0369 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.139,"smiles":null,"spectrum_id":"CCMSLIB00017263901","spectrum_index":27849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 18.0144 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.153,"smiles":null,"spectrum_id":"CCMSLIB00017263904","spectrum_index":27850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 71.0333 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.109,"smiles":null,"spectrum_id":"CCMSLIB00017263907","spectrum_index":27851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tapentadol (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.196,"smiles":null,"spectrum_id":"CCMSLIB00017263909","spectrum_index":27852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrexone (delta mass: 59.0587 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.229,"smiles":null,"spectrum_id":"CCMSLIB00017263911","spectrum_index":27853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Leu (delta mass: 281.1733 Da; putative annotation: N/A; putative formula: C16H28NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.328,"smiles":null,"spectrum_id":"CCMSLIB00017263914","spectrum_index":27854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 125.0481 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.108,"smiles":null,"spectrum_id":"CCMSLIB00017263917","spectrum_index":27855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 771.2235 Da; putative annotation: N/A; putative formula: C55H33NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1049.32,"smiles":null,"spectrum_id":"CCMSLIB00017263919","spectrum_index":27856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 76.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.201,"smiles":null,"spectrum_id":"CCMSLIB00017263922","spectrum_index":27857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 382.1417 Da; putative annotation: N/A; putative formula: C22H22O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.202,"smiles":null,"spectrum_id":"CCMSLIB00017263923","spectrum_index":27858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 238.1318 Da; putative annotation: N/A; putative formula: C12H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.218,"smiles":null,"spectrum_id":"CCMSLIB00017263926","spectrum_index":27859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 18.1117 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.161,"smiles":null,"spectrum_id":"CCMSLIB00017263928","spectrum_index":27860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 86.0839 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.181,"smiles":null,"spectrum_id":"CCMSLIB00017263930","spectrum_index":27861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 90.083 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.154,"smiles":null,"spectrum_id":"CCMSLIB00017263933","spectrum_index":27862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 304.2391 Da; putative annotation: N/A; putative formula: C20H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.363,"smiles":null,"spectrum_id":"CCMSLIB00017263936","spectrum_index":27863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 125.0848 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.213,"smiles":null,"spectrum_id":"CCMSLIB00017263938","spectrum_index":27864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 855.4981 Da; putative annotation: N/A; putative formula: C50H65N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1036.57,"smiles":null,"spectrum_id":"CCMSLIB00017263941","spectrum_index":27865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 162.025 Da; putative annotation: N/A; putative formula: H2N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.122,"smiles":null,"spectrum_id":"CCMSLIB00017263943","spectrum_index":27866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 282.2576 Da; putative annotation: N/A; putative formula: C17H35N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.365,"smiles":null,"spectrum_id":"CCMSLIB00017263945","spectrum_index":27867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 671.2067 Da; putative annotation: N/A; putative formula: C32H38N3O9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.267,"smiles":null,"spectrum_id":"CCMSLIB00017263948","spectrum_index":27868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Imidazol-1-ylmethyl)benzoic acid (delta mass: 28.0196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.101,"smiles":null,"spectrum_id":"CCMSLIB00017263951","spectrum_index":27869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.118,"smiles":null,"spectrum_id":"CCMSLIB00017263953","spectrum_index":27870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 147.0452 Da; putative annotation: N/A; putative formula: C5H10NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.121,"smiles":null,"spectrum_id":"CCMSLIB00017263955","spectrum_index":27871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 291.1697 Da; putative annotation: N/A; putative formula: C14H21N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.265,"smiles":null,"spectrum_id":"CCMSLIB00017263958","spectrum_index":27872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(3-Aminopropyl)-N1-methylpropane-1,3-diamine (delta mass: 162.032 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.197,"smiles":null,"spectrum_id":"CCMSLIB00017263961","spectrum_index":27873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 79.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.097,"smiles":null,"spectrum_id":"CCMSLIB00017263963","spectrum_index":27874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 95.0584 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.155,"smiles":null,"spectrum_id":"CCMSLIB00017263966","spectrum_index":27875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 240.1744 Da; putative annotation: N/A; putative formula: C15H20N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.225,"smiles":null,"spectrum_id":"CCMSLIB00017263969","spectrum_index":27876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 52.0316 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.145,"smiles":null,"spectrum_id":"CCMSLIB00017263970","spectrum_index":27877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 208.1822 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.315,"smiles":null,"spectrum_id":"CCMSLIB00017263973","spectrum_index":27878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 71.035 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.085,"smiles":null,"spectrum_id":"CCMSLIB00017263976","spectrum_index":27879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5-Hexadien-3-ol (delta mass: 7.9898 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":107.07,"smiles":null,"spectrum_id":"CCMSLIB00017263979","spectrum_index":27880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 124.0636 Da; putative annotation: N/A; putative formula: C6H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.233,"smiles":null,"spectrum_id":"CCMSLIB00017263981","spectrum_index":27881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 211.0676 Da; putative annotation: N/A; putative formula: C3H5N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.107,"smiles":null,"spectrum_id":"CCMSLIB00017263984","spectrum_index":27882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zinterol (delta mass: 60.0241 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.193,"smiles":null,"spectrum_id":"CCMSLIB00017263986","spectrum_index":27883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017263989","spectrum_index":27884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 200.1787 Da; putative annotation: N/A; putative formula: C12H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.318,"smiles":null,"spectrum_id":"CCMSLIB00017263991","spectrum_index":27885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 39.0608 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.111,"smiles":null,"spectrum_id":"CCMSLIB00017263994","spectrum_index":27886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 95.155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.25,"smiles":null,"spectrum_id":"CCMSLIB00017263997","spectrum_index":27887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.077,"smiles":null,"spectrum_id":"CCMSLIB00017263999","spectrum_index":27888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 574.3504 Da; putative annotation: N/A; putative formula: C33H50O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.479,"smiles":null,"spectrum_id":"CCMSLIB00017264001","spectrum_index":27889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 322.1888 Da; putative annotation: N/A; putative formula: C19H31PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.254,"smiles":null,"spectrum_id":"CCMSLIB00017264004","spectrum_index":27890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 144.0422 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.113,"smiles":null,"spectrum_id":"CCMSLIB00017264007","spectrum_index":27891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.129,"smiles":null,"spectrum_id":"CCMSLIB00017264009","spectrum_index":27892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 211.1203 Da; putative annotation: N/A; putative formula: C11H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.243,"smiles":null,"spectrum_id":"CCMSLIB00017264012","spectrum_index":27893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 208.0584 Da; putative annotation: N/A; putative formula: C7H12O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.238,"smiles":null,"spectrum_id":"CCMSLIB00017264015","spectrum_index":27894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-acetyl-5-hydroxy-1-(2-hydroxyethyl)-2-methylindole CollisionEnergy:205060 (delta mass: 18.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.124,"smiles":null,"spectrum_id":"CCMSLIB00017264016","spectrum_index":27895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 463.161 Da; putative annotation: N/A; putative formula: C19H30NO10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":968.337,"smiles":null,"spectrum_id":"CCMSLIB00017264019","spectrum_index":27896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 45.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.19,"smiles":null,"spectrum_id":"CCMSLIB00017264022","spectrum_index":27897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 168.0938 Da; putative annotation: N/A; putative formula: C13H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.154,"smiles":null,"spectrum_id":"CCMSLIB00017264025","spectrum_index":27898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 153.0787 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.165,"smiles":null,"spectrum_id":"CCMSLIB00017264027","spectrum_index":27899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 86.0366 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.165,"smiles":null,"spectrum_id":"CCMSLIB00017264029","spectrum_index":27900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norisoboldine (delta mass: 42.008 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.147,"smiles":null,"spectrum_id":"CCMSLIB00017264032","spectrum_index":27901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 247.1266 Da; putative annotation: N/A; putative formula: C10H22N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.255,"smiles":null,"spectrum_id":"CCMSLIB00017264034","spectrum_index":27902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Leu from NIST14 (delta mass: 42.0474 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.197,"smiles":null,"spectrum_id":"CCMSLIB00017264037","spectrum_index":27903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 345.2508 Da; putative annotation: N/A; putative formula: C18H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.321,"smiles":null,"spectrum_id":"CCMSLIB00017264040","spectrum_index":27904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 417.3813 Da; putative annotation: N/A; putative formula: C25H47N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.441,"smiles":null,"spectrum_id":"CCMSLIB00017264041","spectrum_index":27905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 132.8546 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.926,"smiles":null,"spectrum_id":"CCMSLIB00017264044","spectrum_index":27906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 83.346 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.5,"smiles":null,"spectrum_id":"CCMSLIB00017264047","spectrum_index":27907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 754.451 Da; putative annotation: N/A; putative formula: C43H67N2O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":917.511,"smiles":null,"spectrum_id":"CCMSLIB00017264049","spectrum_index":27908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 305.1741 Da; putative annotation: N/A; putative formula: C16H23N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.239,"smiles":null,"spectrum_id":"CCMSLIB00017264052","spectrum_index":27909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 290.1867 Da; putative annotation: N/A; putative formula: C12H27N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.252,"smiles":null,"spectrum_id":"CCMSLIB00017264054","spectrum_index":27910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 50.0 eV (delta mass: 28.8869 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.99,"smiles":null,"spectrum_id":"CCMSLIB00017264057","spectrum_index":27911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 9.9608 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.036,"smiles":null,"spectrum_id":"CCMSLIB00017264059","spectrum_index":27912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 854.5122 Da; putative annotation: N/A; putative formula: C56H70O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1035.58,"smiles":null,"spectrum_id":"CCMSLIB00017264062","spectrum_index":27913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 626.5104 Da; putative annotation: N/A; putative formula: C34H62N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.589,"smiles":null,"spectrum_id":"CCMSLIB00017264065","spectrum_index":27914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 303.1177 Da; putative annotation: N/A; putative formula: C20H18NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.193,"smiles":null,"spectrum_id":"CCMSLIB00017264067","spectrum_index":27915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.129,"smiles":null,"spectrum_id":"CCMSLIB00017264069","spectrum_index":27916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 17.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.123,"smiles":null,"spectrum_id":"CCMSLIB00017264072","spectrum_index":27917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylecgonine (delta mass: 118.998 Da; putative annotation: N/A; putative formula: C2H5N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.126,"smiles":null,"spectrum_id":"CCMSLIB00017264075","spectrum_index":27918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 64.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.138,"smiles":null,"spectrum_id":"CCMSLIB00017264078","spectrum_index":27919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 253.2044 Da; putative annotation: N/A; putative formula: C15H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.275,"smiles":null,"spectrum_id":"CCMSLIB00017264080","spectrum_index":27920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 211.156 Da; putative annotation: N/A; putative formula: C12H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.305,"smiles":null,"spectrum_id":"CCMSLIB00017264082","spectrum_index":27921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 11.062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017264085","spectrum_index":27922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.128,"smiles":null,"spectrum_id":"CCMSLIB00017264088","spectrum_index":27923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 339.1659 Da; putative annotation: N/A; putative formula: C21H25NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.252,"smiles":null,"spectrum_id":"CCMSLIB00017264090","spectrum_index":27924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 54.0274 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.302,"smiles":null,"spectrum_id":"CCMSLIB00017264093","spectrum_index":27925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carbaldehyde (delta mass: 17.0497 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.105,"smiles":null,"spectrum_id":"CCMSLIB00017264096","spectrum_index":27926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Omeprazole sulfide (delta mass: 464.3294 Da; putative annotation: N/A; putative formula: C24H44N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":794.456,"smiles":null,"spectrum_id":"CCMSLIB00017264097","spectrum_index":27927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 168.0858 Da; putative annotation: N/A; putative formula: C4H8N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.166,"smiles":null,"spectrum_id":"CCMSLIB00017264100","spectrum_index":27928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cloethocarb (delta mass: 61.9906 Da; putative annotation: N/A; putative formula: C3H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.059,"smiles":null,"spectrum_id":"CCMSLIB00017264103","spectrum_index":27929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 103.0271 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.103,"smiles":null,"spectrum_id":"CCMSLIB00017264105","spectrum_index":27930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 143.0581 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.134,"smiles":null,"spectrum_id":"CCMSLIB00017264108","spectrum_index":27931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-nitro-1H-indole-2-carboxylate (delta mass: 46.0098 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.081,"smiles":null,"spectrum_id":"CCMSLIB00017264110","spectrum_index":27932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 133.9968 Da; putative annotation: N/A; putative formula: C4H9O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.146,"smiles":null,"spectrum_id":"CCMSLIB00017264113","spectrum_index":27933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 200.9939 Da; putative annotation: N/A; putative formula: C5H4N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.054,"smiles":null,"spectrum_id":"CCMSLIB00017264115","spectrum_index":27934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2,2,6,6-tetramethyl-4-[3-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]butyl]cyclohex-4-ene-1,3-dione (delta mass: 17.0246 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.262,"smiles":null,"spectrum_id":"CCMSLIB00017264118","spectrum_index":27935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 135.0538 Da; putative annotation: N/A; putative formula: C4H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.141,"smiles":null,"spectrum_id":"CCMSLIB00017264121","spectrum_index":27936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 108.0573 Da; putative annotation: 6-Heptynoic acid; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.216,"smiles":null,"spectrum_id":"CCMSLIB00017264123","spectrum_index":27937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 86.0733 Da; putative annotation: Neopentyl glycol; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017264125","spectrum_index":27938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 156.1043 Da; putative annotation: Gramine; putative formula: C11H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.18,"smiles":null,"spectrum_id":"CCMSLIB00017264128","spectrum_index":27939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 188.0108 Da; putative annotation: 6-(4-Chlorophenyl)-3(2H)-pyridazinone; putative formula: C10H5ClN2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.071,"smiles":null,"spectrum_id":"CCMSLIB00017264130","spectrum_index":27940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 301.1536 Da; putative annotation: N/A; putative formula: C15H27NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.292,"smiles":null,"spectrum_id":"CCMSLIB00017264133","spectrum_index":27941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxamide, 1-pentyl-N-(phenylmethyl)- (delta mass: 115.0754 Da; putative annotation: N/A; putative formula: C4H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.272,"smiles":null,"spectrum_id":"CCMSLIB00017264135","spectrum_index":27942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 78.0358 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.175,"smiles":null,"spectrum_id":"CCMSLIB00017264137","spectrum_index":27943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 48.0215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.081,"smiles":null,"spectrum_id":"CCMSLIB00017264140","spectrum_index":27944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 59.047 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017264143","spectrum_index":27945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 283.288 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.411,"smiles":null,"spectrum_id":"CCMSLIB00017264144","spectrum_index":27946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 5.0015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.156,"smiles":null,"spectrum_id":"CCMSLIB00017264147","spectrum_index":27947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 220.2193 Da; putative annotation: N/A; putative formula: C16H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.332,"smiles":null,"spectrum_id":"CCMSLIB00017264150","spectrum_index":27948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl 4-amino-3-(trifluoromethyl)phenylcarbamate (delta mass: 18.0742 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017264151","spectrum_index":27949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 765.4662 Da; putative annotation: N/A; putative formula: C41H67NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.537,"smiles":null,"spectrum_id":"CCMSLIB00017264154","spectrum_index":27950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE30; CorrDec (delta mass: 46.0159 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.076,"smiles":null,"spectrum_id":"CCMSLIB00017264156","spectrum_index":27951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 366.147 Da; putative annotation: N/A; putative formula: C22H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.228,"smiles":null,"spectrum_id":"CCMSLIB00017264158","spectrum_index":27952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 246.1722 Da; putative annotation: N/A; putative formula: C15H22N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.211,"smiles":null,"spectrum_id":"CCMSLIB00017264161","spectrum_index":27953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 267.1109 Da; putative annotation: N/A; putative formula: C13H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.182,"smiles":null,"spectrum_id":"CCMSLIB00017264163","spectrum_index":27954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 95.072 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.195,"smiles":null,"spectrum_id":"CCMSLIB00017264166","spectrum_index":27955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl caffeate CollisionEnergy:205060 (delta mass: 14.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.102,"smiles":null,"spectrum_id":"CCMSLIB00017264168","spectrum_index":27956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 43.0399 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.111,"smiles":null,"spectrum_id":"CCMSLIB00017264171","spectrum_index":27957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 220.1837 Da; putative annotation: N/A; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.28,"smiles":null,"spectrum_id":"CCMSLIB00017264173","spectrum_index":27958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 255.0925 Da; putative annotation: N/A; putative formula: C14H14N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.163,"smiles":null,"spectrum_id":"CCMSLIB00017264176","spectrum_index":27959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 60.0538 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.12,"smiles":null,"spectrum_id":"CCMSLIB00017264179","spectrum_index":27960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 45.9474 Da; putative annotation: N/A; putative formula: H-2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.07,"smiles":null,"spectrum_id":"CCMSLIB00017264182","spectrum_index":27961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 176.0529 Da; putative annotation: N/A; putative formula: C6H13N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.186,"smiles":null,"spectrum_id":"CCMSLIB00017264183","spectrum_index":27962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 191.1163 Da; putative annotation: N/A; putative formula: C8H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.181,"smiles":null,"spectrum_id":"CCMSLIB00017264186","spectrum_index":27963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 107.004 Da; putative annotation: N/A; putative formula: C2H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.128,"smiles":null,"spectrum_id":"CCMSLIB00017264189","spectrum_index":27964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 49.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.155,"smiles":null,"spectrum_id":"CCMSLIB00017264191","spectrum_index":27965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 44.0378 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.125,"smiles":null,"spectrum_id":"CCMSLIB00017264193","spectrum_index":27966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 14.0243 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.1,"smiles":null,"spectrum_id":"CCMSLIB00017264196","spectrum_index":27967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 206.6451 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.768,"smiles":null,"spectrum_id":"CCMSLIB00017264199","spectrum_index":27968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 40.0426 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.113,"smiles":null,"spectrum_id":"CCMSLIB00017264201","spectrum_index":27969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 172.0729 Da; putative annotation: N/A; putative formula: C8H12O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.19,"smiles":null,"spectrum_id":"CCMSLIB00017264204","spectrum_index":27970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 234.0323 Da; putative annotation: N/A; putative formula: C7H12N2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.156,"smiles":null,"spectrum_id":"CCMSLIB00017264207","spectrum_index":27971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-7-methoxy-9H-pyrido[3,4-b]indol-8-yl)-2-methyl- (delta mass: 45.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.153,"smiles":null,"spectrum_id":"CCMSLIB00017264209","spectrum_index":27972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 64.0674 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.31,"smiles":null,"spectrum_id":"CCMSLIB00017264212","spectrum_index":27973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 43.0018 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.057,"smiles":null,"spectrum_id":"CCMSLIB00017264214","spectrum_index":27974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 143.0551 Da; putative annotation: N/A; putative formula: C2H5N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.142,"smiles":null,"spectrum_id":"CCMSLIB00017264217","spectrum_index":27975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 60.9924 Da; putative annotation: N/A; putative formula: C4H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.11,"smiles":null,"spectrum_id":"CCMSLIB00017264219","spectrum_index":27976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 64.0143 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.127,"smiles":null,"spectrum_id":"CCMSLIB00017264222","spectrum_index":27977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 23.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.118,"smiles":null,"spectrum_id":"CCMSLIB00017264224","spectrum_index":27978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 172.0523 Da; putative annotation: N/A; putative formula: C11H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.134,"smiles":null,"spectrum_id":"CCMSLIB00017264227","spectrum_index":27979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 62.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017264230","spectrum_index":27980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 271.0299 Da; putative annotation: N/A; putative formula: C6H5N7O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.09,"smiles":null,"spectrum_id":"CCMSLIB00017264232","spectrum_index":27981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Murrayafoline A (delta mass: 17.0276 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.135,"smiles":null,"spectrum_id":"CCMSLIB00017264235","spectrum_index":27982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 338.1914 Da; putative annotation: N/A; putative formula: C11H26N6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.367,"smiles":null,"spectrum_id":"CCMSLIB00017264237","spectrum_index":27983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 280.0378 Da; putative annotation: N/A; putative formula: C8H14N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.124,"smiles":null,"spectrum_id":"CCMSLIB00017264240","spectrum_index":27984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 69.0101 Da; putative annotation: N/A; putative formula: H-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.045,"smiles":null,"spectrum_id":"CCMSLIB00017264242","spectrum_index":27985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 57.0365 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.133,"smiles":null,"spectrum_id":"CCMSLIB00017264245","spectrum_index":27986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 18.0833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.149,"smiles":null,"spectrum_id":"CCMSLIB00017264248","spectrum_index":27987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 342.2138 Da; putative annotation: N/A; putative formula: C14H22N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.327,"smiles":null,"spectrum_id":"CCMSLIB00017264250","spectrum_index":27988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 182.2032 Da; putative annotation: N/A; putative formula: C13H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.268,"smiles":null,"spectrum_id":"CCMSLIB00017264253","spectrum_index":27989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 575.2065 Da; putative annotation: N/A; putative formula: C35H33N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1242.44,"smiles":null,"spectrum_id":"CCMSLIB00017264255","spectrum_index":27990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 50.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.139,"smiles":null,"spectrum_id":"CCMSLIB00017264258","spectrum_index":27991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 42.0178 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.172,"smiles":null,"spectrum_id":"CCMSLIB00017264261","spectrum_index":27992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(Benzyloxy)-1H-indole (delta mass: 17.0829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.19,"smiles":null,"spectrum_id":"CCMSLIB00017264263","spectrum_index":27993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380167-01!3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015] (delta mass: 118.041 Da; putative annotation: N/A; putative formula: C2H7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.195,"smiles":null,"spectrum_id":"CCMSLIB00017264265","spectrum_index":27994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-((7S)-10-(((2S)-1-(2-(benzo[d]thiazol-2-yl)pyrrolidin-1-yl)-4-(methylthio)-1-oxobutan-2-yl)amino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide (delta mass: 75.035 Da; putative annotation: N/A; putative formula: CH6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.297,"smiles":null,"spectrum_id":"CCMSLIB00017264268","spectrum_index":27995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 108.0999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.16,"smiles":null,"spectrum_id":"CCMSLIB00017264271","spectrum_index":27996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 389.7499 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.926,"smiles":null,"spectrum_id":"CCMSLIB00017264273","spectrum_index":27997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 281.1374 Da; putative annotation: N/A; putative formula: C13H19N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.292,"smiles":null,"spectrum_id":"CCMSLIB00017264276","spectrum_index":27998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 60.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.129,"smiles":null,"spectrum_id":"CCMSLIB00017264279","spectrum_index":27999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 97.0631 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.139,"smiles":null,"spectrum_id":"CCMSLIB00017264281","spectrum_index":28000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Skatole - 40.0 eV (delta mass: 25.0172 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.098,"smiles":null,"spectrum_id":"CCMSLIB00017264283","spectrum_index":28001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 498.2319 Da; putative annotation: N/A; putative formula: C24H39N2O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.318,"smiles":null,"spectrum_id":"CCMSLIB00017264286","spectrum_index":28002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 138.1414 Da; putative annotation: N/A; putative formula: C10H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.222,"smiles":null,"spectrum_id":"CCMSLIB00017264288","spectrum_index":28003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 158.1097 Da; putative annotation: N/A; putative formula: C12H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.18,"smiles":null,"spectrum_id":"CCMSLIB00017264291","spectrum_index":28004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 102.0454 Da; putative annotation: N/A; putative formula: C2H7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.132,"smiles":null,"spectrum_id":"CCMSLIB00017264293","spectrum_index":28005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 637.3733 Da; putative annotation: N/A; putative formula: C29H51N9O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.477,"smiles":null,"spectrum_id":"CCMSLIB00017264296","spectrum_index":28006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 322.1093 Da; putative annotation: N/A; putative formula: C14H26O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.18,"smiles":null,"spectrum_id":"CCMSLIB00017264298","spectrum_index":28007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymandelic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.055,"smiles":null,"spectrum_id":"CCMSLIB00017264301","spectrum_index":28008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 512.4438 Da; putative annotation: N/A; putative formula: C31H60O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.504,"smiles":null,"spectrum_id":"CCMSLIB00017264303","spectrum_index":28009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 163.8268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.887,"smiles":null,"spectrum_id":"CCMSLIB00017264305","spectrum_index":28010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 111.0632 Da; putative annotation: N/A; putative formula: C2H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.145,"smiles":null,"spectrum_id":"CCMSLIB00017264308","spectrum_index":28011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Fluorobenzoyl)-5-amino-1H-indole (delta mass: 9.9925 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.085,"smiles":null,"spectrum_id":"CCMSLIB00017264310","spectrum_index":28012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 416.261 Da; putative annotation: N/A; putative formula: C23H36N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.4,"smiles":null,"spectrum_id":"CCMSLIB00017264313","spectrum_index":28013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510507 Tyramine|4-(2-aminoethyl)phenol (delta mass: 312.1405 Da; putative annotation: N/A; putative formula: C17H28O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.232,"smiles":null,"spectrum_id":"CCMSLIB00017264315","spectrum_index":28014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 324.7385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.777,"smiles":null,"spectrum_id":"CCMSLIB00017264318","spectrum_index":28015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 398.1215 Da; putative annotation: N/A; putative formula: C23H20N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.27,"smiles":null,"spectrum_id":"CCMSLIB00017264320","spectrum_index":28016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 64.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017264323","spectrum_index":28017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 162.0317 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.102,"smiles":null,"spectrum_id":"CCMSLIB00017264325","spectrum_index":28018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desmethylsildenafil (delta mass: 27.0102 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.207,"smiles":null,"spectrum_id":"CCMSLIB00017264327","spectrum_index":28019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 173.0185 Da; putative annotation: N/A; putative formula: C3H3N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.167,"smiles":null,"spectrum_id":"CCMSLIB00017264330","spectrum_index":28020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 599.4776 Da; putative annotation: N/A; putative formula: C35H61N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.731,"smiles":null,"spectrum_id":"CCMSLIB00017264331","spectrum_index":28021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 22.0209 Da; putative annotation: N/A; putative formula: C3H2O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.086,"smiles":null,"spectrum_id":"CCMSLIB00017264334","spectrum_index":28022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 347.0596 Da; putative annotation: N/A; putative formula: C13H18NO6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.151,"smiles":null,"spectrum_id":"CCMSLIB00017264336","spectrum_index":28023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 311.1063 Da; putative annotation: N/A; putative formula: C12H19N5OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.166,"smiles":null,"spectrum_id":"CCMSLIB00017264339","spectrum_index":28024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 330.1312 Da; putative annotation: N/A; putative formula: C15H22O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.28,"smiles":null,"spectrum_id":"CCMSLIB00017264342","spectrum_index":28025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-2-ol (delta mass: 193.0782 Da; putative annotation: N/A; putative formula: C7H17NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.138,"smiles":null,"spectrum_id":"CCMSLIB00017264344","spectrum_index":28026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 278.0953 Da; putative annotation: N/A; putative formula: C19H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.197,"smiles":null,"spectrum_id":"CCMSLIB00017264346","spectrum_index":28027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 34.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017264349","spectrum_index":28028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 189.6637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.734,"smiles":null,"spectrum_id":"CCMSLIB00017264352","spectrum_index":28029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 96.1144 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.279,"smiles":null,"spectrum_id":"CCMSLIB00017264354","spectrum_index":28030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 158.0157 Da; putative annotation: N/A; putative formula: C13H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.169,"smiles":null,"spectrum_id":"CCMSLIB00017264357","spectrum_index":28031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 272.1693 Da; putative annotation: N/A; putative formula: C18H25P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.24,"smiles":null,"spectrum_id":"CCMSLIB00017264359","spectrum_index":28032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 44.0837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.253,"smiles":null,"spectrum_id":"CCMSLIB00017264362","spectrum_index":28033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 26.015 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.117,"smiles":null,"spectrum_id":"CCMSLIB00017264364","spectrum_index":28034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.065,"smiles":null,"spectrum_id":"CCMSLIB00017264366","spectrum_index":28035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 290.1152 Da; putative annotation: N/A; putative formula: C16H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.212,"smiles":null,"spectrum_id":"CCMSLIB00017264369","spectrum_index":28036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 459.2471 Da; putative annotation: N/A; putative formula: C25H38N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.307,"smiles":null,"spectrum_id":"CCMSLIB00017264372","spectrum_index":28037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.081,"smiles":null,"spectrum_id":"CCMSLIB00017264374","spectrum_index":28038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 203.1227 Da; putative annotation: N/A; putative formula: C13H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.218,"smiles":null,"spectrum_id":"CCMSLIB00017264376","spectrum_index":28039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmaline (delta mass: 17.9964 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.114,"smiles":null,"spectrum_id":"CCMSLIB00017264379","spectrum_index":28040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 371.0836 Da; putative annotation: N/A; putative formula: C20H21NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.218,"smiles":null,"spectrum_id":"CCMSLIB00017264382","spectrum_index":28041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C6:0 (delta mass: 212.1408 Da; putative annotation: N/A; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.301,"smiles":null,"spectrum_id":"CCMSLIB00017264384","spectrum_index":28042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 87.0321 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.202,"smiles":null,"spectrum_id":"CCMSLIB00017264387","spectrum_index":28043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 73.0878 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.148,"smiles":null,"spectrum_id":"CCMSLIB00017264389","spectrum_index":28044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 32.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.16,"smiles":null,"spectrum_id":"CCMSLIB00017264392","spectrum_index":28045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 98.1095 Da; putative annotation: N/A; putative formula: C7H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.18,"smiles":null,"spectrum_id":"CCMSLIB00017264394","spectrum_index":28046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"9H-Pyrido[3,4-B]indole CollisionEnergy:102040\"\" (delta mass: 81.9719 Da; putative annotation: N/A; putative formula: C2H-1N2P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.048,"smiles":null,"spectrum_id":"CCMSLIB00017264396","spectrum_index":28047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 251.1043 Da; putative annotation: N/A; putative formula: C8H18N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.281,"smiles":null,"spectrum_id":"CCMSLIB00017264399","spectrum_index":28048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lactulose from NIST14 (delta mass: 294.2552 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.379,"smiles":null,"spectrum_id":"CCMSLIB00017264402","spectrum_index":28049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Camalexin (delta mass: 160.0842 Da; putative annotation: N/A; putative formula: C8H17O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.132,"smiles":null,"spectrum_id":"CCMSLIB00017264404","spectrum_index":28050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 159.0844 Da; putative annotation: N/A; putative formula: C6H13N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.212,"smiles":null,"spectrum_id":"CCMSLIB00017264407","spectrum_index":28051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 183.9888 Da; putative annotation: N/A; putative formula: C4H12P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.069,"smiles":null,"spectrum_id":"CCMSLIB00017264410","spectrum_index":28052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 233.8392 Da; putative annotation: N/A; putative formula: H-2N2O3S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.915,"smiles":null,"spectrum_id":"CCMSLIB00017264411","spectrum_index":28053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paprotrain (delta mass: 143.1025 Da; putative annotation: N/A; putative formula: C2H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.205,"smiles":null,"spectrum_id":"CCMSLIB00017264414","spectrum_index":28054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 116.0557 Da; putative annotation: N/A; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.133,"smiles":null,"spectrum_id":"CCMSLIB00017264417","spectrum_index":28055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Ala (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.113,"smiles":null,"spectrum_id":"CCMSLIB00017264419","spectrum_index":28056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 56.026 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017264421","spectrum_index":28057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 13.0179 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.11,"smiles":null,"spectrum_id":"CCMSLIB00017264424","spectrum_index":28058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 134.1031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.216,"smiles":null,"spectrum_id":"CCMSLIB00017264427","spectrum_index":28059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 18.7651 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.899,"smiles":null,"spectrum_id":"CCMSLIB00017264429","spectrum_index":28060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 18.0097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.144,"smiles":null,"spectrum_id":"CCMSLIB00017264432","spectrum_index":28061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 185.9865 Da; putative annotation: N/A; putative formula: C2H7N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.067,"smiles":null,"spectrum_id":"CCMSLIB00017264435","spectrum_index":28062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 57.0357 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.086,"smiles":null,"spectrum_id":"CCMSLIB00017264436","spectrum_index":28063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 115.0268 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017264439","spectrum_index":28064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 45.0603 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.166,"smiles":null,"spectrum_id":"CCMSLIB00017264442","spectrum_index":28065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 239.0122 Da; putative annotation: N/A; putative formula: C8HN9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.099,"smiles":null,"spectrum_id":"CCMSLIB00017264443","spectrum_index":28066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 144.0423 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.102,"smiles":null,"spectrum_id":"CCMSLIB00017264446","spectrum_index":28067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 105.0564 Da; putative annotation: N/A; putative formula: CH8N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.163,"smiles":null,"spectrum_id":"CCMSLIB00017264449","spectrum_index":28068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 609.8756 Da; putative annotation: N/A; putative formula: C18H26O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.946,"smiles":null,"spectrum_id":"CCMSLIB00017264451","spectrum_index":28069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 796.3009 Da; putative annotation: N/A; putative formula: C48H40N6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1180.45,"smiles":null,"spectrum_id":"CCMSLIB00017264454","spectrum_index":28070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-(2-oxo-2-phenylethyl)-1,3-dihydro-2H-indol-2-one (delta mass: 87.0132 Da; putative annotation: N/A; putative formula: C3H5NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.11,"smiles":null,"spectrum_id":"CCMSLIB00017264457","spectrum_index":28071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 769.4544 Da; putative annotation: N/A; putative formula: C52H59N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":907.546,"smiles":null,"spectrum_id":"CCMSLIB00017264458","spectrum_index":28072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 599.3306 Da; putative annotation: N/A; putative formula: C30H49NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.391,"smiles":null,"spectrum_id":"CCMSLIB00017264461","spectrum_index":28073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 42.0215 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.108,"smiles":null,"spectrum_id":"CCMSLIB00017264464","spectrum_index":28074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 13.0315 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.165,"smiles":null,"spectrum_id":"CCMSLIB00017264466","spectrum_index":28075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 354.6887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.759,"smiles":null,"spectrum_id":"CCMSLIB00017264468","spectrum_index":28076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PAR_146.0966_8.3 (delta mass: 140.1044 Da; putative annotation: N/A; putative formula: C6H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.201,"smiles":null,"spectrum_id":"CCMSLIB00017264471","spectrum_index":28077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 486.319 Da; putative annotation: N/A; putative formula: C26H46O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.493,"smiles":null,"spectrum_id":"CCMSLIB00017264473","spectrum_index":28078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 180.004 Da; putative annotation: N/A; putative formula: C4H10N2P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.085,"smiles":null,"spectrum_id":"CCMSLIB00017264476","spectrum_index":28079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 83.9515 Da; putative annotation: N/A; putative formula: C3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.022,"smiles":null,"spectrum_id":"CCMSLIB00017264479","spectrum_index":28080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(4-Methoxyphenyl)ethyl]-3-methyl-2-butenamide (delta mass: 66.0505 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.199,"smiles":null,"spectrum_id":"CCMSLIB00017264480","spectrum_index":28081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Bromo-3,4-dihydro-2(1H)-quinazolinone (delta mass: 59.0274 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.009,"smiles":null,"spectrum_id":"CCMSLIB00017264483","spectrum_index":28082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroflavopereirine (delta mass: 32.0326 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.171,"smiles":null,"spectrum_id":"CCMSLIB00017264486","spectrum_index":28083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 21.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.06,"smiles":null,"spectrum_id":"CCMSLIB00017264489","spectrum_index":28084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 120.0571 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017264490","spectrum_index":28085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.17,"smiles":null,"spectrum_id":"CCMSLIB00017264493","spectrum_index":28086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 276.0417 Da; putative annotation: N/A; putative formula: C9H12N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.102,"smiles":null,"spectrum_id":"CCMSLIB00017264496","spectrum_index":28087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 106.0726 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.186,"smiles":null,"spectrum_id":"CCMSLIB00017264497","spectrum_index":28088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 16.8832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.985,"smiles":null,"spectrum_id":"CCMSLIB00017264500","spectrum_index":28089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 9.9839 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.07,"smiles":null,"spectrum_id":"CCMSLIB00017264503","spectrum_index":28090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 273.1205 Da; putative annotation: N/A; putative formula: C16H21NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.222,"smiles":null,"spectrum_id":"CCMSLIB00017264504","spectrum_index":28091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 132.0418 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.206,"smiles":null,"spectrum_id":"CCMSLIB00017264507","spectrum_index":28092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 111.0325 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.113,"smiles":null,"spectrum_id":"CCMSLIB00017264510","spectrum_index":28093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 132.0465 Da; putative annotation: N/A; putative formula: C3H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017264511","spectrum_index":28094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 214.0835 Da; putative annotation: N/A; putative formula: C10H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.149,"smiles":null,"spectrum_id":"CCMSLIB00017264514","spectrum_index":28095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Isovaleroylglycine (delta mass: 57.0215 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.118,"smiles":null,"spectrum_id":"CCMSLIB00017264517","spectrum_index":28096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; CorrDec (delta mass: 73.9998 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.06,"smiles":null,"spectrum_id":"CCMSLIB00017264519","spectrum_index":28097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 231.0292 Da; putative annotation: N/A; putative formula: C11H9N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.11,"smiles":null,"spectrum_id":"CCMSLIB00017264521","spectrum_index":28098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 18.0354 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.102,"smiles":null,"spectrum_id":"CCMSLIB00017264524","spectrum_index":28099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 693.2256 Da; putative annotation: N/A; putative formula: C37H35N5O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.296,"smiles":null,"spectrum_id":"CCMSLIB00017264527","spectrum_index":28100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 55.9688 Da; putative annotation: N/A; putative formula: C2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.081,"smiles":null,"spectrum_id":"CCMSLIB00017264529","spectrum_index":28101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 135.0686 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.15,"smiles":null,"spectrum_id":"CCMSLIB00017264531","spectrum_index":28102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyethyl)-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.119,"smiles":null,"spectrum_id":"CCMSLIB00017264534","spectrum_index":28103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 173.0844 Da; putative annotation: N/A; putative formula: C11H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.16,"smiles":null,"spectrum_id":"CCMSLIB00017264537","spectrum_index":28104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Untitled CollisionEnergy:205060 (delta mass: 158.1307 Da; putative annotation: N/A; putative formula: C9H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.201,"smiles":null,"spectrum_id":"CCMSLIB00017264539","spectrum_index":28105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 156.2345 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.315,"smiles":null,"spectrum_id":"CCMSLIB00017264542","spectrum_index":28106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 273.1458 Da; putative annotation: N/A; putative formula: C11H15N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.216,"smiles":null,"spectrum_id":"CCMSLIB00017264543","spectrum_index":28107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 3.9789 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.049,"smiles":null,"spectrum_id":"CCMSLIB00017264546","spectrum_index":28108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of lysergol (delta mass: 45.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.206,"smiles":null,"spectrum_id":"CCMSLIB00017264549","spectrum_index":28109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 136.0523 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.102,"smiles":null,"spectrum_id":"CCMSLIB00017264552","spectrum_index":28110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 328.1353 Da; putative annotation: N/A; putative formula: C17H28S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.258,"smiles":null,"spectrum_id":"CCMSLIB00017264553","spectrum_index":28111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 234.0719 Da; putative annotation: N/A; putative formula: C6H14N6S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.142,"smiles":null,"spectrum_id":"CCMSLIB00017264556","spectrum_index":28112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 36.0174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.098,"smiles":null,"spectrum_id":"CCMSLIB00017264559","spectrum_index":28113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-cysteine (delta mass: 275.0817 Da; putative annotation: N/A; putative formula: C13H14N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.119,"smiles":null,"spectrum_id":"CCMSLIB00017264560","spectrum_index":28114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-acetyl-4-hydroxy-1-(2-imidazol-4-ylethyl)-2-(3-methoxyphenyl)-5-oxo-3-pyrrol ine CollisionEnergy:102040 (delta mass: 275.1033 Da; putative annotation: N/A; putative formula: C13H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.248,"smiles":null,"spectrum_id":"CCMSLIB00017264563","spectrum_index":28115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 162.0533 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.145,"smiles":null,"spectrum_id":"CCMSLIB00017264567","spectrum_index":28116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 58.0414 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.159,"smiles":null,"spectrum_id":"CCMSLIB00017264569","spectrum_index":28117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 173.1201 Da; putative annotation: Pentedrone; putative formula: C12H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.269,"smiles":null,"spectrum_id":"CCMSLIB00017264572","spectrum_index":28118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 106.0417 Da; putative annotation: 2-Methylresorcinol; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.216,"smiles":null,"spectrum_id":"CCMSLIB00017264574","spectrum_index":28119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 208.1827 Da; putative annotation: Myristoleic acid; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.222,"smiles":null,"spectrum_id":"CCMSLIB00017264577","spectrum_index":28120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 129.0424 Da; putative annotation: Massbank:CE000654 Glutamate; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.113,"smiles":null,"spectrum_id":"CCMSLIB00017264579","spectrum_index":28121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 162.0524 Da; putative annotation: D-Psicose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.112,"smiles":null,"spectrum_id":"CCMSLIB00017264582","spectrum_index":28122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 98.036 Da; putative annotation: Levulinic acid; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.101,"smiles":null,"spectrum_id":"CCMSLIB00017264584","spectrum_index":28123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 254.2241 Da; putative annotation: 16-Hydroxyhexadecanoic acid; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.358,"smiles":null,"spectrum_id":"CCMSLIB00017264586","spectrum_index":28124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 108.0946 Da; putative annotation: Bicyclo[2.2.1]heptane-2-methanol; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.144,"smiles":null,"spectrum_id":"CCMSLIB00017264589","spectrum_index":28125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 186.1242 Da; putative annotation: N/A; putative formula: C6H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.294,"smiles":null,"spectrum_id":"CCMSLIB00017264592","spectrum_index":28126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 196.1487 Da; putative annotation: N/A; putative formula: C11H21N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.288,"smiles":null,"spectrum_id":"CCMSLIB00017264595","spectrum_index":28127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 116.0497 Da; putative annotation: N/A; putative formula: C4H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.125,"smiles":null,"spectrum_id":"CCMSLIB00017264597","spectrum_index":28128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine (delta mass: 127.0987 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.274,"smiles":null,"spectrum_id":"CCMSLIB00017264599","spectrum_index":28129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 146.0734 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.154,"smiles":null,"spectrum_id":"CCMSLIB00017264602","spectrum_index":28130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 145.0723 Da; putative annotation: N/A; putative formula: C2H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.2,"smiles":null,"spectrum_id":"CCMSLIB00017264604","spectrum_index":28131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 118.0265 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.086,"smiles":null,"spectrum_id":"CCMSLIB00017264606","spectrum_index":28132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 39.0767 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.21,"smiles":null,"spectrum_id":"CCMSLIB00017264609","spectrum_index":28133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 953.4988 Da; putative annotation: N/A; putative formula: C54H67N9O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1116.56,"smiles":null,"spectrum_id":"CCMSLIB00017264611","spectrum_index":28134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 751.3059 Da; putative annotation: N/A; putative formula: C50H37N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1122.45,"smiles":null,"spectrum_id":"CCMSLIB00017264613","spectrum_index":28135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 909.5092 Da; putative annotation: N/A; putative formula: C61H63N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1090.58,"smiles":null,"spectrum_id":"CCMSLIB00017264616","spectrum_index":28136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 724.2352 Da; putative annotation: N/A; putative formula: C34H32N10O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1109.4,"smiles":null,"spectrum_id":"CCMSLIB00017264619","spectrum_index":28137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 58.9496 Da; putative annotation: N/A; putative formula: H-1NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.041,"smiles":null,"spectrum_id":"CCMSLIB00017264622","spectrum_index":28138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(1H-Indol-3-yl)vinyl]isoquinoline (delta mass: 248.1515 Da; putative annotation: N/A; putative formula: C14H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.274,"smiles":null,"spectrum_id":"CCMSLIB00017264624","spectrum_index":28139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine methyl ester (delta mass: 210.1979 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.272,"smiles":null,"spectrum_id":"CCMSLIB00017264626","spectrum_index":28140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 169.0805 Da; putative annotation: N/A; putative formula: C6H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.192,"smiles":null,"spectrum_id":"CCMSLIB00017264629","spectrum_index":28141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 245.2136 Da; putative annotation: N/A; putative formula: C17H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.279,"smiles":null,"spectrum_id":"CCMSLIB00017264632","spectrum_index":28142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 43.9894 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.097,"smiles":null,"spectrum_id":"CCMSLIB00017264635","spectrum_index":28143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 145.0917 Da; putative annotation: N/A; putative formula: C7H15NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.134,"smiles":null,"spectrum_id":"CCMSLIB00017264637","spectrum_index":28144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 205.9855 Da; putative annotation: N/A; putative formula: C2H2N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.051,"smiles":null,"spectrum_id":"CCMSLIB00017264640","spectrum_index":28145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 138.0321 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.077,"smiles":null,"spectrum_id":"CCMSLIB00017264641","spectrum_index":28146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Trifluoromethylphenyl)ethylamine (delta mass: 415.2752 Da; putative annotation: N/A; putative formula: C24H38N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.359,"smiles":null,"spectrum_id":"CCMSLIB00017264644","spectrum_index":28147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 194.1097 Da; putative annotation: N/A; putative formula: C15H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017264647","spectrum_index":28148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 105.0417 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.175,"smiles":null,"spectrum_id":"CCMSLIB00017264649","spectrum_index":28149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 228.1203 Da; putative annotation: N/A; putative formula: C12H22P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.269,"smiles":null,"spectrum_id":"CCMSLIB00017264652","spectrum_index":28150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311112 Caffeoyl putrescin (isomer of 1059) (delta mass: 354.0951 Da; putative annotation: N/A; putative formula: C16H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.234,"smiles":null,"spectrum_id":"CCMSLIB00017264654","spectrum_index":28151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 8.0053 Da; putative annotation: N/A; putative formula: C2O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.065,"smiles":null,"spectrum_id":"CCMSLIB00017264657","spectrum_index":28152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipivefrine (delta mass: 28.9379 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.15,"smiles":null,"spectrum_id":"CCMSLIB00017264659","spectrum_index":28153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 82.0897 Da; putative annotation: N/A; putative formula: C5H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.15,"smiles":null,"spectrum_id":"CCMSLIB00017264662","spectrum_index":28154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 294.2205 Da; putative annotation: N/A; putative formula: C19H26N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.318,"smiles":null,"spectrum_id":"CCMSLIB00017264665","spectrum_index":28155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 194.0162 Da; putative annotation: N/A; putative formula: C8H8N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.103,"smiles":null,"spectrum_id":"CCMSLIB00017264666","spectrum_index":28156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 264.0876 Da; putative annotation: N/A; putative formula: C9H17N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.185,"smiles":null,"spectrum_id":"CCMSLIB00017264669","spectrum_index":28157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 45.0214 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017264672","spectrum_index":28158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 28.0671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.19,"smiles":null,"spectrum_id":"CCMSLIB00017264674","spectrum_index":28159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-3-ylmethanamine (delta mass: 78.0203 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017264677","spectrum_index":28160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 12.0014 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.103,"smiles":null,"spectrum_id":"CCMSLIB00017264679","spectrum_index":28161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 307.1587 Da; putative annotation: N/A; putative formula: C6H13N17O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.25,"smiles":null,"spectrum_id":"CCMSLIB00017264682","spectrum_index":28162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 180.1925 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.372,"smiles":null,"spectrum_id":"CCMSLIB00017264685","spectrum_index":28163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 130.0959 Da; putative annotation: N/A; putative formula: C3H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.224,"smiles":null,"spectrum_id":"CCMSLIB00017264687","spectrum_index":28164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 411.2268 Da; putative annotation: N/A; putative formula: C22H29N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.297,"smiles":null,"spectrum_id":"CCMSLIB00017264689","spectrum_index":28165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 849.58 Da; putative annotation: N/A; putative formula: C41H75N11O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1012.64,"smiles":null,"spectrum_id":"CCMSLIB00017264692","spectrum_index":28166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 678.49 Da; putative annotation: N/A; putative formula: C33H62N10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":859.561,"smiles":null,"spectrum_id":"CCMSLIB00017264695","spectrum_index":28167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 425.2318 Da; putative annotation: N/A; putative formula: C24H31N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.329,"smiles":null,"spectrum_id":"CCMSLIB00017264697","spectrum_index":28168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.164,"smiles":null,"spectrum_id":"CCMSLIB00017264700","spectrum_index":28169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 82.0371 Da; putative annotation: N/A; putative formula: CH2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.17,"smiles":null,"spectrum_id":"CCMSLIB00017264703","spectrum_index":28170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 217.8946 Da; putative annotation: N/A; putative formula: H-2N2O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.039,"smiles":null,"spectrum_id":"CCMSLIB00017264704","spectrum_index":28171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 133.0259 Da; putative annotation: N/A; putative formula: H4N7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.112,"smiles":null,"spectrum_id":"CCMSLIB00017264707","spectrum_index":28172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-(pyridin-3-yl)quinazolin-4-amine (delta mass: 45.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.202,"smiles":null,"spectrum_id":"CCMSLIB00017264710","spectrum_index":28173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 311.1795 Da; putative annotation: N/A; putative formula: C14H27N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.26,"smiles":null,"spectrum_id":"CCMSLIB00017264712","spectrum_index":28174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 153.1531 Da; putative annotation: N/A; putative formula: C10H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.234,"smiles":null,"spectrum_id":"CCMSLIB00017264715","spectrum_index":28175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 177.0537 Da; putative annotation: N/A; putative formula: C8H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.141,"smiles":null,"spectrum_id":"CCMSLIB00017264717","spectrum_index":28176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 18.0169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.143,"smiles":null,"spectrum_id":"CCMSLIB00017264720","spectrum_index":28177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 672.3377 Da; putative annotation: N/A; putative formula: C35H52N4O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":836.429,"smiles":null,"spectrum_id":"CCMSLIB00017264722","spectrum_index":28178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYANTHRANILATE - 20.0 eV (delta mass: 41.9668 Da; putative annotation: N/A; putative formula: H-2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.017,"smiles":null,"spectrum_id":"CCMSLIB00017264725","spectrum_index":28179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 426.3864 Da; putative annotation: N/A; putative formula: C30H50O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.478,"smiles":null,"spectrum_id":"CCMSLIB00017264728","spectrum_index":28180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltopentaose from NIST14 (delta mass: 326.1122 Da; putative annotation: N/A; putative formula: C15H22N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1155.39,"smiles":null,"spectrum_id":"CCMSLIB00017264731","spectrum_index":28181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 87.0325 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.172,"smiles":null,"spectrum_id":"CCMSLIB00017264733","spectrum_index":28182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 225.0573 Da; putative annotation: N/A; putative formula: C9H11N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.113,"smiles":null,"spectrum_id":"CCMSLIB00017264736","spectrum_index":28183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 175.0477 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.134,"smiles":null,"spectrum_id":"CCMSLIB00017264739","spectrum_index":28184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 121.8779 Da; putative annotation: N/A; putative formula: CH-2O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.938,"smiles":null,"spectrum_id":"CCMSLIB00017264741","spectrum_index":28185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidacloprid-guanidine (delta mass: 68.0628 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.137,"smiles":null,"spectrum_id":"CCMSLIB00017264743","spectrum_index":28186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Benzyloxy)-1H-indole (delta mass: 74.001 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.108,"smiles":null,"spectrum_id":"CCMSLIB00017264746","spectrum_index":28187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Longicaulenone (delta mass: 88.0066 Da; putative annotation: N/A; putative formula: C5N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017264747","spectrum_index":28188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 41.882 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.968,"smiles":null,"spectrum_id":"CCMSLIB00017264750","spectrum_index":28189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 146.2289 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.263,"smiles":null,"spectrum_id":"CCMSLIB00017264753","spectrum_index":28190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 18.065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.192,"smiles":null,"spectrum_id":"CCMSLIB00017264755","spectrum_index":28191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 146.0642 Da; putative annotation: N/A; putative formula: C10H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.218,"smiles":null,"spectrum_id":"CCMSLIB00017264758","spectrum_index":28192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 157.0449 Da; putative annotation: N/A; putative formula: C10H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.184,"smiles":null,"spectrum_id":"CCMSLIB00017264760","spectrum_index":28193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 119.0579 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.186,"smiles":null,"spectrum_id":"CCMSLIB00017264763","spectrum_index":28194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 310.319 Da; putative annotation: N/A; putative formula: C17H38N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.4,"smiles":null,"spectrum_id":"CCMSLIB00017264766","spectrum_index":28195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 260.2035 Da; putative annotation: N/A; putative formula: C12H28N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.342,"smiles":null,"spectrum_id":"CCMSLIB00017264768","spectrum_index":28196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2,3-dione (delta mass: 8.9883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.018,"smiles":null,"spectrum_id":"CCMSLIB00017264771","spectrum_index":28197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 530.285 Da; putative annotation: N/A; putative formula: C26H46N2O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.356,"smiles":null,"spectrum_id":"CCMSLIB00017264773","spectrum_index":28198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 25.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.128,"smiles":null,"spectrum_id":"CCMSLIB00017264776","spectrum_index":28199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 61.0002 Da; putative annotation: N/A; putative formula: CH3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.072,"smiles":null,"spectrum_id":"CCMSLIB00017264779","spectrum_index":28200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 89.9953 Da; putative annotation: N/A; putative formula: C2H2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.082,"smiles":null,"spectrum_id":"CCMSLIB00017264781","spectrum_index":28201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 56.0266 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.155,"smiles":null,"spectrum_id":"CCMSLIB00017264784","spectrum_index":28202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Allylphenoxy)acetic acid (delta mass: 42.0218 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.108,"smiles":null,"spectrum_id":"CCMSLIB00017264786","spectrum_index":28203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 55.9357 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.017,"smiles":null,"spectrum_id":"CCMSLIB00017264789","spectrum_index":28204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 160.0911 Da; putative annotation: N/A; putative formula: C11H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.172,"smiles":null,"spectrum_id":"CCMSLIB00017264791","spectrum_index":28205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 165.0841 Da; putative annotation: N/A; putative formula: C8H12N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.148,"smiles":null,"spectrum_id":"CCMSLIB00017264793","spectrum_index":28206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-5-carboxamide (delta mass: 26.9968 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.068,"smiles":null,"spectrum_id":"CCMSLIB00017264796","spectrum_index":28207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 56.0615 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.121,"smiles":null,"spectrum_id":"CCMSLIB00017264798","spectrum_index":28208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 156.0427 Da; putative annotation: N/A; putative formula: C8H12O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.082,"smiles":null,"spectrum_id":"CCMSLIB00017264801","spectrum_index":28209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 40.0318 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.274,"smiles":null,"spectrum_id":"CCMSLIB00017264802","spectrum_index":28210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 202.0942 Da; putative annotation: N/A; putative formula: C10H19PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.196,"smiles":null,"spectrum_id":"CCMSLIB00017264805","spectrum_index":28211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 651.3314 Da; putative annotation: N/A; putative formula: C32H45N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.402,"smiles":null,"spectrum_id":"CCMSLIB00017264808","spectrum_index":28212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 213.1307 Da; putative annotation: N/A; putative formula: C3H11N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.229,"smiles":null,"spectrum_id":"CCMSLIB00017264809","spectrum_index":28213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 211.1425 Da; putative annotation: N/A; putative formula: C9H17N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.192,"smiles":null,"spectrum_id":"CCMSLIB00017264812","spectrum_index":28214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 205.0543 Da; putative annotation: N/A; putative formula: C7H7N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.141,"smiles":null,"spectrum_id":"CCMSLIB00017264815","spectrum_index":28215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 46.0109 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.087,"smiles":null,"spectrum_id":"CCMSLIB00017264817","spectrum_index":28216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 144.065 Da; putative annotation: N/A; putative formula: C4H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.147,"smiles":null,"spectrum_id":"CCMSLIB00017264819","spectrum_index":28217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Butylbenzenesulfonamide (delta mass: 42.0445 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.134,"smiles":null,"spectrum_id":"CCMSLIB00017264822","spectrum_index":28218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 273.084 Da; putative annotation: N/A; putative formula: C15H17NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.176,"smiles":null,"spectrum_id":"CCMSLIB00017264823","spectrum_index":28219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 362.7487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.809,"smiles":null,"spectrum_id":"CCMSLIB00017264826","spectrum_index":28220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 67.0416 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.232,"smiles":null,"spectrum_id":"CCMSLIB00017264829","spectrum_index":28221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 30.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017264830","spectrum_index":28222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methylphenyl)-1H-indole (delta mass: 238.0819 Da; putative annotation: N/A; putative formula: C16H14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.194,"smiles":null,"spectrum_id":"CCMSLIB00017264833","spectrum_index":28223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 186.2209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.416,"smiles":null,"spectrum_id":"CCMSLIB00017264836","spectrum_index":28224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corynoline (delta mass: 162.148 Da; putative annotation: N/A; putative formula: C2H14N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.297,"smiles":null,"spectrum_id":"CCMSLIB00017264837","spectrum_index":28225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-(2-naphthyl)acetamide (delta mass: 158.027 Da; putative annotation: N/A; putative formula: C12H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.079,"smiles":null,"spectrum_id":"CCMSLIB00017264840","spectrum_index":28226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 26.0157 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017264843","spectrum_index":28227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 607.3355 Da; putative annotation: N/A; putative formula: C32H49NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.406,"smiles":null,"spectrum_id":"CCMSLIB00017264844","spectrum_index":28228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 302.0996 Da; putative annotation: N/A; putative formula: C18H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.234,"smiles":null,"spectrum_id":"CCMSLIB00017264847","spectrum_index":28229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380671-01!(2S)-4-hydroxy-2-(2-hydroxypropan-2-yl)-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one (delta mass: 211.069 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.176,"smiles":null,"spectrum_id":"CCMSLIB00017264850","spectrum_index":28230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 263.2612 Da; putative annotation: N/A; putative formula: C18H33N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.348,"smiles":null,"spectrum_id":"CCMSLIB00017264853","spectrum_index":28231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 281.2715 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.342,"smiles":null,"spectrum_id":"CCMSLIB00017264855","spectrum_index":28232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 110.069 Da; putative annotation: N/A; putative formula: C3H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.208,"smiles":null,"spectrum_id":"CCMSLIB00017264857","spectrum_index":28233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 89.0097 Da; putative annotation: N/A; putative formula: C2H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.097,"smiles":null,"spectrum_id":"CCMSLIB00017264860","spectrum_index":28234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2,2,2-trifluoroethanamine (delta mass: 34.0449 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.129,"smiles":null,"spectrum_id":"CCMSLIB00017264863","spectrum_index":28235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 153.1157 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.176,"smiles":null,"spectrum_id":"CCMSLIB00017264865","spectrum_index":28236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 300.0463 Da; putative annotation: N/A; putative formula: C9H12N6O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.111,"smiles":null,"spectrum_id":"CCMSLIB00017264867","spectrum_index":28237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 818.2835 Da; putative annotation: N/A; putative formula: C62H34N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1485.51,"smiles":null,"spectrum_id":"CCMSLIB00017264870","spectrum_index":28238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 72.0211 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.155,"smiles":null,"spectrum_id":"CCMSLIB00017264872","spectrum_index":28239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Tyr from NIST14 (delta mass: 17.9604 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.074,"smiles":null,"spectrum_id":"CCMSLIB00017264874","spectrum_index":28240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 96.0422 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.154,"smiles":null,"spectrum_id":"CCMSLIB00017264877","spectrum_index":28241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 290.4067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.504,"smiles":null,"spectrum_id":"CCMSLIB00017264880","spectrum_index":28242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 103.0265 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.102,"smiles":null,"spectrum_id":"CCMSLIB00017264882","spectrum_index":28243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 331.0206 Da; putative annotation: N/A; putative formula: C10H10N3O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.06,"smiles":null,"spectrum_id":"CCMSLIB00017264885","spectrum_index":28244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 162.043 Da; putative annotation: N/A; putative formula: C8H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.218,"smiles":null,"spectrum_id":"CCMSLIB00017264886","spectrum_index":28245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine (delta mass: 9.9842 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017264889","spectrum_index":28246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000086 Harmane (delta mass: 3.1287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.22,"smiles":null,"spectrum_id":"CCMSLIB00017264892","spectrum_index":28247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 149.0181 Da; putative annotation: N/A; putative formula: CH3N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.073,"smiles":null,"spectrum_id":"CCMSLIB00017264893","spectrum_index":28248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ethylimidazoleacetic acid (delta mass: 72.0216 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.087,"smiles":null,"spectrum_id":"CCMSLIB00017264896","spectrum_index":28249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 868.7202 Da; putative annotation: N/A; putative formula: C45H92N10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.83,"smiles":null,"spectrum_id":"CCMSLIB00017264899","spectrum_index":28250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 236.11 Da; putative annotation: N/A; putative formula: C11H16N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.181,"smiles":null,"spectrum_id":"CCMSLIB00017264901","spectrum_index":28251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophol (delta mass: 323.1225 Da; putative annotation: N/A; putative formula: C13H25NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.214,"smiles":null,"spectrum_id":"CCMSLIB00017264903","spectrum_index":28252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 46.0443 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.148,"smiles":null,"spectrum_id":"CCMSLIB00017264906","spectrum_index":28253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 389.3138 Da; putative annotation: N/A; putative formula: C21H43NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.385,"smiles":null,"spectrum_id":"CCMSLIB00017264908","spectrum_index":28254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 68.0252 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.133,"smiles":null,"spectrum_id":"CCMSLIB00017264911","spectrum_index":28255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 100.0275 Da; putative annotation: N/A; putative formula: C3H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.109,"smiles":null,"spectrum_id":"CCMSLIB00017264913","spectrum_index":28256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCURONOLACTONE (delta mass: 88.0578 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.108,"smiles":null,"spectrum_id":"CCMSLIB00017264916","spectrum_index":28257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 368.2882 Da; putative annotation: N/A; putative formula: C29H36O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.325,"smiles":null,"spectrum_id":"CCMSLIB00017264918","spectrum_index":28258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 100.0572 Da; putative annotation: N/A; putative formula: C4H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.105,"smiles":null,"spectrum_id":"CCMSLIB00017264921","spectrum_index":28259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylbutanoic acid (delta mass: 162.0536 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.14,"smiles":null,"spectrum_id":"CCMSLIB00017264923","spectrum_index":28260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-alpha-D-glucosamine - 40.0 eV (delta mass: 891.7229 Da; putative annotation: N/A; putative formula: C59H93N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1113.82,"smiles":null,"spectrum_id":"CCMSLIB00017264925","spectrum_index":28261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 223.2523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.328,"smiles":null,"spectrum_id":"CCMSLIB00017264928","spectrum_index":28262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 431.2732 Da; putative annotation: N/A; putative formula: C21H42N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.328,"smiles":null,"spectrum_id":"CCMSLIB00017264931","spectrum_index":28263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 102.0385 Da; putative annotation: N/A; putative formula: C2H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017264932","spectrum_index":28264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 272.2505 Da; putative annotation: N/A; putative formula: C20H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.316,"smiles":null,"spectrum_id":"CCMSLIB00017264935","spectrum_index":28265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[1-(Aminomethyl)cyclopentyl]acetic acid (delta mass: 302.297 Da; putative annotation: N/A; putative formula: C22H38)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.415,"smiles":null,"spectrum_id":"CCMSLIB00017264938","spectrum_index":28266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 105.0788 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.16,"smiles":null,"spectrum_id":"CCMSLIB00017264940","spectrum_index":28267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 83.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017264943","spectrum_index":28268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 317.1831 Da; putative annotation: N/A; putative formula: C19H29NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.254,"smiles":null,"spectrum_id":"CCMSLIB00017264945","spectrum_index":28269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 210.1981 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.279,"smiles":null,"spectrum_id":"CCMSLIB00017264948","spectrum_index":28270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 135.0898 Da; putative annotation: N/A; putative formula: C6H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.264,"smiles":null,"spectrum_id":"CCMSLIB00017264950","spectrum_index":28271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 70.078 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017264953","spectrum_index":28272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 121.0196 Da; putative annotation: N/A; putative formula: C3H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.057,"smiles":null,"spectrum_id":"CCMSLIB00017264955","spectrum_index":28273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 238.178 Da; putative annotation: N/A; putative formula: C8H18N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.368,"smiles":null,"spectrum_id":"CCMSLIB00017264958","spectrum_index":28274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 142.0993 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.222,"smiles":null,"spectrum_id":"CCMSLIB00017264960","spectrum_index":28275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 40.9985 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.111,"smiles":null,"spectrum_id":"CCMSLIB00017264963","spectrum_index":28276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-N-(4-Acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide (delta mass: 176.0435 Da; putative annotation: N/A; putative formula: C9H8N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.209,"smiles":null,"spectrum_id":"CCMSLIB00017264965","spectrum_index":28277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 544.5003 Da; putative annotation: N/A; putative formula: C40H64)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1153.77,"smiles":null,"spectrum_id":"CCMSLIB00017264968","spectrum_index":28278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 128.0584 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.229,"smiles":null,"spectrum_id":"CCMSLIB00017264970","spectrum_index":28279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 295.26 Da; putative annotation: N/A; putative formula: C13H29N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.351,"smiles":null,"spectrum_id":"CCMSLIB00017264973","spectrum_index":28280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 287.1768 Da; putative annotation: N/A; putative formula: C13H26N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.247,"smiles":null,"spectrum_id":"CCMSLIB00017264976","spectrum_index":28281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 192.0675 Da; putative annotation: N/A; putative formula: C5H12N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.149,"smiles":null,"spectrum_id":"CCMSLIB00017264978","spectrum_index":28282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-Hydroxynonenal from NIST14 (delta mass: 365.1275 Da; putative annotation: N/A; putative formula: C22H15N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.25,"smiles":null,"spectrum_id":"CCMSLIB00017264980","spectrum_index":28283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 154.1062 Da; putative annotation: N/A; putative formula: C4H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.208,"smiles":null,"spectrum_id":"CCMSLIB00017264983","spectrum_index":28284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 11.0247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.102,"smiles":null,"spectrum_id":"CCMSLIB00017264984","spectrum_index":28285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 329.1477 Da; putative annotation: N/A; putative formula: C18H24N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.208,"smiles":null,"spectrum_id":"CCMSLIB00017264987","spectrum_index":28286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 266.2612 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.373,"smiles":null,"spectrum_id":"CCMSLIB00017264990","spectrum_index":28287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 234.21 Da; putative annotation: N/A; putative formula: C15H26N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.323,"smiles":null,"spectrum_id":"CCMSLIB00017264991","spectrum_index":28288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 371.158 Da; putative annotation: N/A; putative formula: C17H25NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.239,"smiles":null,"spectrum_id":"CCMSLIB00017264994","spectrum_index":28289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 136.0426 Da; putative annotation: N/A; putative formula: C10H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.074,"smiles":null,"spectrum_id":"CCMSLIB00017264995","spectrum_index":28290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 160.0526 Da; putative annotation: (3E)-4-(3,4-Dihydroxyphenyl)-3-buten-2-one; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.113,"smiles":null,"spectrum_id":"CCMSLIB00017264998","spectrum_index":28291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 137.026 Da; putative annotation: 4-Amino-2-fluorobenzoic acid; putative formula: C7H4FNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.123,"smiles":null,"spectrum_id":"CCMSLIB00017264999","spectrum_index":28292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 161.0689 Da; putative annotation: Glucosamine - 30.0 eV; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.192,"smiles":null,"spectrum_id":"CCMSLIB00017265002","spectrum_index":28293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 298.117 Da; putative annotation: Laurycolactone B; putative formula: C18H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.267,"smiles":null,"spectrum_id":"CCMSLIB00017265004","spectrum_index":28294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 236.212 Da; putative annotation: (2R)-1-(2-Hydroxyethyl)-2,5,5,8a-tetramethyldecahydronaphthalen-2-ol; putative formula: C16H28O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.262,"smiles":null,"spectrum_id":"CCMSLIB00017265006","spectrum_index":28295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 38.0484 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.291,"smiles":null,"spectrum_id":"CCMSLIB00017265009","spectrum_index":28296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 91.0654 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.167,"smiles":null,"spectrum_id":"CCMSLIB00017265011","spectrum_index":28297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 97.9663 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.09,"smiles":null,"spectrum_id":"CCMSLIB00017265014","spectrum_index":28298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 186.0532 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.177,"smiles":null,"spectrum_id":"CCMSLIB00017265016","spectrum_index":28299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 667.2547 Da; putative annotation: N/A; putative formula: C39H45N3O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.325,"smiles":null,"spectrum_id":"CCMSLIB00017265019","spectrum_index":28300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 147.9444 Da; putative annotation: N/A; putative formula: C3O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.041,"smiles":null,"spectrum_id":"CCMSLIB00017265022","spectrum_index":28301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Gln (delta mass: 239.095 Da; putative annotation: N/A; putative formula: C15H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.23,"smiles":null,"spectrum_id":"CCMSLIB00017265024","spectrum_index":28302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 439.2208 Da; putative annotation: N/A; putative formula: C22H33NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.286,"smiles":null,"spectrum_id":"CCMSLIB00017265027","spectrum_index":28303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 41.1609 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.32,"smiles":null,"spectrum_id":"CCMSLIB00017265030","spectrum_index":28304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 287.1735 Da; putative annotation: N/A; putative formula: C14H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.234,"smiles":null,"spectrum_id":"CCMSLIB00017265031","spectrum_index":28305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine (delta mass: 63.0193 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.127,"smiles":null,"spectrum_id":"CCMSLIB00017265034","spectrum_index":28306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 156.0425 Da; putative annotation: N/A; putative formula: C7H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.082,"smiles":null,"spectrum_id":"CCMSLIB00017265037","spectrum_index":28307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 231.1552 Da; putative annotation: N/A; putative formula: C6H17N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.253,"smiles":null,"spectrum_id":"CCMSLIB00017265038","spectrum_index":28308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 72.0574 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.149,"smiles":null,"spectrum_id":"CCMSLIB00017265041","spectrum_index":28309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 15.995 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.07,"smiles":null,"spectrum_id":"CCMSLIB00017265042","spectrum_index":28310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 493.3249 Da; putative annotation: N/A; putative formula: C24H47NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.364,"smiles":null,"spectrum_id":"CCMSLIB00017265045","spectrum_index":28311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 507.2663 Da; putative annotation: N/A; putative formula: C20H33N11O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.326,"smiles":null,"spectrum_id":"CCMSLIB00017265046","spectrum_index":28312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 467.1033 Da; putative annotation: N/A; putative formula: C16H25N3O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.174,"smiles":null,"spectrum_id":"CCMSLIB00017265049","spectrum_index":28313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 927.4838 Da; putative annotation: N/A; putative formula: C45H65N15O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1090.54,"smiles":null,"spectrum_id":"CCMSLIB00017265052","spectrum_index":28314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 395.3189 Da; putative annotation: N/A; putative formula: C27H41NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.495,"smiles":null,"spectrum_id":"CCMSLIB00017265053","spectrum_index":28315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 241.2833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.381,"smiles":null,"spectrum_id":"CCMSLIB00017265056","spectrum_index":28316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 200.1414 Da; putative annotation: N/A; putative formula: C11H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.243,"smiles":null,"spectrum_id":"CCMSLIB00017265057","spectrum_index":28317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 132.0534 Da; putative annotation: N/A; putative formula: C4H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.129,"smiles":null,"spectrum_id":"CCMSLIB00017265060","spectrum_index":28318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 344.2107 Da; putative annotation: N/A; putative formula: C21H24N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.307,"smiles":null,"spectrum_id":"CCMSLIB00017265061","spectrum_index":28319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 246.2344 Da; putative annotation: N/A; putative formula: C18H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.321,"smiles":null,"spectrum_id":"CCMSLIB00017265064","spectrum_index":28320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017265067","spectrum_index":28321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 270.2346 Da; putative annotation: N/A; putative formula: C20H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.358,"smiles":null,"spectrum_id":"CCMSLIB00017265069","spectrum_index":28322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 163.0302 Da; putative annotation: N/A; putative formula: C5H9NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.185,"smiles":null,"spectrum_id":"CCMSLIB00017265071","spectrum_index":28323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 246.1455 Da; putative annotation: N/A; putative formula: C9H14N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.211,"smiles":null,"spectrum_id":"CCMSLIB00017265074","spectrum_index":28324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Laurotetanine (delta mass: 301.1578 Da; putative annotation: N/A; putative formula: C20H19N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.312,"smiles":null,"spectrum_id":"CCMSLIB00017265077","spectrum_index":28325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 180.1504 Da; putative annotation: N/A; putative formula: C12H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.268,"smiles":null,"spectrum_id":"CCMSLIB00017265079","spectrum_index":28326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 19.0042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.082,"smiles":null,"spectrum_id":"CCMSLIB00017265082","spectrum_index":28327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 63.0318 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.097,"smiles":null,"spectrum_id":"CCMSLIB00017265084","spectrum_index":28328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 136.0366 Da; putative annotation: N/A; putative formula: C4H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.123,"smiles":null,"spectrum_id":"CCMSLIB00017265087","spectrum_index":28329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 969.6952 Da; putative annotation: N/A; putative formula: C63H91N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1150.77,"smiles":null,"spectrum_id":"CCMSLIB00017265089","spectrum_index":28330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tapentadol (delta mass: 256.2415 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.427,"smiles":null,"spectrum_id":"CCMSLIB00017265092","spectrum_index":28331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 36.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.076,"smiles":null,"spectrum_id":"CCMSLIB00017265094","spectrum_index":28332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 913.6319 Da; putative annotation: N/A; putative formula: C56H75N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1094.7,"smiles":null,"spectrum_id":"CCMSLIB00017265096","spectrum_index":28333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 241.1101 Da; putative annotation: N/A; putative formula: C15H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.239,"smiles":null,"spectrum_id":"CCMSLIB00017265099","spectrum_index":28334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-[2-(phenylmethoxy)phenyl]prop-2-enoic acid CollisionEnergy:102040 (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.086,"smiles":null,"spectrum_id":"CCMSLIB00017265101","spectrum_index":28335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 9.9842 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017265103","spectrum_index":28336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 281.0124 Da; putative annotation: N/A; putative formula: C8H12NO6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.13,"smiles":null,"spectrum_id":"CCMSLIB00017265106","spectrum_index":28337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 2.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.161,"smiles":null,"spectrum_id":"CCMSLIB00017265108","spectrum_index":28338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 117.9388 Da; putative annotation: N/A; putative formula: C2O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.004,"smiles":null,"spectrum_id":"CCMSLIB00017265110","spectrum_index":28339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 197.0891 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.186,"smiles":null,"spectrum_id":"CCMSLIB00017265113","spectrum_index":28340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 111.04 Da; putative annotation: N/A; putative formula: HN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.12,"smiles":null,"spectrum_id":"CCMSLIB00017265114","spectrum_index":28341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 445.1614 Da; putative annotation: N/A; putative formula: C18H28N3O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.258,"smiles":null,"spectrum_id":"CCMSLIB00017265117","spectrum_index":28342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meropenem (delta mass: 385.1475 Da; putative annotation: N/A; putative formula: C18H28NO4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.306,"smiles":null,"spectrum_id":"CCMSLIB00017265118","spectrum_index":28343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 241.1067 Da; putative annotation: N/A; putative formula: C11H19N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.24,"smiles":null,"spectrum_id":"CCMSLIB00017265121","spectrum_index":28344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 332.0896 Da; putative annotation: N/A; putative formula: C17H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.155,"smiles":null,"spectrum_id":"CCMSLIB00017265122","spectrum_index":28345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 941.3582 Da; putative annotation: N/A; putative formula: C49H55N3O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1284.48,"smiles":null,"spectrum_id":"CCMSLIB00017265125","spectrum_index":28346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 210.1316 Da; putative annotation: N/A; putative formula: C10H18N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017265126","spectrum_index":28347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 74.0574 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.175,"smiles":null,"spectrum_id":"CCMSLIB00017265129","spectrum_index":28348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 121.0887 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.242,"smiles":null,"spectrum_id":"CCMSLIB00017265130","spectrum_index":28349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 222.0345 Da; putative annotation: N/A; putative formula: C13H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.094,"smiles":null,"spectrum_id":"CCMSLIB00017265133","spectrum_index":28350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 547.4736 Da; putative annotation: N/A; putative formula: C32H62N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.545,"smiles":null,"spectrum_id":"CCMSLIB00017265134","spectrum_index":28351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 164.0841 Da; putative annotation: N/A; putative formula: C10H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.149,"smiles":null,"spectrum_id":"CCMSLIB00017265137","spectrum_index":28352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 282.1775 Da; putative annotation: N/A; putative formula: C23H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.254,"smiles":null,"spectrum_id":"CCMSLIB00017265140","spectrum_index":28353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 367.2562 Da; putative annotation: N/A; putative formula: C14H29N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.405,"smiles":null,"spectrum_id":"CCMSLIB00017265141","spectrum_index":28354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 98.0797 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017265144","spectrum_index":28355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 66.0105 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.112,"smiles":null,"spectrum_id":"CCMSLIB00017265145","spectrum_index":28356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-n-benzoyl-2-hydroxy-2-phenylethylamine (delta mass: 15.0334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.151,"smiles":null,"spectrum_id":"CCMSLIB00017265148","spectrum_index":28357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 173.4286 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.5,"smiles":null,"spectrum_id":"CCMSLIB00017265151","spectrum_index":28358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 63.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.123,"smiles":null,"spectrum_id":"CCMSLIB00017265153","spectrum_index":28359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 135.0893 Da; putative annotation: N/A; putative formula: C6H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.228,"smiles":null,"spectrum_id":"CCMSLIB00017265155","spectrum_index":28360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 102.068 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.165,"smiles":null,"spectrum_id":"CCMSLIB00017265158","spectrum_index":28361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole_3_butyric_acid (delta mass: 73.0167 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.119,"smiles":null,"spectrum_id":"CCMSLIB00017265161","spectrum_index":28362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one (delta mass: 7.0773 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.148,"smiles":null,"spectrum_id":"CCMSLIB00017265163","spectrum_index":28363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 42.0325 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.14,"smiles":null,"spectrum_id":"CCMSLIB00017265165","spectrum_index":28364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 106.1014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.149,"smiles":null,"spectrum_id":"CCMSLIB00017265168","spectrum_index":28365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 51.0293 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.089,"smiles":null,"spectrum_id":"CCMSLIB00017265171","spectrum_index":28366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 38.9816 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.062,"smiles":null,"spectrum_id":"CCMSLIB00017265173","spectrum_index":28367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 31.0513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.132,"smiles":null,"spectrum_id":"CCMSLIB00017265176","spectrum_index":28368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 221.1362 Da; putative annotation: N/A; putative formula: C12H19N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.269,"smiles":null,"spectrum_id":"CCMSLIB00017265178","spectrum_index":28369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 64.0159 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017265181","spectrum_index":28370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 26.0054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.072,"smiles":null,"spectrum_id":"CCMSLIB00017265183","spectrum_index":28371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 156.1207 Da; putative annotation: N/A; putative formula: C8H17N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.179,"smiles":null,"spectrum_id":"CCMSLIB00017265186","spectrum_index":28372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 312.1365 Da; putative annotation: N/A; putative formula: C12H20N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.207,"smiles":null,"spectrum_id":"CCMSLIB00017265187","spectrum_index":28373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 175.1216 Da; putative annotation: N/A; putative formula: C9H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.192,"smiles":null,"spectrum_id":"CCMSLIB00017265190","spectrum_index":28374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 356.2823 Da; putative annotation: N/A; putative formula: C23H36N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.333,"smiles":null,"spectrum_id":"CCMSLIB00017265192","spectrum_index":28375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 424.2256 Da; putative annotation: N/A; putative formula: C19H32N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.296,"smiles":null,"spectrum_id":"CCMSLIB00017265194","spectrum_index":28376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 102.0763 Da; putative annotation: N/A; putative formula: H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.266,"smiles":null,"spectrum_id":"CCMSLIB00017265197","spectrum_index":28377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 93.0096 Da; putative annotation: N/A; putative formula: H4N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.07,"smiles":null,"spectrum_id":"CCMSLIB00017265199","spectrum_index":28378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 80.0263 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.107,"smiles":null,"spectrum_id":"CCMSLIB00017265202","spectrum_index":28379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 178.0901 Da; putative annotation: N/A; putative formula: C13H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.131,"smiles":null,"spectrum_id":"CCMSLIB00017265204","spectrum_index":28380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 335.1602 Da; putative annotation: N/A; putative formula: C16H25N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.231,"smiles":null,"spectrum_id":"CCMSLIB00017265206","spectrum_index":28381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 234.0816 Da; putative annotation: N/A; putative formula: C13H15O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.168,"smiles":null,"spectrum_id":"CCMSLIB00017265209","spectrum_index":28382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 168.0397 Da; putative annotation: N/A; putative formula: C12H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.121,"smiles":null,"spectrum_id":"CCMSLIB00017265210","spectrum_index":28383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00017 Biotin (delta mass: 42.0544 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.15,"smiles":null,"spectrum_id":"CCMSLIB00017265213","spectrum_index":28384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 68.0256 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.123,"smiles":null,"spectrum_id":"CCMSLIB00017265214","spectrum_index":28385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-1-yl)propanamide (delta mass: 145.0828 Da; putative annotation: N/A; putative formula: C5H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.185,"smiles":null,"spectrum_id":"CCMSLIB00017265217","spectrum_index":28386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 132.0577 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.222,"smiles":null,"spectrum_id":"CCMSLIB00017265218","spectrum_index":28387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 113.0942 Da; putative annotation: N/A; putative formula: C5H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.218,"smiles":null,"spectrum_id":"CCMSLIB00017265221","spectrum_index":28388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 242.0944 Da; putative annotation: N/A; putative formula: C15H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.16,"smiles":null,"spectrum_id":"CCMSLIB00017265224","spectrum_index":28389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 277.2284 Da; putative annotation: N/A; putative formula: C15H27N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.367,"smiles":null,"spectrum_id":"CCMSLIB00017265225","spectrum_index":28390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 186.1047 Da; putative annotation: N/A; putative formula: C13H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017265228","spectrum_index":28391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 83.0372 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017265231","spectrum_index":28392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 174.0135 Da; putative annotation: N/A; putative formula: C2H2N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.142,"smiles":null,"spectrum_id":"CCMSLIB00017265233","spectrum_index":28393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 541.179 Da; putative annotation: N/A; putative formula: C37H23N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.229,"smiles":null,"spectrum_id":"CCMSLIB00017265236","spectrum_index":28394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 732.4448 Da; putative annotation: N/A; putative formula: C39H52N14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.516,"smiles":null,"spectrum_id":"CCMSLIB00017265238","spectrum_index":28395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 131.0742 Da; putative annotation: N/A; putative formula: C9H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.176,"smiles":null,"spectrum_id":"CCMSLIB00017265241","spectrum_index":28396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 116.0629 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.158,"smiles":null,"spectrum_id":"CCMSLIB00017265243","spectrum_index":28397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 325.1468 Da; putative annotation: N/A; putative formula: C23H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.233,"smiles":null,"spectrum_id":"CCMSLIB00017265246","spectrum_index":28398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 88.0707 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.241,"smiles":null,"spectrum_id":"CCMSLIB00017265248","spectrum_index":28399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 44.0716 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.131,"smiles":null,"spectrum_id":"CCMSLIB00017265250","spectrum_index":28400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 42.0961 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.214,"smiles":null,"spectrum_id":"CCMSLIB00017265253","spectrum_index":28401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 16.0722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.115,"smiles":null,"spectrum_id":"CCMSLIB00017265256","spectrum_index":28402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 142.0409 Da; putative annotation: N/A; putative formula: C4H7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.195,"smiles":null,"spectrum_id":"CCMSLIB00017265258","spectrum_index":28403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C9:0 (delta mass: 46.0004 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.207,"smiles":null,"spectrum_id":"CCMSLIB00017265260","spectrum_index":28404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 450.2204 Da; putative annotation: N/A; putative formula: C21H39O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.312,"smiles":null,"spectrum_id":"CCMSLIB00017265263","spectrum_index":28405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amlexanox (delta mass: 45.9942 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.097,"smiles":null,"spectrum_id":"CCMSLIB00017265265","spectrum_index":28406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 34.8854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.982,"smiles":null,"spectrum_id":"CCMSLIB00017265268","spectrum_index":28407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-8H-[1,3]dioxolo[4,5-g]indole-7-carboxylic acid (delta mass: 42.0676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.023,"smiles":null,"spectrum_id":"CCMSLIB00017265269","spectrum_index":28408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 127.5159 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.607,"smiles":null,"spectrum_id":"CCMSLIB00017265272","spectrum_index":28409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetanine (delta mass: 92.1049 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.244,"smiles":null,"spectrum_id":"CCMSLIB00017265275","spectrum_index":28410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 26.9887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.064,"smiles":null,"spectrum_id":"CCMSLIB00017265277","spectrum_index":28411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 482.1734 Da; putative annotation: N/A; putative formula: C22H32N2O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.244,"smiles":null,"spectrum_id":"CCMSLIB00017265280","spectrum_index":28412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 110.0688 Da; putative annotation: N/A; putative formula: C3H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.164,"smiles":null,"spectrum_id":"CCMSLIB00017265283","spectrum_index":28413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 91.0541 Da; putative annotation: N/A; putative formula: C5H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.204,"smiles":null,"spectrum_id":"CCMSLIB00017265284","spectrum_index":28414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 226.1052 Da; putative annotation: N/A; putative formula: C11H19N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.176,"smiles":null,"spectrum_id":"CCMSLIB00017265287","spectrum_index":28415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 45.0079 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.1,"smiles":null,"spectrum_id":"CCMSLIB00017265290","spectrum_index":28416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 80.0583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.171,"smiles":null,"spectrum_id":"CCMSLIB00017265292","spectrum_index":28417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 56.0267 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017265294","spectrum_index":28418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 208.1233 Da; putative annotation: N/A; putative formula: C10H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.231,"smiles":null,"spectrum_id":"CCMSLIB00017265296","spectrum_index":28419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 17.0193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.158,"smiles":null,"spectrum_id":"CCMSLIB00017265299","spectrum_index":28420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 262.1167 Da; putative annotation: N/A; putative formula: C12H25P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.25,"smiles":null,"spectrum_id":"CCMSLIB00017265302","spectrum_index":28421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00178646-02!2,4-dihydroxyheptadecyl acetate (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.295,"smiles":null,"spectrum_id":"CCMSLIB00017265305","spectrum_index":28422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 505.2781 Da; putative annotation: N/A; putative formula: C26H39N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.364,"smiles":null,"spectrum_id":"CCMSLIB00017265308","spectrum_index":28423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 83.0371 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017265310","spectrum_index":28424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 107.0033 Da; putative annotation: N/A; putative formula: C4H2N3O-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.069,"smiles":null,"spectrum_id":"CCMSLIB00017265312","spectrum_index":28425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 20.0 eV (delta mass: 453.8884 Da; putative annotation: N/A; putative formula: C12H10N2O5S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.002,"smiles":null,"spectrum_id":"CCMSLIB00017265315","spectrum_index":28426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 206.0416 Da; putative annotation: N/A; putative formula: C11H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.133,"smiles":null,"spectrum_id":"CCMSLIB00017265318","spectrum_index":28427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 62.0589 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.154,"smiles":null,"spectrum_id":"CCMSLIB00017265320","spectrum_index":28428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 168.115 Da; putative annotation: N/A; putative formula: C10H16O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.206,"smiles":null,"spectrum_id":"CCMSLIB00017265322","spectrum_index":28429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 109.9963 Da; putative annotation: N/A; putative formula: H2N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.108,"smiles":null,"spectrum_id":"CCMSLIB00017265324","spectrum_index":28430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 385.3188 Da; putative annotation: N/A; putative formula: C22H43NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.452,"smiles":null,"spectrum_id":"CCMSLIB00017265327","spectrum_index":28431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 752.4347 Da; putative annotation: N/A; putative formula: C40H64O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.495,"smiles":null,"spectrum_id":"CCMSLIB00017265330","spectrum_index":28432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 739.4498 Da; putative annotation: N/A; putative formula: C44H61N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.51,"smiles":null,"spectrum_id":"CCMSLIB00017265331","spectrum_index":28433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl putrescine (isomer of 1173) (delta mass: 852.2474 Da; putative annotation: N/A; putative formula: C48H44N4O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1117.4,"smiles":null,"spectrum_id":"CCMSLIB00017265334","spectrum_index":28434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 228.0638 Da; putative annotation: N/A; putative formula: C11H16OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.134,"smiles":null,"spectrum_id":"CCMSLIB00017265337","spectrum_index":28435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 23.9297 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.964,"smiles":null,"spectrum_id":"CCMSLIB00017265338","spectrum_index":28436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 112.1211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.223,"smiles":null,"spectrum_id":"CCMSLIB00017265341","spectrum_index":28437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C9:0 (delta mass: 71.0736 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.301,"smiles":null,"spectrum_id":"CCMSLIB00017265343","spectrum_index":28438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 569.3322 Da; putative annotation: N/A; putative formula: C29H51N3O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.403,"smiles":null,"spectrum_id":"CCMSLIB00017265346","spectrum_index":28439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of haplamine (delta mass: 171.1263 Da; putative annotation: N/A; putative formula: C9H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.239,"smiles":null,"spectrum_id":"CCMSLIB00017265349","spectrum_index":28440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 538.3978 Da; putative annotation: N/A; putative formula: C30H54N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.495,"smiles":null,"spectrum_id":"CCMSLIB00017265350","spectrum_index":28441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 383.2201 Da; putative annotation: N/A; putative formula: C24H34NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.3,"smiles":null,"spectrum_id":"CCMSLIB00017265353","spectrum_index":28442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 165.0655 Da; putative annotation: N/A; putative formula: C6H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.204,"smiles":null,"spectrum_id":"CCMSLIB00017265356","spectrum_index":28443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 55.0768 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.093,"smiles":null,"spectrum_id":"CCMSLIB00017265357","spectrum_index":28444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 97.9763 Da; putative annotation: N/A; putative formula: C2H-2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.052,"smiles":null,"spectrum_id":"CCMSLIB00017265360","spectrum_index":28445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 43.0426 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.155,"smiles":null,"spectrum_id":"CCMSLIB00017265363","spectrum_index":28446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 61.9395 Da; putative annotation: N/A; putative formula: C26H38N8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.912,"smiles":null,"spectrum_id":"CCMSLIB00017265365","spectrum_index":28447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 49.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.092,"smiles":null,"spectrum_id":"CCMSLIB00017265367","spectrum_index":28448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 418.3453 Da; putative annotation: N/A; putative formula: C27H46O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.411,"smiles":null,"spectrum_id":"CCMSLIB00017265370","spectrum_index":28449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.087,"smiles":null,"spectrum_id":"CCMSLIB00017265371","spectrum_index":28450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 60.9905 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.062,"smiles":null,"spectrum_id":"CCMSLIB00017265374","spectrum_index":28451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 28.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.112,"smiles":null,"spectrum_id":"CCMSLIB00017265377","spectrum_index":28452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 94.1118 Da; putative annotation: N/A; putative formula: C8H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.172,"smiles":null,"spectrum_id":"CCMSLIB00017265378","spectrum_index":28453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 601.4099 Da; putative annotation: N/A; putative formula: C35H51N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.47,"smiles":null,"spectrum_id":"CCMSLIB00017265381","spectrum_index":28454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 45.919 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.984,"smiles":null,"spectrum_id":"CCMSLIB00017265383","spectrum_index":28455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epinephrine (delta mass: 202.136 Da; putative annotation: N/A; putative formula: C14H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.233,"smiles":null,"spectrum_id":"CCMSLIB00017265386","spectrum_index":28456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.18,"smiles":null,"spectrum_id":"CCMSLIB00017265389","spectrum_index":28457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 50.0 eV (delta mass: 9.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.149,"smiles":null,"spectrum_id":"CCMSLIB00017265390","spectrum_index":28458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 63.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.191,"smiles":null,"spectrum_id":"CCMSLIB00017265393","spectrum_index":28459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Pro (delta mass: 99.0688 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.224,"smiles":null,"spectrum_id":"CCMSLIB00017265395","spectrum_index":28460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 147.0326 Da; putative annotation: N/A; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.119,"smiles":null,"spectrum_id":"CCMSLIB00017265398","spectrum_index":28461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 72.0207 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.101,"smiles":null,"spectrum_id":"CCMSLIB00017265400","spectrum_index":28462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1-pentanamine (delta mass: 102.035 Da; putative annotation: N/A; putative formula: C3H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.21,"smiles":null,"spectrum_id":"CCMSLIB00017265403","spectrum_index":28463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 54.0742 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.139,"smiles":null,"spectrum_id":"CCMSLIB00017265405","spectrum_index":28464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 97.0164 Da; putative annotation: N/A; putative formula: C4H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017265407","spectrum_index":28465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 48.0403 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017265410","spectrum_index":28466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.149,"smiles":null,"spectrum_id":"CCMSLIB00017265412","spectrum_index":28467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 125.0728 Da; putative annotation: N/A; putative formula: C4H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.195,"smiles":null,"spectrum_id":"CCMSLIB00017265415","spectrum_index":28468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 90.0829 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017265417","spectrum_index":28469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 85.0528 Da; putative annotation: .gamma.-Aminobutyric acid; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.15,"smiles":null,"spectrum_id":"CCMSLIB00017265420","spectrum_index":28470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 171.0684 Da; putative annotation: Indole_3_PropionicAcid; putative formula: C11H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.197,"smiles":null,"spectrum_id":"CCMSLIB00017265422","spectrum_index":28471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311040 Threonylleucine (isomer of 809, 926) (delta mass: 214.1324 Da; putative annotation: 6-Dehydropetasol; putative formula: C15H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.282,"smiles":null,"spectrum_id":"CCMSLIB00017265425","spectrum_index":28472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 324.1049 Da; putative annotation: Maltose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.281,"smiles":null,"spectrum_id":"CCMSLIB00017265427","spectrum_index":28473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylleucine (delta mass: 113.084 Da; putative annotation: L-(+)-Leucine - 40.0 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.228,"smiles":null,"spectrum_id":"CCMSLIB00017265429","spectrum_index":28474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 81.058 Da; putative annotation: 3-Piperidone; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017265432","spectrum_index":28475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 429.4199 Da; putative annotation: N/A; putative formula: C27H51N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.532,"smiles":null,"spectrum_id":"CCMSLIB00017265433","spectrum_index":28476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 353.1669 Da; putative annotation: N/A; putative formula: C19H31NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.248,"smiles":null,"spectrum_id":"CCMSLIB00017265436","spectrum_index":28477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 200.1768 Da; putative annotation: N/A; putative formula: C12H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.273,"smiles":null,"spectrum_id":"CCMSLIB00017265439","spectrum_index":28478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamyltyrosine (delta mass: 282.254 Da; putative annotation: N/A; putative formula: C14H30N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.378,"smiles":null,"spectrum_id":"CCMSLIB00017265441","spectrum_index":28479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 419.1847 Da; putative annotation: N/A; putative formula: C24H25N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.307,"smiles":null,"spectrum_id":"CCMSLIB00017265443","spectrum_index":28480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017265446","spectrum_index":28481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 177.0637 Da; putative annotation: N/A; putative formula: C6H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.098,"smiles":null,"spectrum_id":"CCMSLIB00017265449","spectrum_index":28482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 191.0794 Da; putative annotation: N/A; putative formula: C7H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.15,"smiles":null,"spectrum_id":"CCMSLIB00017265450","spectrum_index":28483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 46.0572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017265453","spectrum_index":28484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 925.503 Da; putative annotation: N/A; putative formula: C60H67N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1118.57,"smiles":null,"spectrum_id":"CCMSLIB00017265455","spectrum_index":28485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 46.0111 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.093,"smiles":null,"spectrum_id":"CCMSLIB00017265458","spectrum_index":28486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384850-01_C25H33N5O7_2-({3-Phenyl-3-[(N-{2-[(1H-pyrrol-2-ylcarbonyl)amino]butanoyl}seryl)amino]propanoyl}amino)butanoic acid (delta mass: 515.2277 Da; putative annotation: N/A; putative formula: C27H37N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1031.47,"smiles":null,"spectrum_id":"CCMSLIB00017265460","spectrum_index":28487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 70.0785 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.186,"smiles":null,"spectrum_id":"CCMSLIB00017265463","spectrum_index":28488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 148.1687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.312,"smiles":null,"spectrum_id":"CCMSLIB00017265465","spectrum_index":28489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olaquindox (delta mass: 83.0899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.188,"smiles":null,"spectrum_id":"CCMSLIB00017265468","spectrum_index":28490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 62.0 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.092,"smiles":null,"spectrum_id":"CCMSLIB00017265471","spectrum_index":28491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 88.0456 Da; putative annotation: N/A; putative formula: C3H8N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.126,"smiles":null,"spectrum_id":"CCMSLIB00017265472","spectrum_index":28492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 47.9845 Da; putative annotation: N/A; putative formula: O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.06,"smiles":null,"spectrum_id":"CCMSLIB00017265475","spectrum_index":28493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 94.0055 Da; putative annotation: N/A; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.076,"smiles":null,"spectrum_id":"CCMSLIB00017265478","spectrum_index":28494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Ile (delta mass: 241.1408 Da; putative annotation: N/A; putative formula: C11H19N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.29,"smiles":null,"spectrum_id":"CCMSLIB00017265479","spectrum_index":28495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-pyruvic acid (delta mass: 79.9539 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.019,"smiles":null,"spectrum_id":"CCMSLIB00017265482","spectrum_index":28496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMANNOSAMINE (delta mass: 992.4722 Da; putative annotation: N/A; putative formula: C62H64N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1214.57,"smiles":null,"spectrum_id":"CCMSLIB00017265484","spectrum_index":28497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 103.0685 Da; putative annotation: N/A; putative formula: C3H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.228,"smiles":null,"spectrum_id":"CCMSLIB00017265487","spectrum_index":28498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 71.0344 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.094,"smiles":null,"spectrum_id":"CCMSLIB00017265489","spectrum_index":28499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304055 p-Coumaraldehyde (delta mass: 31.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.102,"smiles":null,"spectrum_id":"CCMSLIB00017265492","spectrum_index":28500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 170.0983 Da; putative annotation: N/A; putative formula: C7H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.237,"smiles":null,"spectrum_id":"CCMSLIB00017265494","spectrum_index":28501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 122.0328 Da; putative annotation: N/A; putative formula: C2H6N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.307,"smiles":null,"spectrum_id":"CCMSLIB00017265497","spectrum_index":28502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 59.0636 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.135,"smiles":null,"spectrum_id":"CCMSLIB00017265500","spectrum_index":28503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.081,"smiles":null,"spectrum_id":"CCMSLIB00017265501","spectrum_index":28504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin; AIF; CE10; MS2Dec (delta mass: 49.0033 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.099,"smiles":null,"spectrum_id":"CCMSLIB00017265504","spectrum_index":28505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 53.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.107,"smiles":null,"spectrum_id":"CCMSLIB00017265506","spectrum_index":28506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 140.0087 Da; putative annotation: N/A; putative formula: C10H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.137,"smiles":null,"spectrum_id":"CCMSLIB00017265508","spectrum_index":28507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 376.2817 Da; putative annotation: N/A; putative formula: C24H42O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.321,"smiles":null,"spectrum_id":"CCMSLIB00017265511","spectrum_index":28508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coniferaldehyde (delta mass: 410.1576 Da; putative annotation: N/A; putative formula: C20H26O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.228,"smiles":null,"spectrum_id":"CCMSLIB00017265514","spectrum_index":28509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 239.1007 Da; putative annotation: N/A; putative formula: C8H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.135,"smiles":null,"spectrum_id":"CCMSLIB00017265515","spectrum_index":28510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 179.1017 Da; putative annotation: N/A; putative formula: C4H13N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.163,"smiles":null,"spectrum_id":"CCMSLIB00017265518","spectrum_index":28511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 112.0676 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017265521","spectrum_index":28512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 375.2293 Da; putative annotation: N/A; putative formula: C17H34N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.342,"smiles":null,"spectrum_id":"CCMSLIB00017265523","spectrum_index":28513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 116.0839 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.196,"smiles":null,"spectrum_id":"CCMSLIB00017265525","spectrum_index":28514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 349.1243 Da; putative annotation: N/A; putative formula: C12H23N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.279,"smiles":null,"spectrum_id":"CCMSLIB00017265528","spectrum_index":28515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 799.3021 Da; putative annotation: N/A; putative formula: C57H41N3S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1026.39,"smiles":null,"spectrum_id":"CCMSLIB00017265531","spectrum_index":28516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 133.0389 Da; putative annotation: N/A; putative formula: C5H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.162,"smiles":null,"spectrum_id":"CCMSLIB00017265532","spectrum_index":28517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 99.0528 Da; putative annotation: N/A; putative formula: C2H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.222,"smiles":null,"spectrum_id":"CCMSLIB00017265535","spectrum_index":28518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 55.0471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.123,"smiles":null,"spectrum_id":"CCMSLIB00017265537","spectrum_index":28519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 80.062 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.185,"smiles":null,"spectrum_id":"CCMSLIB00017265539","spectrum_index":28520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 63.1049 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.181,"smiles":null,"spectrum_id":"CCMSLIB00017265542","spectrum_index":28521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 106.0784 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.159,"smiles":null,"spectrum_id":"CCMSLIB00017265544","spectrum_index":28522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 104.1012 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017265547","spectrum_index":28523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 54.0509 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.21,"smiles":null,"spectrum_id":"CCMSLIB00017265549","spectrum_index":28524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methylserine (delta mass: 132.0445 Da; putative annotation: N/A; putative formula: C4H9N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.11,"smiles":null,"spectrum_id":"CCMSLIB00017265552","spectrum_index":28525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 84.0612 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.2,"smiles":null,"spectrum_id":"CCMSLIB00017265554","spectrum_index":28526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxyamphetamine (delta mass: 53.0263 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.17,"smiles":null,"spectrum_id":"CCMSLIB00017265557","spectrum_index":28527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 150.081 Da; putative annotation: N/A; putative formula: C8H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.141,"smiles":null,"spectrum_id":"CCMSLIB00017265559","spectrum_index":28528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 16.0275 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.108,"smiles":null,"spectrum_id":"CCMSLIB00017265562","spectrum_index":28529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 27.9901 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.06,"smiles":null,"spectrum_id":"CCMSLIB00017265564","spectrum_index":28530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Diethyl-2-aminoethanol (delta mass: 109.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.18,"smiles":null,"spectrum_id":"CCMSLIB00017265567","spectrum_index":28531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-pentyl- (delta mass: 24.9949 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017265569","spectrum_index":28532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 293.1841 Da; putative annotation: N/A; putative formula: C13H27NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.244,"smiles":null,"spectrum_id":"CCMSLIB00017265572","spectrum_index":28533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE10; CorrDec (delta mass: 89.0471 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.128,"smiles":null,"spectrum_id":"CCMSLIB00017265574","spectrum_index":28534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 159.0902 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.187,"smiles":null,"spectrum_id":"CCMSLIB00017265577","spectrum_index":28535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001048999-01!1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole\"\" (delta mass: 164.0567 Da; putative annotation: N/A; putative formula: C4H4N8)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.164,"smiles":null,"spectrum_id":"CCMSLIB00017265578","spectrum_index":28536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 73.0159 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.123,"smiles":null,"spectrum_id":"CCMSLIB00017265581","spectrum_index":28537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 429.4181 Da; putative annotation: N/A; putative formula: C27H51N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.457,"smiles":null,"spectrum_id":"CCMSLIB00017265584","spectrum_index":28538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 273.1574 Da; putative annotation: N/A; putative formula: C13H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.228,"smiles":null,"spectrum_id":"CCMSLIB00017265586","spectrum_index":28539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 72.0324 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.113,"smiles":null,"spectrum_id":"CCMSLIB00017265589","spectrum_index":28540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 117.0703 Da; putative annotation: N/A; putative formula: C5H12NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.146,"smiles":null,"spectrum_id":"CCMSLIB00017265592","spectrum_index":28541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 48.0097 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.065,"smiles":null,"spectrum_id":"CCMSLIB00017265594","spectrum_index":28542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 369.3257 Da; putative annotation: N/A; putative formula: C23H39N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.389,"smiles":null,"spectrum_id":"CCMSLIB00017265597","spectrum_index":28543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-DIHYDROXY-1-PHENYLALANINE (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017265599","spectrum_index":28544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 36.0364 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017265602","spectrum_index":28545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:102040\"\" (delta mass: 102.0682 Da; putative annotation: N/A; putative formula: C5H10O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.186,"smiles":null,"spectrum_id":"CCMSLIB00017265605","spectrum_index":28546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 111.0481 Da; putative annotation: N/A; putative formula: C9H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.108,"smiles":null,"spectrum_id":"CCMSLIB00017265606","spectrum_index":28547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 382.2238 Da; putative annotation: N/A; putative formula: C16H35N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.347,"smiles":null,"spectrum_id":"CCMSLIB00017265609","spectrum_index":28548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 82.0895 Da; putative annotation: N/A; putative formula: C5H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.155,"smiles":null,"spectrum_id":"CCMSLIB00017265612","spectrum_index":28549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 285.1611 Da; putative annotation: N/A; putative formula: C13H24N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.196,"smiles":null,"spectrum_id":"CCMSLIB00017265614","spectrum_index":28550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 260.2228 Da; putative annotation: N/A; putative formula: C12H28N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.302,"smiles":null,"spectrum_id":"CCMSLIB00017265616","spectrum_index":28551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 111.2333 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.36,"smiles":null,"spectrum_id":"CCMSLIB00017265619","spectrum_index":28552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 24.0561 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.19,"smiles":null,"spectrum_id":"CCMSLIB00017265622","spectrum_index":28553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 264.1616 Da; putative annotation: N/A; putative formula: C12H21N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.301,"smiles":null,"spectrum_id":"CCMSLIB00017265624","spectrum_index":28554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine methyl ester (delta mass: 143.0591 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.133,"smiles":null,"spectrum_id":"CCMSLIB00017265627","spectrum_index":28555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 517.2155 Da; putative annotation: N/A; putative formula: C36H27N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.276,"smiles":null,"spectrum_id":"CCMSLIB00017265630","spectrum_index":28556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 182.1011 Da; putative annotation: N/A; putative formula: C5H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.255,"smiles":null,"spectrum_id":"CCMSLIB00017265632","spectrum_index":28557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 238.0837 Da; putative annotation: N/A; putative formula: C12H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.185,"smiles":null,"spectrum_id":"CCMSLIB00017265634","spectrum_index":28558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 390.1314 Da; putative annotation: N/A; putative formula: C20H22O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.17,"smiles":null,"spectrum_id":"CCMSLIB00017265637","spectrum_index":28559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 208.0677 Da; putative annotation: N/A; putative formula: C18H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.191,"smiles":null,"spectrum_id":"CCMSLIB00017265640","spectrum_index":28560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA001085 Coniferaldehyde (delta mass: 238.0839 Da; putative annotation: N/A; putative formula: C12H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.154,"smiles":null,"spectrum_id":"CCMSLIB00017265642","spectrum_index":28561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.102,"smiles":null,"spectrum_id":"CCMSLIB00017265644","spectrum_index":28562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 57.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017265647","spectrum_index":28563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(3-Aminopropyl)-N1-methylpropane-1,3-diamine (delta mass: 146.0367 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.202,"smiles":null,"spectrum_id":"CCMSLIB00017265650","spectrum_index":28564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 101.048 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.108,"smiles":null,"spectrum_id":"CCMSLIB00017265651","spectrum_index":28565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 188.0314 Da; putative annotation: N/A; putative formula: C8H12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.07,"smiles":null,"spectrum_id":"CCMSLIB00017265654","spectrum_index":28566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 283.2891 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.36,"smiles":null,"spectrum_id":"CCMSLIB00017265657","spectrum_index":28567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 676.3829 Da; putative annotation: N/A; putative formula: C30H56N6O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.454,"smiles":null,"spectrum_id":"CCMSLIB00017265658","spectrum_index":28568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 69.0578 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.191,"smiles":null,"spectrum_id":"CCMSLIB00017265661","spectrum_index":28569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 38.0393 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.116,"smiles":null,"spectrum_id":"CCMSLIB00017265664","spectrum_index":28570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 133.0439 Da; putative annotation: N/A; putative formula: C8H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.016,"smiles":null,"spectrum_id":"CCMSLIB00017265666","spectrum_index":28571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:102040\"\" (delta mass: 17.9416 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.038,"smiles":null,"spectrum_id":"CCMSLIB00017265668","spectrum_index":28572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl tyramine (delta mass: 57.022 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.124,"smiles":null,"spectrum_id":"CCMSLIB00017265671","spectrum_index":28573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 450.2605 Da; putative annotation: N/A; putative formula: C22H30N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.321,"smiles":null,"spectrum_id":"CCMSLIB00017265674","spectrum_index":28574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to His-Ile from NIST14 (delta mass: 141.0801 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.241,"smiles":null,"spectrum_id":"CCMSLIB00017265676","spectrum_index":28575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 364.1093 Da; putative annotation: N/A; putative formula: C17H20N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.18,"smiles":null,"spectrum_id":"CCMSLIB00017265678","spectrum_index":28576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 450.1536 Da; putative annotation: N/A; putative formula: C23H30O5S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.245,"smiles":null,"spectrum_id":"CCMSLIB00017265681","spectrum_index":28577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 195.0726 Da; putative annotation: N/A; putative formula: C3H5N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.133,"smiles":null,"spectrum_id":"CCMSLIB00017265683","spectrum_index":28578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 185.0759 Da; putative annotation: N/A; putative formula: C12H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.321,"smiles":null,"spectrum_id":"CCMSLIB00017265685","spectrum_index":28579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methylthio)-1-propanol (delta mass: 114.0395 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.092,"smiles":null,"spectrum_id":"CCMSLIB00017265688","spectrum_index":28580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 315.2192 Da; putative annotation: N/A; putative formula: C20H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.311,"smiles":null,"spectrum_id":"CCMSLIB00017265691","spectrum_index":28581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 147.053 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017265694","spectrum_index":28582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 41.0271 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.087,"smiles":null,"spectrum_id":"CCMSLIB00017265697","spectrum_index":28583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 114.0315 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.118,"smiles":null,"spectrum_id":"CCMSLIB00017265699","spectrum_index":28584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carboxylic acid, ethyl ester (delta mass: 46.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.128,"smiles":null,"spectrum_id":"CCMSLIB00017265701","spectrum_index":28585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 108.0099 Da; putative annotation: N/A; putative formula: H4N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.144,"smiles":null,"spectrum_id":"CCMSLIB00017265704","spectrum_index":28586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 117.0744 Da; putative annotation: N/A; putative formula: C4H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.155,"smiles":null,"spectrum_id":"CCMSLIB00017265707","spectrum_index":28587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 61.032 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.119,"smiles":null,"spectrum_id":"CCMSLIB00017265710","spectrum_index":28588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 358.1575 Da; putative annotation: N/A; putative formula: C17H22N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.343,"smiles":null,"spectrum_id":"CCMSLIB00017265711","spectrum_index":28589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 132.051 Da; putative annotation: N/A; putative formula: C6H13O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.122,"smiles":null,"spectrum_id":"CCMSLIB00017265714","spectrum_index":28590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300757 Cephaeline (delta mass: 537.3187 Da; putative annotation: N/A; putative formula: C35H43N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1004.61,"smiles":null,"spectrum_id":"CCMSLIB00017265717","spectrum_index":28591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 413.1501 Da; putative annotation: N/A; putative formula: C24H15N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1080.38,"smiles":null,"spectrum_id":"CCMSLIB00017265719","spectrum_index":28592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 403.018 Da; putative annotation: N/A; putative formula: C9H15N3O11P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.136,"smiles":null,"spectrum_id":"CCMSLIB00017265721","spectrum_index":28593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 184.0891 Da; putative annotation: N/A; putative formula: C13H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.175,"smiles":null,"spectrum_id":"CCMSLIB00017265724","spectrum_index":28594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 35.8394 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.926,"smiles":null,"spectrum_id":"CCMSLIB00017265727","spectrum_index":28595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ac-Asp-Glu (delta mass: 83.0375 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.135,"smiles":null,"spectrum_id":"CCMSLIB00017265729","spectrum_index":28596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 405.1644 Da; putative annotation: N/A; putative formula: C18H31NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.24,"smiles":null,"spectrum_id":"CCMSLIB00017265730","spectrum_index":28597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 72.0323 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.113,"smiles":null,"spectrum_id":"CCMSLIB00017265733","spectrum_index":28598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-1-(4-phenoxyphenyl)methanamine (delta mass: 164.0803 Da; putative annotation: N/A; putative formula: C6H8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.203,"smiles":null,"spectrum_id":"CCMSLIB00017265736","spectrum_index":28599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 111.0321 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.129,"smiles":null,"spectrum_id":"CCMSLIB00017265737","spectrum_index":28600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 212.0382 Da; putative annotation: N/A; putative formula: C5H13N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.125,"smiles":null,"spectrum_id":"CCMSLIB00017265740","spectrum_index":28601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 192.0541 Da; putative annotation: N/A; putative formula: C2H8N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.167,"smiles":null,"spectrum_id":"CCMSLIB00017265743","spectrum_index":28602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 15.009 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.132,"smiles":null,"spectrum_id":"CCMSLIB00017265744","spectrum_index":28603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 336.3752 Da; putative annotation: N/A; putative formula: C24H48)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.445,"smiles":null,"spectrum_id":"CCMSLIB00017265747","spectrum_index":28604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.155,"smiles":null,"spectrum_id":"CCMSLIB00017265750","spectrum_index":28605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methylquinoline-3-carbaldehyde (delta mass: 17.0222 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.093,"smiles":null,"spectrum_id":"CCMSLIB00017265751","spectrum_index":28606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 464.2237 Da; putative annotation: N/A; putative formula: C18H36N6O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.377,"smiles":null,"spectrum_id":"CCMSLIB00017265754","spectrum_index":28607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 38.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017265757","spectrum_index":28608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 808.0935 Da; putative annotation: N/A; putative formula: C43H28N4O5S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1030.19,"smiles":null,"spectrum_id":"CCMSLIB00017265758","spectrum_index":28609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 13.9241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.021,"smiles":null,"spectrum_id":"CCMSLIB00017265761","spectrum_index":28610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pergolide sulfoxide (delta mass: 211.0759 Da; putative annotation: N/A; putative formula: C10H14NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.26,"smiles":null,"spectrum_id":"CCMSLIB00017265764","spectrum_index":28611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 106.0784 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.159,"smiles":null,"spectrum_id":"CCMSLIB00017265766","spectrum_index":28612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 191.1027 Da; putative annotation: N/A; putative formula: C6H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.183,"smiles":null,"spectrum_id":"CCMSLIB00017265768","spectrum_index":28613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 45.0049 Da; putative annotation: N/A; putative formula: CH3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.148,"smiles":null,"spectrum_id":"CCMSLIB00017265771","spectrum_index":28614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 109.0726 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.148,"smiles":null,"spectrum_id":"CCMSLIB00017265774","spectrum_index":28615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 682.5665 Da; putative annotation: N/A; putative formula: C41H79O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.645,"smiles":null,"spectrum_id":"CCMSLIB00017265776","spectrum_index":28616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 634.98 Da; putative annotation: N/A; putative formula: C18H37NOS11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":797.071,"smiles":null,"spectrum_id":"CCMSLIB00017265778","spectrum_index":28617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 97.0887 Da; putative annotation: N/A; putative formula: C6H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.16,"smiles":null,"spectrum_id":"CCMSLIB00017265781","spectrum_index":28618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 128.0464 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.133,"smiles":null,"spectrum_id":"CCMSLIB00017265784","spectrum_index":28619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 81.062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.184,"smiles":null,"spectrum_id":"CCMSLIB00017265786","spectrum_index":28620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 158.0575 Da; putative annotation: N/A; putative formula: C7H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.201,"smiles":null,"spectrum_id":"CCMSLIB00017265788","spectrum_index":28621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 52.03 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.179,"smiles":null,"spectrum_id":"CCMSLIB00017265791","spectrum_index":28622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 254.1571 Da; putative annotation: N/A; putative formula: C12H22N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.254,"smiles":null,"spectrum_id":"CCMSLIB00017265793","spectrum_index":28623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 152.056 Da; putative annotation: N/A; putative formula: C3H4N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.161,"smiles":null,"spectrum_id":"CCMSLIB00017265796","spectrum_index":28624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1075.0958 Da; putative annotation: N/A; putative formula: C50H29NO27)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1297.19,"smiles":null,"spectrum_id":"CCMSLIB00017265798","spectrum_index":28625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 278.0371 Da; putative annotation: N/A; putative formula: C13H14N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.213,"smiles":null,"spectrum_id":"CCMSLIB00017265801","spectrum_index":28626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 10.0389 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.141,"smiles":null,"spectrum_id":"CCMSLIB00017265804","spectrum_index":28627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 157.0732 Da; putative annotation: N/A; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.16,"smiles":null,"spectrum_id":"CCMSLIB00017265806","spectrum_index":28628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-6-ol, 1-(4-methoxyphenyl)-2-methyl-3-nitro- (delta mass: 41.0191 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.122,"smiles":null,"spectrum_id":"CCMSLIB00017265809","spectrum_index":28629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.066,"smiles":null,"spectrum_id":"CCMSLIB00017265812","spectrum_index":28630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Fluoro-2,3-dihydro-1H-indole (delta mass: 111.0241 Da; putative annotation: N/A; putative formula: C5H6NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.096,"smiles":null,"spectrum_id":"CCMSLIB00017265814","spectrum_index":28631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 435.2693 Da; putative annotation: N/A; putative formula: C18H37N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.34,"smiles":null,"spectrum_id":"CCMSLIB00017265817","spectrum_index":28632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 146.1096 Da; putative annotation: N/A; putative formula: C11H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.19,"smiles":null,"spectrum_id":"CCMSLIB00017265820","spectrum_index":28633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 125.0347 Da; putative annotation: N/A; putative formula: C3H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.101,"smiles":null,"spectrum_id":"CCMSLIB00017265822","spectrum_index":28634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 236.1514 Da; putative annotation: N/A; putative formula: C13H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.238,"smiles":null,"spectrum_id":"CCMSLIB00017265825","spectrum_index":28635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,4-Triazolidine-3-thione, 2-(4-chlorophenyl)-5-methyl-5-(3-methylbutyl)- (delta mass: 18.0128 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.127,"smiles":null,"spectrum_id":"CCMSLIB00017265828","spectrum_index":28636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 157.0858 Da; putative annotation: N/A; putative formula: C6H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.12,"smiles":null,"spectrum_id":"CCMSLIB00017265831","spectrum_index":28637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 92.0109 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.098,"smiles":null,"spectrum_id":"CCMSLIB00017265833","spectrum_index":28638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 25.0032 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017265836","spectrum_index":28639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Pyrimidinylmethanol (delta mass: 26.0157 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.071,"smiles":null,"spectrum_id":"CCMSLIB00017265838","spectrum_index":28640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 122.1076 Da; putative annotation: N/A; putative formula: C9H14)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.173,"smiles":null,"spectrum_id":"CCMSLIB00017265841","spectrum_index":28641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Val (delta mass: 99.0683 Da; putative annotation: L-Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.202,"smiles":null,"spectrum_id":"CCMSLIB00017265843","spectrum_index":28642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385000-01_C15H18O8_beta-D-Glucopyranose, 1-O-[(2E)-3-(2-hydroxyphenyl)-1-oxo-2-propen-1-yl]- (delta mass: 146.0355 Da; putative annotation: p-Coumaric acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.143,"smiles":null,"spectrum_id":"CCMSLIB00017265846","spectrum_index":28643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 80.0626 Da; putative annotation: 1,5-Hexadien-3-ol; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.123,"smiles":null,"spectrum_id":"CCMSLIB00017265848","spectrum_index":28644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 143.0582 Da; putative annotation: 2-Aminoadipic acid; AIF; CE0; MS2Dec; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.182,"smiles":null,"spectrum_id":"CCMSLIB00017265851","spectrum_index":28645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 268.2184 Da; putative annotation: Retinol; putative formula: C20H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.347,"smiles":null,"spectrum_id":"CCMSLIB00017265853","spectrum_index":28646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 143.0585 Da; putative annotation: 3-Aminoadipic acid; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017265856","spectrum_index":28647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 325.1633 Da; putative annotation: N/A; putative formula: C17H28NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.318,"smiles":null,"spectrum_id":"CCMSLIB00017265858","spectrum_index":28648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 409.1776 Da; putative annotation: N/A; putative formula: C18H35NO3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.248,"smiles":null,"spectrum_id":"CCMSLIB00017265860","spectrum_index":28649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 70.0779 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.252,"smiles":null,"spectrum_id":"CCMSLIB00017265863","spectrum_index":28650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 162.0403 Da; putative annotation: N/A; putative formula: C4H2N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.174,"smiles":null,"spectrum_id":"CCMSLIB00017265866","spectrum_index":28651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 151.0273 Da; putative annotation: N/A; putative formula: C7H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.087,"smiles":null,"spectrum_id":"CCMSLIB00017265867","spectrum_index":28652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 326.2042 Da; putative annotation: N/A; putative formula: C25H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.363,"smiles":null,"spectrum_id":"CCMSLIB00017265870","spectrum_index":28653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Hexane-1,6-diylbis(N'-cyanoguanidine) (delta mass: 35.0287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.201,"smiles":null,"spectrum_id":"CCMSLIB00017265873","spectrum_index":28654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 127.1002 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.224,"smiles":null,"spectrum_id":"CCMSLIB00017265874","spectrum_index":28655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 82.0741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.181,"smiles":null,"spectrum_id":"CCMSLIB00017265877","spectrum_index":28656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 293.1503 Da; putative annotation: N/A; putative formula: C11H24N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.221,"smiles":null,"spectrum_id":"CCMSLIB00017265880","spectrum_index":28657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 903.4841 Da; putative annotation: N/A; putative formula: C58H69N3O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1084.55,"smiles":null,"spectrum_id":"CCMSLIB00017265881","spectrum_index":28658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 781.4606 Da; putative annotation: N/A; putative formula: C54H59N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1108.59,"smiles":null,"spectrum_id":"CCMSLIB00017265884","spectrum_index":28659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 5.002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.177,"smiles":null,"spectrum_id":"CCMSLIB00017265887","spectrum_index":28660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 540.3076 Da; putative annotation: N/A; putative formula: C26H45N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.378,"smiles":null,"spectrum_id":"CCMSLIB00017265888","spectrum_index":28661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.16,"smiles":null,"spectrum_id":"CCMSLIB00017265892","spectrum_index":28662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl hydrogen malonate (delta mass: 17.0168 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.066,"smiles":null,"spectrum_id":"CCMSLIB00017265894","spectrum_index":28663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 98.0732 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.133,"smiles":null,"spectrum_id":"CCMSLIB00017265897","spectrum_index":28664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 473.2128 Da; putative annotation: N/A; putative formula: C20H35N5O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.279,"smiles":null,"spectrum_id":"CCMSLIB00017265899","spectrum_index":28665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 136.0892 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.186,"smiles":null,"spectrum_id":"CCMSLIB00017265902","spectrum_index":28666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 84.0105 Da; putative annotation: N/A; putative formula: C6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017265905","spectrum_index":28667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 323.1886 Da; putative annotation: N/A; putative formula: C21H25NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.286,"smiles":null,"spectrum_id":"CCMSLIB00017265907","spectrum_index":28668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 132.0429 Da; putative annotation: N/A; putative formula: C6H12O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.139,"smiles":null,"spectrum_id":"CCMSLIB00017265909","spectrum_index":28669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 41.0781 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017265912","spectrum_index":28670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 221.0902 Da; putative annotation: N/A; putative formula: C8H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.161,"smiles":null,"spectrum_id":"CCMSLIB00017265915","spectrum_index":28671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.159,"smiles":null,"spectrum_id":"CCMSLIB00017265918","spectrum_index":28672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 111.0328 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.098,"smiles":null,"spectrum_id":"CCMSLIB00017265919","spectrum_index":28673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 64.0341 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017265922","spectrum_index":28674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 10.1074 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.293,"smiles":null,"spectrum_id":"CCMSLIB00017265925","spectrum_index":28675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 590.3464 Da; putative annotation: N/A; putative formula: C34H54O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.417,"smiles":null,"spectrum_id":"CCMSLIB00017265928","spectrum_index":28676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 595.2628 Da; putative annotation: N/A; putative formula: C27H29N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.323,"smiles":null,"spectrum_id":"CCMSLIB00017265931","spectrum_index":28677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 316.2146 Da; putative annotation: N/A; putative formula: C19H28N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.52,"smiles":null,"spectrum_id":"CCMSLIB00017265933","spectrum_index":28678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017265935","spectrum_index":28679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arthrobactin (delta mass: 14.02 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.276,"smiles":null,"spectrum_id":"CCMSLIB00017265938","spectrum_index":28680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 513.2799 Da; putative annotation: N/A; putative formula: C23H39N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.366,"smiles":null,"spectrum_id":"CCMSLIB00017265941","spectrum_index":28681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 78.0238 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.146,"smiles":null,"spectrum_id":"CCMSLIB00017265943","spectrum_index":28682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380371-01!5-hydroxy-2,2,6,6-tetramethyl-4-[3-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]butyl]cyclohex-4-ene-1,3-dione (delta mass: 427.2353 Da; putative annotation: N/A; putative formula: C19H34N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.473,"smiles":null,"spectrum_id":"CCMSLIB00017265945","spectrum_index":28683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 138.1094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.132,"smiles":null,"spectrum_id":"CCMSLIB00017265948","spectrum_index":28684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 103.0258 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.125,"smiles":null,"spectrum_id":"CCMSLIB00017265950","spectrum_index":28685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinazolin-4(3H)-one (delta mass: 64.0412 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017265952","spectrum_index":28686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 12.0362 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.086,"smiles":null,"spectrum_id":"CCMSLIB00017265955","spectrum_index":28687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 648.3137 Da; putative annotation: N/A; putative formula: C39H44N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.384,"smiles":null,"spectrum_id":"CCMSLIB00017265958","spectrum_index":28688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 318.2561 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.343,"smiles":null,"spectrum_id":"CCMSLIB00017265959","spectrum_index":28689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ACETATE - 70.0 eV (delta mass: 27.0107 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.081,"smiles":null,"spectrum_id":"CCMSLIB00017265962","spectrum_index":28690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 74.0365 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.144,"smiles":null,"spectrum_id":"CCMSLIB00017265964","spectrum_index":28691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 264.1116 Da; putative annotation: N/A; putative formula: C14H20N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.182,"smiles":null,"spectrum_id":"CCMSLIB00017265966","spectrum_index":28692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 702.2526 Da; putative annotation: N/A; putative formula: C30H39N8O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":908.334,"smiles":null,"spectrum_id":"CCMSLIB00017265969","spectrum_index":28693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 18.969 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.065,"smiles":null,"spectrum_id":"CCMSLIB00017265971","spectrum_index":28694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ellipticine (delta mass: 16.9822 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.105,"smiles":null,"spectrum_id":"CCMSLIB00017265973","spectrum_index":28695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 497.1425 Da; putative annotation: N/A; putative formula: C26H28NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.203,"smiles":null,"spectrum_id":"CCMSLIB00017265976","spectrum_index":28696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 558.1938 Da; putative annotation: N/A; putative formula: C30H30N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.275,"smiles":null,"spectrum_id":"CCMSLIB00017265979","spectrum_index":28697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 923.3686 Da; putative annotation: N/A; putative formula: C46H57N3O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1250.5,"smiles":null,"spectrum_id":"CCMSLIB00017265982","spectrum_index":28698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 462.7503 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.821,"smiles":null,"spectrum_id":"CCMSLIB00017265983","spectrum_index":28699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dimethyl-1H-benzimidazole-2-thiol (delta mass: 27.0089 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.073,"smiles":null,"spectrum_id":"CCMSLIB00017265986","spectrum_index":28700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 194.0971 Da; putative annotation: N/A; putative formula: C10H15N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.202,"smiles":null,"spectrum_id":"CCMSLIB00017265989","spectrum_index":28701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-alpha-D-glucosamine - 40.0 eV (delta mass: 458.7716 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.869,"smiles":null,"spectrum_id":"CCMSLIB00017265990","spectrum_index":28702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C5:0 (delta mass: 56.06 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.204,"smiles":null,"spectrum_id":"CCMSLIB00017265993","spectrum_index":28703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 168.0939 Da; putative annotation: N/A; putative formula: C13H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017265995","spectrum_index":28704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 17.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.15,"smiles":null,"spectrum_id":"CCMSLIB00017265998","spectrum_index":28705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 10.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.113,"smiles":null,"spectrum_id":"CCMSLIB00017266000","spectrum_index":28706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 176.0756 Da; putative annotation: N/A; putative formula: C11H13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.24,"smiles":null,"spectrum_id":"CCMSLIB00017266003","spectrum_index":28707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 534.5046 Da; putative annotation: N/A; putative formula: C33H66N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.576,"smiles":null,"spectrum_id":"CCMSLIB00017266006","spectrum_index":28708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 131.0401 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.21,"smiles":null,"spectrum_id":"CCMSLIB00017266008","spectrum_index":28709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 245.1632 Da; putative annotation: N/A; putative formula: C13H27NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.254,"smiles":null,"spectrum_id":"CCMSLIB00017266010","spectrum_index":28710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 72.8385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.909,"smiles":null,"spectrum_id":"CCMSLIB00017266013","spectrum_index":28711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 158.0795 Da; putative annotation: N/A; putative formula: C5H10N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017266015","spectrum_index":28712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 61.0386 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.125,"smiles":null,"spectrum_id":"CCMSLIB00017266017","spectrum_index":28713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(+)-4-Amino-3-hydroxybutyric acid (delta mass: 270.2161 Da; putative annotation: N/A; putative formula: C12H26N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.282,"smiles":null,"spectrum_id":"CCMSLIB00017266020","spectrum_index":28714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 12.9898 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":123.05,"smiles":null,"spectrum_id":"CCMSLIB00017266022","spectrum_index":28715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 27.0068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.083,"smiles":null,"spectrum_id":"CCMSLIB00017266024","spectrum_index":28716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 23.0001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.086,"smiles":null,"spectrum_id":"CCMSLIB00017266027","spectrum_index":28717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 245.2352 Da; putative annotation: N/A; putative formula: C10H27N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.3,"smiles":null,"spectrum_id":"CCMSLIB00017266030","spectrum_index":28718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 195.0408 Da; putative annotation: N/A; putative formula: C4H10N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.138,"smiles":null,"spectrum_id":"CCMSLIB00017266032","spectrum_index":28719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-(1H-Imidazol-1-yl)propyl]-3-nitrobenzamide (delta mass: 156.0226 Da; putative annotation: N/A; putative formula: C3H4N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.137,"smiles":null,"spectrum_id":"CCMSLIB00017266035","spectrum_index":28720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 527.3566 Da; putative annotation: N/A; putative formula: C27H49N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":856.543,"smiles":null,"spectrum_id":"CCMSLIB00017266037","spectrum_index":28721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 286.2302 Da; putative annotation: N/A; putative formula: C13H30N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.359,"smiles":null,"spectrum_id":"CCMSLIB00017266039","spectrum_index":28722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ305901 Imidacloprid-guanidine|Desnitro-imidacloprid|1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-1H-imidazol-2-amine (delta mass: 84.0395 Da; putative annotation: N/A; putative formula: C5H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.114,"smiles":null,"spectrum_id":"CCMSLIB00017266042","spectrum_index":28723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 517.3399 Da; putative annotation: N/A; putative formula: C26H55N3O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.463,"smiles":null,"spectrum_id":"CCMSLIB00017266045","spectrum_index":28724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 56.0632 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.139,"smiles":null,"spectrum_id":"CCMSLIB00017266046","spectrum_index":28725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-AMINO-5-HYDROXYBENZOATE (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.06,"smiles":null,"spectrum_id":"CCMSLIB00017266049","spectrum_index":28726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 128.0577 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.139,"smiles":null,"spectrum_id":"CCMSLIB00017266051","spectrum_index":28727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 86.0779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.141,"smiles":null,"spectrum_id":"CCMSLIB00017266053","spectrum_index":28728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosaminic acid (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.081,"smiles":null,"spectrum_id":"CCMSLIB00017266056","spectrum_index":28729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 118.0421 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017266059","spectrum_index":28730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.029,"smiles":null,"spectrum_id":"CCMSLIB00017266060","spectrum_index":28731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 179.0794 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.213,"smiles":null,"spectrum_id":"CCMSLIB00017266063","spectrum_index":28732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carboxylic acid, ethyl ester (delta mass: 177.1514 Da; putative annotation: N/A; putative formula: C12H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.238,"smiles":null,"spectrum_id":"CCMSLIB00017266064","spectrum_index":28733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 248.1777 Da; putative annotation: N/A; putative formula: C16H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.306,"smiles":null,"spectrum_id":"CCMSLIB00017266067","spectrum_index":28734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-AMINOSALICYLIC ACID (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.05,"smiles":null,"spectrum_id":"CCMSLIB00017266070","spectrum_index":28735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 89.0475 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.107,"smiles":null,"spectrum_id":"CCMSLIB00017266071","spectrum_index":28736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 40.8341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.952,"smiles":null,"spectrum_id":"CCMSLIB00017266074","spectrum_index":28737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 869.4262 Da; putative annotation: N/A; putative formula: C53H55N7O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1050.5,"smiles":null,"spectrum_id":"CCMSLIB00017266077","spectrum_index":28738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-Gentiobiose (delta mass: 421.2483 Da; putative annotation: N/A; putative formula: C24H31N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.372,"smiles":null,"spectrum_id":"CCMSLIB00017266078","spectrum_index":28739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 734.4611 Da; putative annotation: N/A; putative formula: C42H70O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.532,"smiles":null,"spectrum_id":"CCMSLIB00017266081","spectrum_index":28740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 393.3596 Da; putative annotation: N/A; putative formula: C25H47NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.446,"smiles":null,"spectrum_id":"CCMSLIB00017266084","spectrum_index":28741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 351.1061 Da; putative annotation: N/A; putative formula: C17H22NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.177,"smiles":null,"spectrum_id":"CCMSLIB00017266085","spectrum_index":28742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amoxicillin - 30.0 eV (delta mass: 188.0672 Da; putative annotation: N/A; putative formula: C8H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.179,"smiles":null,"spectrum_id":"CCMSLIB00017266088","spectrum_index":28743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 10.0572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.107,"smiles":null,"spectrum_id":"CCMSLIB00017266091","spectrum_index":28744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 86.0523 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.107,"smiles":null,"spectrum_id":"CCMSLIB00017266092","spectrum_index":28745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 106.0308 Da; putative annotation: N/A; putative formula: CH6N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.108,"smiles":null,"spectrum_id":"CCMSLIB00017266095","spectrum_index":28746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 260.1202 Da; putative annotation: N/A; putative formula: C11H20N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.284,"smiles":null,"spectrum_id":"CCMSLIB00017266098","spectrum_index":28747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 330.1736 Da; putative annotation: N/A; putative formula: C14H28N4OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.343,"smiles":null,"spectrum_id":"CCMSLIB00017266099","spectrum_index":28748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Leu (delta mass: 57.0232 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.194,"smiles":null,"spectrum_id":"CCMSLIB00017266102","spectrum_index":28749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 26.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017266105","spectrum_index":28750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 285.1078 Da; putative annotation: N/A; putative formula: C12H22N3O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.22,"smiles":null,"spectrum_id":"CCMSLIB00017266107","spectrum_index":28751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 267.2926 Da; putative annotation: N/A; putative formula: C18H37N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.363,"smiles":null,"spectrum_id":"CCMSLIB00017266109","spectrum_index":28752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 29.0244 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.106,"smiles":null,"spectrum_id":"CCMSLIB00017266112","spectrum_index":28753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(1H-Indol-3-yl)-1-butanone (delta mass: 43.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.144,"smiles":null,"spectrum_id":"CCMSLIB00017266115","spectrum_index":28754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 426.1911 Da; putative annotation: N/A; putative formula: C15H26N10O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.303,"smiles":null,"spectrum_id":"CCMSLIB00017266116","spectrum_index":28755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 94.0057 Da; putative annotation: N/A; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.103,"smiles":null,"spectrum_id":"CCMSLIB00017266119","spectrum_index":28756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 79.9657 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.046,"smiles":null,"spectrum_id":"CCMSLIB00017266122","spectrum_index":28757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 705.2347 Da; putative annotation: N/A; putative formula: C38H44NO6PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1372.46,"smiles":null,"spectrum_id":"CCMSLIB00017266123","spectrum_index":28758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 261.1565 Da; putative annotation: N/A; putative formula: C9H15N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.227,"smiles":null,"spectrum_id":"CCMSLIB00017266126","spectrum_index":28759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 16.9931 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.059,"smiles":null,"spectrum_id":"CCMSLIB00017266129","spectrum_index":28760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 163.1681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.202,"smiles":null,"spectrum_id":"CCMSLIB00017266130","spectrum_index":28761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-1-(4-phenoxyphenyl)methanamine (delta mass: 74.0565 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.179,"smiles":null,"spectrum_id":"CCMSLIB00017266133","spectrum_index":28762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 73.0528 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017266136","spectrum_index":28763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 457.3252 Da; putative annotation: N/A; putative formula: C24H48N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.364,"smiles":null,"spectrum_id":"CCMSLIB00017266137","spectrum_index":28764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Blood Group H Trisaccharide (delta mass: 209.0781 Da; putative annotation: N/A; putative formula: C5H7N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.286,"smiles":null,"spectrum_id":"CCMSLIB00017266140","spectrum_index":28765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381317-01!(E)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-methyldec-8-ene-1,3-dione [IIN-based: Match] (delta mass: 262.2292 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.436,"smiles":null,"spectrum_id":"CCMSLIB00017266141","spectrum_index":28766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 73.0527 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.124,"smiles":null,"spectrum_id":"CCMSLIB00017266144","spectrum_index":28767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid CollisionEnergy:205060 (delta mass: 113.0846 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.186,"smiles":null,"spectrum_id":"CCMSLIB00017266147","spectrum_index":28768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 18.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.139,"smiles":null,"spectrum_id":"CCMSLIB00017266148","spectrum_index":28769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ellipticine (delta mass: 14.0123 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.135,"smiles":null,"spectrum_id":"CCMSLIB00017266151","spectrum_index":28770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 352.2174 Da; putative annotation: N/A; putative formula: C20H33O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.397,"smiles":null,"spectrum_id":"CCMSLIB00017266154","spectrum_index":28771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 45.0552 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.232,"smiles":null,"spectrum_id":"CCMSLIB00017266155","spectrum_index":28772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 90.0311 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.185,"smiles":null,"spectrum_id":"CCMSLIB00017266158","spectrum_index":28773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 130.0987 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.19,"smiles":null,"spectrum_id":"CCMSLIB00017266161","spectrum_index":28774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 761.3787 Da; putative annotation: N/A; putative formula: C44H51N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":924.439,"smiles":null,"spectrum_id":"CCMSLIB00017266164","spectrum_index":28775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 308.3033 Da; putative annotation: N/A; putative formula: C17H36N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.375,"smiles":null,"spectrum_id":"CCMSLIB00017266166","spectrum_index":28776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 30.0129 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.136,"smiles":null,"spectrum_id":"CCMSLIB00017266168","spectrum_index":28777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 92.0626 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017266171","spectrum_index":28778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 228.1201 Da; putative annotation: N/A; putative formula: C12H22P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.207,"smiles":null,"spectrum_id":"CCMSLIB00017266173","spectrum_index":28779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 96.0211 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017266175","spectrum_index":28780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 504.725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.796,"smiles":null,"spectrum_id":"CCMSLIB00017266178","spectrum_index":28781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 222.108 Da; putative annotation: N/A; putative formula: C13H18OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.173,"smiles":null,"spectrum_id":"CCMSLIB00017266180","spectrum_index":28782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 99.0688 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.192,"smiles":null,"spectrum_id":"CCMSLIB00017266182","spectrum_index":28783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 135.0407 Da; putative annotation: N/A; putative formula: C2HN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.082,"smiles":null,"spectrum_id":"CCMSLIB00017266185","spectrum_index":28784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-[2-Nitro-4-(trifluoromethyl)phenyl]-1,3-propanediamine (delta mass: 18.0023 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.098,"smiles":null,"spectrum_id":"CCMSLIB00017266188","spectrum_index":28785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 654.3251 Da; putative annotation: N/A; putative formula: C33H50O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":818.417,"smiles":null,"spectrum_id":"CCMSLIB00017266189","spectrum_index":28786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 239.1239 Da; putative annotation: N/A; putative formula: C7H13N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.278,"smiles":null,"spectrum_id":"CCMSLIB00017266192","spectrum_index":28787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1236.9879 Da; putative annotation: N/A; putative formula: C78H120N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1459.09,"smiles":null,"spectrum_id":"CCMSLIB00017266195","spectrum_index":28788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 261.1028 Da; putative annotation: N/A; putative formula: C13H16N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.181,"smiles":null,"spectrum_id":"CCMSLIB00017266197","spectrum_index":28789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 43.0419 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017266200","spectrum_index":28790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 86.9619 Da; putative annotation: N/A; putative formula: H-2N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.022,"smiles":null,"spectrum_id":"CCMSLIB00017266202","spectrum_index":28791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 52.0396 Da; putative annotation: N/A; putative formula: C3H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.127,"smiles":null,"spectrum_id":"CCMSLIB00017266205","spectrum_index":28792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 115.9869 Da; putative annotation: N/A; putative formula: C3H4N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.063,"smiles":null,"spectrum_id":"CCMSLIB00017266207","spectrum_index":28793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 107.0444 Da; putative annotation: N/A; putative formula: C5H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017266210","spectrum_index":28794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 70.0414 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.19,"smiles":null,"spectrum_id":"CCMSLIB00017266213","spectrum_index":28795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 49.982 Da; putative annotation: N/A; putative formula: C3H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.079,"smiles":null,"spectrum_id":"CCMSLIB00017266215","spectrum_index":28796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 389.2746 Da; putative annotation: N/A; putative formula: C16H35N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.361,"smiles":null,"spectrum_id":"CCMSLIB00017266217","spectrum_index":28797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline (delta mass: 27.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.116,"smiles":null,"spectrum_id":"CCMSLIB00017266220","spectrum_index":28798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Lys (delta mass: 83.0728 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.218,"smiles":null,"spectrum_id":"CCMSLIB00017266223","spectrum_index":28799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 73.0527 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.186,"smiles":null,"spectrum_id":"CCMSLIB00017266225","spectrum_index":28800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7,8-Tetramethyl-2-(.beta.-carboxyethyl)-6-hydroxychroman (delta mass: 236.0623 Da; putative annotation: N/A; putative formula: C19H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.221,"smiles":null,"spectrum_id":"CCMSLIB00017266227","spectrum_index":28801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 204.0628 Da; putative annotation: N/A; putative formula: C8H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.149,"smiles":null,"spectrum_id":"CCMSLIB00017266230","spectrum_index":28802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 195.0728 Da; putative annotation: N/A; putative formula: C3H5N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.169,"smiles":null,"spectrum_id":"CCMSLIB00017266231","spectrum_index":28803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 58.0143 Da; putative annotation: N/A; putative formula: CH2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.112,"smiles":null,"spectrum_id":"CCMSLIB00017266234","spectrum_index":28804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 42.1784 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.226,"smiles":null,"spectrum_id":"CCMSLIB00017266237","spectrum_index":28805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-2-amine, 4,5-dihydro-N-[4-[[4-(1-methylethoxy)phenyl]methyl]phenyl]- (delta mass: 2.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.223,"smiles":null,"spectrum_id":"CCMSLIB00017266238","spectrum_index":28806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 150.0552 Da; putative annotation: N/A; putative formula: C11H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.142,"smiles":null,"spectrum_id":"CCMSLIB00017266241","spectrum_index":28807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 48.0403 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017266243","spectrum_index":28808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 144.0306 Da; putative annotation: Imidazo[1,2-a]pyridine-2-carboxylic acid; putative formula: C8H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.081,"smiles":null,"spectrum_id":"CCMSLIB00017266246","spectrum_index":28809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxy-2-[(4-methyl-1-piperazinyl)carbonyl]-1H-indole (delta mass: 100.0411 Da; putative annotation: 5-Azaindole; putative formula: C7H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.196,"smiles":null,"spectrum_id":"CCMSLIB00017266248","spectrum_index":28810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 159.089 Da; putative annotation: N-Ethyl-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine; putative formula: C8H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.175,"smiles":null,"spectrum_id":"CCMSLIB00017266251","spectrum_index":28811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Val (delta mass: 113.0842 Da; putative annotation: L-Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017266253","spectrum_index":28812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Thr-Lys (delta mass: 200.1165 Da; putative annotation: Ser-Ile; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.345,"smiles":null,"spectrum_id":"CCMSLIB00017266255","spectrum_index":28813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Tyrosine (delta mass: 115.0268 Da; putative annotation: Massbank:RP001601 L-Aspartic acid|(2S)-2-aminobutanedioic acid; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.108,"smiles":null,"spectrum_id":"CCMSLIB00017266258","spectrum_index":28814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 156.1156 Da; putative annotation: 9-Hydroxynonanoic acid; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.163,"smiles":null,"spectrum_id":"CCMSLIB00017266260","spectrum_index":28815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 46.0735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.154,"smiles":null,"spectrum_id":"CCMSLIB00017266262","spectrum_index":28816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 452.1328 Da; putative annotation: N/A; putative formula: C22H28O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.23,"smiles":null,"spectrum_id":"CCMSLIB00017266265","spectrum_index":28817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 90.0871 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.262,"smiles":null,"spectrum_id":"CCMSLIB00017266268","spectrum_index":28818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 283.0454 Da; putative annotation: N/A; putative formula: C11H5N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.143,"smiles":null,"spectrum_id":"CCMSLIB00017266269","spectrum_index":28819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 193.0709 Da; putative annotation: N/A; putative formula: C6H15N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.166,"smiles":null,"spectrum_id":"CCMSLIB00017266272","spectrum_index":28820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 457.331 Da; putative annotation: N/A; putative formula: C27H43N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.443,"smiles":null,"spectrum_id":"CCMSLIB00017266274","spectrum_index":28821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 126.0835 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.149,"smiles":null,"spectrum_id":"CCMSLIB00017266276","spectrum_index":28822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 62.0517 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.133,"smiles":null,"spectrum_id":"CCMSLIB00017266279","spectrum_index":28823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Gly-Leu (delta mass: 113.0864 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.231,"smiles":null,"spectrum_id":"CCMSLIB00017266282","spectrum_index":28824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 14.1135 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.247,"smiles":null,"spectrum_id":"CCMSLIB00017266283","spectrum_index":28825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 28.0199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.07,"smiles":null,"spectrum_id":"CCMSLIB00017266286","spectrum_index":28826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 313.1882 Da; putative annotation: N/A; putative formula: C13H19N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.259,"smiles":null,"spectrum_id":"CCMSLIB00017266288","spectrum_index":28827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 141.0788 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.129,"smiles":null,"spectrum_id":"CCMSLIB00017266291","spectrum_index":28828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381327-01_C21H28O6_2H,11H-Naphtho[2,1-b]pyrano[3,2-e]pyran-9-carboxylic acid, 1,3,4,4a,5,6,6a,12,12a,12b-decahydro-3-hydroxy-4,4,6a,12b-tetramethyl-11-oxo- (delta mass: 125.0516 Da; putative annotation: N/A; putative formula: C5H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.247,"smiles":null,"spectrum_id":"CCMSLIB00017266293","spectrum_index":28829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 68.0252 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.09,"smiles":null,"spectrum_id":"CCMSLIB00017266296","spectrum_index":28830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 232.1685 Da; putative annotation: N/A; putative formula: C13H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.239,"smiles":null,"spectrum_id":"CCMSLIB00017266298","spectrum_index":28831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 491.2579 Da; putative annotation: N/A; putative formula: C25H33N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.328,"smiles":null,"spectrum_id":"CCMSLIB00017266301","spectrum_index":28832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 204.0787 Da; putative annotation: N/A; putative formula: C12H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.176,"smiles":null,"spectrum_id":"CCMSLIB00017266304","spectrum_index":28833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 129.0178 Da; putative annotation: N/A; putative formula: C3H3N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.099,"smiles":null,"spectrum_id":"CCMSLIB00017266306","spectrum_index":28834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 425.1317 Da; putative annotation: N/A; putative formula: C32H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.245,"smiles":null,"spectrum_id":"CCMSLIB00017266309","spectrum_index":28835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 438.3502 Da; putative annotation: N/A; putative formula: C30H46O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.526,"smiles":null,"spectrum_id":"CCMSLIB00017266311","spectrum_index":28836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 60.0424 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.212,"smiles":null,"spectrum_id":"CCMSLIB00017266314","spectrum_index":28837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 58.0646 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.187,"smiles":null,"spectrum_id":"CCMSLIB00017266316","spectrum_index":28838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Methylsulfanyl)-9H-pyrimido[4,5-b]indole (delta mass: 18.0177 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.077,"smiles":null,"spectrum_id":"CCMSLIB00017266318","spectrum_index":28839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 153.1154 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.275,"smiles":null,"spectrum_id":"CCMSLIB00017266321","spectrum_index":28840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 118.0066 Da; putative annotation: N/A; putative formula: H2N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.13,"smiles":null,"spectrum_id":"CCMSLIB00017266324","spectrum_index":28841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 260.1821 Da; putative annotation: N/A; putative formula: C14H30P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.264,"smiles":null,"spectrum_id":"CCMSLIB00017266325","spectrum_index":28842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of galanthamine (delta mass: 260.2139 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.373,"smiles":null,"spectrum_id":"CCMSLIB00017266328","spectrum_index":28843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"9H-Pyrido[3,4-B]indole CollisionEnergy:102040\"\" (delta mass: 135.0553 Da; putative annotation: N/A; putative formula: C5H5N5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.131,"smiles":null,"spectrum_id":"CCMSLIB00017266331","spectrum_index":28844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neogrifolin (delta mass: 80.0637 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.311,"smiles":null,"spectrum_id":"CCMSLIB00017266333","spectrum_index":28845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 105.14 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.253,"smiles":null,"spectrum_id":"CCMSLIB00017266335","spectrum_index":28846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 71.0364 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.175,"smiles":null,"spectrum_id":"CCMSLIB00017266338","spectrum_index":28847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET020002 CLE_291.1026_12.2|Clensiopenterol|1-(4-amino-3,5-dichlorophenyl)-2-(3-methylbutylamino)ethanol (delta mass: 46.0407 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.143,"smiles":null,"spectrum_id":"CCMSLIB00017266340","spectrum_index":28848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 200.1776 Da; putative annotation: N/A; putative formula: C12H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.274,"smiles":null,"spectrum_id":"CCMSLIB00017266342","spectrum_index":28849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of FUROSINE (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.144,"smiles":null,"spectrum_id":"CCMSLIB00017266345","spectrum_index":28850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 101.0469 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.217,"smiles":null,"spectrum_id":"CCMSLIB00017266348","spectrum_index":28851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 66.0377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.174,"smiles":null,"spectrum_id":"CCMSLIB00017266349","spectrum_index":28852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 219.0952 Da; putative annotation: N/A; putative formula: C8H18N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.197,"smiles":null,"spectrum_id":"CCMSLIB00017266352","spectrum_index":28853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 737.4552 Da; putative annotation: N/A; putative formula: C41H63N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.515,"smiles":null,"spectrum_id":"CCMSLIB00017266355","spectrum_index":28854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 312.2306 Da; putative annotation: N/A; putative formula: C19H36O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.28,"smiles":null,"spectrum_id":"CCMSLIB00017266356","spectrum_index":28855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 120.0374 Da; putative annotation: N/A; putative formula: C3H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.115,"smiles":null,"spectrum_id":"CCMSLIB00017266359","spectrum_index":28856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 676.2374 Da; putative annotation: N/A; putative formula: C47H28N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.319,"smiles":null,"spectrum_id":"CCMSLIB00017266362","spectrum_index":28857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004503 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 40.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.159,"smiles":null,"spectrum_id":"CCMSLIB00017266363","spectrum_index":28858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 126.0832 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.222,"smiles":null,"spectrum_id":"CCMSLIB00017266366","spectrum_index":28859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 527.2212 Da; putative annotation: N/A; putative formula: C21H37NO14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":835.407,"smiles":null,"spectrum_id":"CCMSLIB00017266369","spectrum_index":28860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 107.0583 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017266370","spectrum_index":28861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 402.2981 Da; putative annotation: N/A; putative formula: C22H42O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.358,"smiles":null,"spectrum_id":"CCMSLIB00017266373","spectrum_index":28862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 295.2942 Da; putative annotation: N/A; putative formula: C18H37N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.57,"smiles":null,"spectrum_id":"CCMSLIB00017266376","spectrum_index":28863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 153.0857 Da; putative annotation: N/A; putative formula: C3H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.185,"smiles":null,"spectrum_id":"CCMSLIB00017266377","spectrum_index":28864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PRENOL (delta mass: 60.037 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.117,"smiles":null,"spectrum_id":"CCMSLIB00017266380","spectrum_index":28865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 195.9928 Da; putative annotation: N/A; putative formula: C8H5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.073,"smiles":null,"spectrum_id":"CCMSLIB00017266383","spectrum_index":28866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Trp-Lys (delta mass: 18.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.236,"smiles":null,"spectrum_id":"CCMSLIB00017266384","spectrum_index":28867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 50.0156 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.092,"smiles":null,"spectrum_id":"CCMSLIB00017266387","spectrum_index":28868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 75.0535 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017266390","spectrum_index":28869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 18.0092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.2,"smiles":null,"spectrum_id":"CCMSLIB00017266391","spectrum_index":28870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 174.0687 Da; putative annotation: N/A; putative formula: C4H10N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.134,"smiles":null,"spectrum_id":"CCMSLIB00017266394","spectrum_index":28871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 70.0421 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.322,"smiles":null,"spectrum_id":"CCMSLIB00017266397","spectrum_index":28872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 679.355 Da; putative annotation: N/A; putative formula: C33H65N3O-1S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.541,"smiles":null,"spectrum_id":"CCMSLIB00017266398","spectrum_index":28873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Asp (delta mass: 71.0737 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.203,"smiles":null,"spectrum_id":"CCMSLIB00017266401","spectrum_index":28874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 70.0408 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.137,"smiles":null,"spectrum_id":"CCMSLIB00017266404","spectrum_index":28875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 54.0285 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.109,"smiles":null,"spectrum_id":"CCMSLIB00017266407","spectrum_index":28876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 212.1301 Da; putative annotation: N/A; putative formula: C8H17N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.206,"smiles":null,"spectrum_id":"CCMSLIB00017266408","spectrum_index":28877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 204.0727 Da; putative annotation: N/A; putative formula: C4H4N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.148,"smiles":null,"spectrum_id":"CCMSLIB00017266411","spectrum_index":28878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 162.0373 Da; putative annotation: N/A; putative formula: C5H11N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.207,"smiles":null,"spectrum_id":"CCMSLIB00017266414","spectrum_index":28879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 541.309 Da; putative annotation: N/A; putative formula: C37H39N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.369,"smiles":null,"spectrum_id":"CCMSLIB00017266415","spectrum_index":28880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 394.4316 Da; putative annotation: N/A; putative formula: C26H54N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.523,"smiles":null,"spectrum_id":"CCMSLIB00017266418","spectrum_index":28881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 96.0247 Da; putative annotation: N/A; putative formula: C4H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.075,"smiles":null,"spectrum_id":"CCMSLIB00017266421","spectrum_index":28882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 86.0727 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.242,"smiles":null,"spectrum_id":"CCMSLIB00017266422","spectrum_index":28883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 155.0859 Da; putative annotation: N/A; putative formula: C8H14NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.163,"smiles":null,"spectrum_id":"CCMSLIB00017266425","spectrum_index":28884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 188.0508 Da; putative annotation: N/A; putative formula: C8H12O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.174,"smiles":null,"spectrum_id":"CCMSLIB00017266428","spectrum_index":28885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethoxycarbonyl)-3-phenylindole (delta mass: 83.0433 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.161,"smiles":null,"spectrum_id":"CCMSLIB00017266430","spectrum_index":28886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 185.1055 Da; putative annotation: N/A; putative formula: C9H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.181,"smiles":null,"spectrum_id":"CCMSLIB00017266432","spectrum_index":28887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 15.9934 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.116,"smiles":null,"spectrum_id":"CCMSLIB00017266435","spectrum_index":28888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 17.0261 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.117,"smiles":null,"spectrum_id":"CCMSLIB00017266437","spectrum_index":28889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 177.0893 Da; putative annotation: N/A; putative formula: C9H11N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017266439","spectrum_index":28890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 71.001 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.066,"smiles":null,"spectrum_id":"CCMSLIB00017266442","spectrum_index":28891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 9H-carbazole-3-carboxylate (delta mass: 73.0167 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.119,"smiles":null,"spectrum_id":"CCMSLIB00017266443","spectrum_index":28892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Threonine (delta mass: 28.9983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.064,"smiles":null,"spectrum_id":"CCMSLIB00017266446","spectrum_index":28893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 386.1936 Da; putative annotation: N/A; putative formula: C19H30O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.306,"smiles":null,"spectrum_id":"CCMSLIB00017266449","spectrum_index":28894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 42.0114 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.098,"smiles":null,"spectrum_id":"CCMSLIB00017266452","spectrum_index":28895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 270.2196 Da; putative annotation: N/A; putative formula: C16H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.316,"smiles":null,"spectrum_id":"CCMSLIB00017266453","spectrum_index":28896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 24.0363 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.084,"smiles":null,"spectrum_id":"CCMSLIB00017266456","spectrum_index":28897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 124.0308 Da; putative annotation: N/A; putative formula: C10H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.065,"smiles":null,"spectrum_id":"CCMSLIB00017266459","spectrum_index":28898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 40.999 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.044,"smiles":null,"spectrum_id":"CCMSLIB00017266461","spectrum_index":28899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 281.1629 Da; putative annotation: N/A; putative formula: C15H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.301,"smiles":null,"spectrum_id":"CCMSLIB00017266463","spectrum_index":28900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 38.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017266466","spectrum_index":28901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 232.037 Da; putative annotation: N/A; putative formula: C12H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.097,"smiles":null,"spectrum_id":"CCMSLIB00017266469","spectrum_index":28902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 145.0719 Da; putative annotation: N/A; putative formula: C2H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.153,"smiles":null,"spectrum_id":"CCMSLIB00017266470","spectrum_index":28903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 45.0215 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.081,"smiles":null,"spectrum_id":"CCMSLIB00017266473","spectrum_index":28904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 31.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.154,"smiles":null,"spectrum_id":"CCMSLIB00017266476","spectrum_index":28905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Aminobutyl)hydroxylamine (delta mass: 342.1109 Da; putative annotation: N/A; putative formula: C11H24N2O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.213,"smiles":null,"spectrum_id":"CCMSLIB00017266477","spectrum_index":28906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 216.0392 Da; putative annotation: N/A; putative formula: C8H12N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.136,"smiles":null,"spectrum_id":"CCMSLIB00017266480","spectrum_index":28907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304150 Indole-3-acetyl-L-glutamic acid (delta mass: 321.1446 Da; putative annotation: N/A; putative formula: C15H23N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.258,"smiles":null,"spectrum_id":"CCMSLIB00017266483","spectrum_index":28908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 60.0 eV (delta mass: 54.0106 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.086,"smiles":null,"spectrum_id":"CCMSLIB00017266484","spectrum_index":28909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 160.0608 Da; putative annotation: N/A; putative formula: C5H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.152,"smiles":null,"spectrum_id":"CCMSLIB00017266487","spectrum_index":28910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 45.0205 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.146,"smiles":null,"spectrum_id":"CCMSLIB00017266490","spectrum_index":28911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 184.0726 Da; putative annotation: N/A; putative formula: C9H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.19,"smiles":null,"spectrum_id":"CCMSLIB00017266491","spectrum_index":28912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 835.5893 Da; putative annotation: N/A; putative formula: C42H77N9O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":968.665,"smiles":null,"spectrum_id":"CCMSLIB00017266494","spectrum_index":28913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 243.1115 Da; putative annotation: N/A; putative formula: C12H21NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.276,"smiles":null,"spectrum_id":"CCMSLIB00017266497","spectrum_index":28914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 125.1209 Da; putative annotation: N/A; putative formula: C8H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.301,"smiles":null,"spectrum_id":"CCMSLIB00017266498","spectrum_index":28915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.144,"smiles":null,"spectrum_id":"CCMSLIB00017266501","spectrum_index":28916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 41.013 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.11,"smiles":null,"spectrum_id":"CCMSLIB00017266504","spectrum_index":28917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 71.0369 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017266505","spectrum_index":28918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 211.0843 Da; putative annotation: N/A; putative formula: C10H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.176,"smiles":null,"spectrum_id":"CCMSLIB00017266508","spectrum_index":28919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid (delta mass: 62.0066 Da; putative annotation: N/A; putative formula: H3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.102,"smiles":null,"spectrum_id":"CCMSLIB00017266511","spectrum_index":28920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 289.1275 Da; putative annotation: N/A; putative formula: C11H19N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.187,"smiles":null,"spectrum_id":"CCMSLIB00017266512","spectrum_index":28921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 331.1634 Da; putative annotation: N/A; putative formula: C18H26N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.239,"smiles":null,"spectrum_id":"CCMSLIB00017266515","spectrum_index":28922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 28.0309 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.102,"smiles":null,"spectrum_id":"CCMSLIB00017266517","spectrum_index":28923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 54.1042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.201,"smiles":null,"spectrum_id":"CCMSLIB00017266519","spectrum_index":28924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 158.8228 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.945,"smiles":null,"spectrum_id":"CCMSLIB00017266522","spectrum_index":28925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 162.0534 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.171,"smiles":null,"spectrum_id":"CCMSLIB00017266525","spectrum_index":28926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 201.0461 Da; putative annotation: N/A; putative formula: C8H11NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.148,"smiles":null,"spectrum_id":"CCMSLIB00017266528","spectrum_index":28927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 312.2663 Da; putative annotation: N/A; putative formula: C19H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.326,"smiles":null,"spectrum_id":"CCMSLIB00017266529","spectrum_index":28928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 635.456 Da; putative annotation: N/A; putative formula: C41H57N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.527,"smiles":null,"spectrum_id":"CCMSLIB00017266532","spectrum_index":28929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.138,"smiles":null,"spectrum_id":"CCMSLIB00017266534","spectrum_index":28930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 255.4464 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.533,"smiles":null,"spectrum_id":"CCMSLIB00017266537","spectrum_index":28931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 75.0474 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017266539","spectrum_index":28932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Allylphenoxy)acetic acid (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017266542","spectrum_index":28933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 221.2151 Da; putative annotation: N/A; putative formula: C15H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.306,"smiles":null,"spectrum_id":"CCMSLIB00017266545","spectrum_index":28934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 453.6626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.776,"smiles":null,"spectrum_id":"CCMSLIB00017266546","spectrum_index":28935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 115.0731 Da; putative annotation: N/A; putative formula: H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.133,"smiles":null,"spectrum_id":"CCMSLIB00017266549","spectrum_index":28936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hapalindole D (delta mass: 35.9751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.148,"smiles":null,"spectrum_id":"CCMSLIB00017266552","spectrum_index":28937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 525.7664 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.837,"smiles":null,"spectrum_id":"CCMSLIB00017266553","spectrum_index":28938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 447.8348 Da; putative annotation: N/A; putative formula: C14H8OS8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.958,"smiles":null,"spectrum_id":"CCMSLIB00017266556","spectrum_index":28939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mycophenolic acid IV (delta mass: 23.0741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.27,"smiles":null,"spectrum_id":"CCMSLIB00017266559","spectrum_index":28940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 270.1473 Da; putative annotation: N/A; putative formula: C15H26S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.207,"smiles":null,"spectrum_id":"CCMSLIB00017266561","spectrum_index":28941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 294.3284 Da; putative annotation: N/A; putative formula: C21H42)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.399,"smiles":null,"spectrum_id":"CCMSLIB00017266564","spectrum_index":28942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 440.9529 Da; putative annotation: N/A; putative formula: C18H7N3O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.05,"smiles":null,"spectrum_id":"CCMSLIB00017266566","spectrum_index":28943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Gln-Lys (delta mass: 18.0096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.213,"smiles":null,"spectrum_id":"CCMSLIB00017266569","spectrum_index":28944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 870.1194 Da; putative annotation: N/A; putative formula: C28H38N6O18P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.22,"smiles":null,"spectrum_id":"CCMSLIB00017266572","spectrum_index":28945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 190.135 Da; putative annotation: N/A; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.311,"smiles":null,"spectrum_id":"CCMSLIB00017266575","spectrum_index":28946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 769.4618 Da; putative annotation: N/A; putative formula: C40H67NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":932.522,"smiles":null,"spectrum_id":"CCMSLIB00017266576","spectrum_index":28947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.117,"smiles":null,"spectrum_id":"CCMSLIB00017266579","spectrum_index":28948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017266581","spectrum_index":28949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 17.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.19,"smiles":null,"spectrum_id":"CCMSLIB00017266583","spectrum_index":28950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 494.2367 Da; putative annotation: N/A; putative formula: C28H30N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.417,"smiles":null,"spectrum_id":"CCMSLIB00017266586","spectrum_index":28951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 64.0161 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017266589","spectrum_index":28952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Thr (delta mass: 69.0617 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.18,"smiles":null,"spectrum_id":"CCMSLIB00017266590","spectrum_index":28953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 48.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.128,"smiles":null,"spectrum_id":"CCMSLIB00017266593","spectrum_index":28954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-2,5-Dimethoxyphenethylamine (delta mass: 49.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.116,"smiles":null,"spectrum_id":"CCMSLIB00017266596","spectrum_index":28955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 162.0517 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.221,"smiles":null,"spectrum_id":"CCMSLIB00017266597","spectrum_index":28956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 306.1106 Da; putative annotation: N/A; putative formula: C16H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.15,"smiles":null,"spectrum_id":"CCMSLIB00017266600","spectrum_index":28957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 130.1351 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.19,"smiles":null,"spectrum_id":"CCMSLIB00017266603","spectrum_index":28958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 114.0749 Da; putative annotation: N/A; putative formula: CH6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.214,"smiles":null,"spectrum_id":"CCMSLIB00017266604","spectrum_index":28959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 557.2555 Da; putative annotation: N/A; putative formula: C31H36N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.296,"smiles":null,"spectrum_id":"CCMSLIB00017266607","spectrum_index":28960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 241.1093 Da; putative annotation: N/A; putative formula: C9H16N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.206,"smiles":null,"spectrum_id":"CCMSLIB00017266610","spectrum_index":28961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 15.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.159,"smiles":null,"spectrum_id":"CCMSLIB00017266613","spectrum_index":28962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017266614","spectrum_index":28963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3S)-3-Hydroxyleucine (delta mass: 129.0423 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.139,"smiles":null,"spectrum_id":"CCMSLIB00017266617","spectrum_index":28964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentamycin_20eV (delta mass: 238.0979 Da; putative annotation: N/A; putative formula: C10H15N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.421,"smiles":null,"spectrum_id":"CCMSLIB00017266620","spectrum_index":28965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 206.1097 Da; putative annotation: N/A; putative formula: C16H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.185,"smiles":null,"spectrum_id":"CCMSLIB00017266621","spectrum_index":28966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Trifluoromethyl)pyrimidine-4-carboxylic acid (delta mass: 60.0488 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.071,"smiles":null,"spectrum_id":"CCMSLIB00017266624","spectrum_index":28967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 242.0964 Da; putative annotation: N/A; putative formula: C16H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.172,"smiles":null,"spectrum_id":"CCMSLIB00017266627","spectrum_index":28968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 377.2236 Da; putative annotation: N/A; putative formula: C18H35NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.294,"smiles":null,"spectrum_id":"CCMSLIB00017266629","spectrum_index":28969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flindersine CollisionEnergy:102040 (delta mass: 87.0144 Da; putative annotation: N/A; putative formula: C3H5NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.116,"smiles":null,"spectrum_id":"CCMSLIB00017266631","spectrum_index":28970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 154.1111 Da; putative annotation: N/A; putative formula: C8H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.182,"smiles":null,"spectrum_id":"CCMSLIB00017266634","spectrum_index":28971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 32.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017266637","spectrum_index":28972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 18.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.201,"smiles":null,"spectrum_id":"CCMSLIB00017266640","spectrum_index":28973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 128.0204 Da; putative annotation: N/A; putative formula: C6H9O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.153,"smiles":null,"spectrum_id":"CCMSLIB00017266641","spectrum_index":28974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 286.1684 Da; putative annotation: N/A; putative formula: C17H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.255,"smiles":null,"spectrum_id":"CCMSLIB00017266644","spectrum_index":28975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 230.1059 Da; putative annotation: N/A; putative formula: C6H14N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.182,"smiles":null,"spectrum_id":"CCMSLIB00017266647","spectrum_index":28976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spermine (delta mass: 310.0846 Da; putative annotation: N/A; putative formula: C10H20N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.308,"smiles":null,"spectrum_id":"CCMSLIB00017266648","spectrum_index":28977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 131.0537 Da; putative annotation: N/A; putative formula: CH5N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.14,"smiles":null,"spectrum_id":"CCMSLIB00017266651","spectrum_index":28978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 172.1456 Da; putative annotation: N/A; putative formula: C10H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.242,"smiles":null,"spectrum_id":"CCMSLIB00017266654","spectrum_index":28979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 191.8097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.88,"smiles":null,"spectrum_id":"CCMSLIB00017266655","spectrum_index":28980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311040 Threonylleucine (isomer of 809, 926) (delta mass: 113.0833 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.233,"smiles":null,"spectrum_id":"CCMSLIB00017266658","spectrum_index":28981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dehydrocoelenterazine (delta mass: 266.1035 Da; putative annotation: 4-Methoxy-N'-(phenylacetyl)benzohydrazide; putative formula: C16H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.253,"smiles":null,"spectrum_id":"CCMSLIB00017266661","spectrum_index":28982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 192.0629 Da; putative annotation: D-Glucoheptose; putative formula: C7H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.134,"smiles":null,"spectrum_id":"CCMSLIB00017266662","spectrum_index":28983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1086.5641 Da; putative annotation: (2S,3S,4S,5R,6R)-4-{[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxy-6-{[(1S,2R,4S,5R,10S,13R,17S)-2-hydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.0,?.0?,?.0?,?.0?,]tetracosan-10-yl]oxy}-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-2-carboxylic acid; putative formula: C54H86O22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1267.63,"smiles":null,"spectrum_id":"CCMSLIB00017266665","spectrum_index":28984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 250.0683 Da; putative annotation: N/A; putative formula: C9H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.155,"smiles":null,"spectrum_id":"CCMSLIB00017266668","spectrum_index":28985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 183.0227 Da; putative annotation: N/A; putative formula: C11H6NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.104,"smiles":null,"spectrum_id":"CCMSLIB00017266671","spectrum_index":28986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Nitrophenyl N-acetyl-alpha-galactosaminide CollisionEnergy:102040 (delta mass: 203.0891 Da; putative annotation: N/A; putative formula: C9H18NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.203,"smiles":null,"spectrum_id":"CCMSLIB00017266672","spectrum_index":28987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 17.9774 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.08,"smiles":null,"spectrum_id":"CCMSLIB00017266675","spectrum_index":28988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Gln (delta mass: 98.0009 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.178,"smiles":null,"spectrum_id":"CCMSLIB00017266678","spectrum_index":28989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 312.2715 Da; putative annotation: N/A; putative formula: C17H36N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.41,"smiles":null,"spectrum_id":"CCMSLIB00017266679","spectrum_index":28990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 66.0486 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.14,"smiles":null,"spectrum_id":"CCMSLIB00017266682","spectrum_index":28991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 114.0377 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.117,"smiles":null,"spectrum_id":"CCMSLIB00017266684","spectrum_index":28992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 22.0493 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.072,"smiles":null,"spectrum_id":"CCMSLIB00017266686","spectrum_index":28993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Ile (delta mass: 99.069 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.229,"smiles":null,"spectrum_id":"CCMSLIB00017266689","spectrum_index":28994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 156.1148 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.18,"smiles":null,"spectrum_id":"CCMSLIB00017266691","spectrum_index":28995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 58.0031 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.042,"smiles":null,"spectrum_id":"CCMSLIB00017266693","spectrum_index":28996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Decanol (delta mass: 27.0469 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.221,"smiles":null,"spectrum_id":"CCMSLIB00017266696","spectrum_index":28997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 213.1721 Da; putative annotation: N/A; putative formula: C12H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.274,"smiles":null,"spectrum_id":"CCMSLIB00017266699","spectrum_index":28998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 574.2838 Da; putative annotation: N/A; putative formula: C30H38N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":903.552,"smiles":null,"spectrum_id":"CCMSLIB00017266700","spectrum_index":28999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 173.3202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.5,"smiles":null,"spectrum_id":"CCMSLIB00017266703","spectrum_index":29000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 102.0971 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.163,"smiles":null,"spectrum_id":"CCMSLIB00017266706","spectrum_index":29001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 169.0747 Da; putative annotation: N/A; putative formula: C9H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.188,"smiles":null,"spectrum_id":"CCMSLIB00017266707","spectrum_index":29002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 402.2529 Da; putative annotation: N/A; putative formula: C24H38N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.318,"smiles":null,"spectrum_id":"CCMSLIB00017266710","spectrum_index":29003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 61.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.123,"smiles":null,"spectrum_id":"CCMSLIB00017266713","spectrum_index":29004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 136.0286 Da; putative annotation: N/A; putative formula: C6H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.099,"smiles":null,"spectrum_id":"CCMSLIB00017266714","spectrum_index":29005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 58.0423 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.138,"smiles":null,"spectrum_id":"CCMSLIB00017266717","spectrum_index":29006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 40.0675 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.217,"smiles":null,"spectrum_id":"CCMSLIB00017266720","spectrum_index":29007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 94.9799 Da; putative annotation: N/A; putative formula: CH-2N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.057,"smiles":null,"spectrum_id":"CCMSLIB00017266721","spectrum_index":29008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 372.1794 Da; putative annotation: N/A; putative formula: C19H32O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.245,"smiles":null,"spectrum_id":"CCMSLIB00017266724","spectrum_index":29009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 176.0304 Da; putative annotation: N/A; putative formula: C3H8N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.122,"smiles":null,"spectrum_id":"CCMSLIB00017266726","spectrum_index":29010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 40.1 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.171,"smiles":null,"spectrum_id":"CCMSLIB00017266728","spectrum_index":29011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 532.1642 Da; putative annotation: N/A; putative formula: C25H24N8O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.228,"smiles":null,"spectrum_id":"CCMSLIB00017266731","spectrum_index":29012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 84.0206 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.154,"smiles":null,"spectrum_id":"CCMSLIB00017266734","spectrum_index":29013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 35.9044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.985,"smiles":null,"spectrum_id":"CCMSLIB00017266735","spectrum_index":29014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 600.3989 Da; putative annotation: N/A; putative formula: C31H56N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.47,"smiles":null,"spectrum_id":"CCMSLIB00017266738","spectrum_index":29015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 66.0489 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.339,"smiles":null,"spectrum_id":"CCMSLIB00017266741","spectrum_index":29016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ramosetron (delta mass: 141.0747 Da; putative annotation: N/A; putative formula: C3H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.219,"smiles":null,"spectrum_id":"CCMSLIB00017266742","spectrum_index":29017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 132.876 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.936,"smiles":null,"spectrum_id":"CCMSLIB00017266745","spectrum_index":29018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301340 Ethylbeta-carboline (delta mass: 16.9799 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.087,"smiles":null,"spectrum_id":"CCMSLIB00017266748","spectrum_index":29019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 124.0409 Da; putative annotation: N/A; putative formula: C9H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.159,"smiles":null,"spectrum_id":"CCMSLIB00017266751","spectrum_index":29020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Ile (delta mass: 152.0941 Da; putative annotation: N/A; putative formula: C8H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.255,"smiles":null,"spectrum_id":"CCMSLIB00017266752","spectrum_index":29021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 42.0272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.14,"smiles":null,"spectrum_id":"CCMSLIB00017266755","spectrum_index":29022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Chlorobenzyl)-2-(1H-indol-3-yl)ethanamine (delta mass: 162.0435 Da; putative annotation: N/A; putative formula: C8H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.159,"smiles":null,"spectrum_id":"CCMSLIB00017266758","spectrum_index":29023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paprotrain (delta mass: 78.0184 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.121,"smiles":null,"spectrum_id":"CCMSLIB00017266760","spectrum_index":29024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 835.6728 Da; putative annotation: N/A; putative formula: C51H97NOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1016.74,"smiles":null,"spectrum_id":"CCMSLIB00017266762","spectrum_index":29025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 547.371 Da; putative annotation: N/A; putative formula: C33H49N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.431,"smiles":null,"spectrum_id":"CCMSLIB00017266765","spectrum_index":29026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tapentadol (delta mass: 280.2413 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.427,"smiles":null,"spectrum_id":"CCMSLIB00017266768","spectrum_index":29027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 548.3554 Da; putative annotation: N/A; putative formula: C41H44N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":729.426,"smiles":null,"spectrum_id":"CCMSLIB00017266769","spectrum_index":29028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Laurotetanine (delta mass: 452.3309 Da; putative annotation: N/A; putative formula: C31H40N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.485,"smiles":null,"spectrum_id":"CCMSLIB00017266772","spectrum_index":29029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 38.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.14,"smiles":null,"spectrum_id":"CCMSLIB00017266775","spectrum_index":29030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 136.0525 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017266778","spectrum_index":29031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 297.1076 Da; putative annotation: N/A; putative formula: C11H15N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.178,"smiles":null,"spectrum_id":"CCMSLIB00017266779","spectrum_index":29032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 382.1474 Da; putative annotation: N/A; putative formula: C15H26O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.244,"smiles":null,"spectrum_id":"CCMSLIB00017266782","spectrum_index":29033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 158.0766 Da; putative annotation: N/A; putative formula: C8H14OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.217,"smiles":null,"spectrum_id":"CCMSLIB00017266785","spectrum_index":29034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Debromohymenialdisine (delta mass: 191.4519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.551,"smiles":null,"spectrum_id":"CCMSLIB00017266786","spectrum_index":29035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 501.149 Da; putative annotation: N/A; putative formula: C22H31NO8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.214,"smiles":null,"spectrum_id":"CCMSLIB00017266789","spectrum_index":29036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.107,"smiles":null,"spectrum_id":"CCMSLIB00017266792","spectrum_index":29037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 206.1653 Da; putative annotation: N/A; putative formula: C10H18N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.23,"smiles":null,"spectrum_id":"CCMSLIB00017266795","spectrum_index":29038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 188.1152 Da; putative annotation: N/A; putative formula: C10H21O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.239,"smiles":null,"spectrum_id":"CCMSLIB00017266798","spectrum_index":29039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 129.0422 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.181,"smiles":null,"spectrum_id":"CCMSLIB00017266799","spectrum_index":29040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 616.3921 Da; putative annotation: N/A; putative formula: C28H48N12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":797.463,"smiles":null,"spectrum_id":"CCMSLIB00017266802","spectrum_index":29041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methoxybenzaldehyde (delta mass: 196.0718 Da; putative annotation: N/A; putative formula: C14H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.126,"smiles":null,"spectrum_id":"CCMSLIB00017266805","spectrum_index":29042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 60.0034 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.074,"smiles":null,"spectrum_id":"CCMSLIB00017266806","spectrum_index":29043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminobenzoic acid (delta mass: 28.1038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.159,"smiles":null,"spectrum_id":"CCMSLIB00017266809","spectrum_index":29044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 188.2762 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.311,"smiles":null,"spectrum_id":"CCMSLIB00017266812","spectrum_index":29045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 200.1147 Da; putative annotation: N/A; putative formula: C11H21O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.36,"smiles":null,"spectrum_id":"CCMSLIB00017266815","spectrum_index":29046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 81.0685 Da; putative annotation: N/A; putative formula: C4H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.166,"smiles":null,"spectrum_id":"CCMSLIB00017266816","spectrum_index":29047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 49.0377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.097,"smiles":null,"spectrum_id":"CCMSLIB00017266819","spectrum_index":29048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 94.0629 Da; putative annotation: N/A; putative formula: C4H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.16,"smiles":null,"spectrum_id":"CCMSLIB00017266822","spectrum_index":29049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 124.0529 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.118,"smiles":null,"spectrum_id":"CCMSLIB00017266823","spectrum_index":29050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(1H-Imidazol-4-yl)ethyl]-N'-(2-phenylethyl)thiourea (delta mass: 103.0544 Da; putative annotation: N/A; putative formula: C4H10NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.187,"smiles":null,"spectrum_id":"CCMSLIB00017266826","spectrum_index":29051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 58.0415 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.139,"smiles":null,"spectrum_id":"CCMSLIB00017266829","spectrum_index":29052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 27.0554 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.158,"smiles":null,"spectrum_id":"CCMSLIB00017266830","spectrum_index":29053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 38.0069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.073,"smiles":null,"spectrum_id":"CCMSLIB00017266833","spectrum_index":29054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 22.4414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.517,"smiles":null,"spectrum_id":"CCMSLIB00017266836","spectrum_index":29055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 366.1442 Da; putative annotation: N/A; putative formula: C26H22S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.242,"smiles":null,"spectrum_id":"CCMSLIB00017266837","spectrum_index":29056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 139.0532 Da; putative annotation: N/A; putative formula: C9H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.13,"smiles":null,"spectrum_id":"CCMSLIB00017266840","spectrum_index":29057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 69.9939 Da; putative annotation: N/A; putative formula: C5H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.081,"smiles":null,"spectrum_id":"CCMSLIB00017266843","spectrum_index":29058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 159.0827 Da; putative annotation: N/A; putative formula: C6H13N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.194,"smiles":null,"spectrum_id":"CCMSLIB00017266846","spectrum_index":29059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 168.1163 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.24,"smiles":null,"spectrum_id":"CCMSLIB00017266847","spectrum_index":29060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 59.0246 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.116,"smiles":null,"spectrum_id":"CCMSLIB00017266850","spectrum_index":29061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 124.117 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.198,"smiles":null,"spectrum_id":"CCMSLIB00017266853","spectrum_index":29062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 388.1066 Da; putative annotation: N/A; putative formula: C15H16N8O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.165,"smiles":null,"spectrum_id":"CCMSLIB00017266854","spectrum_index":29063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MMV675993 (delta mass: 170.1205 Da; putative annotation: N/A; putative formula: C12H14N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.282,"smiles":null,"spectrum_id":"CCMSLIB00017266857","spectrum_index":29064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 5.9965 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.083,"smiles":null,"spectrum_id":"CCMSLIB00017266860","spectrum_index":29065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 196.1973 Da; putative annotation: N/A; putative formula: C12H24N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.32,"smiles":null,"spectrum_id":"CCMSLIB00017266862","spectrum_index":29066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 297.3027 Da; putative annotation: N/A; putative formula: C19H39NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.373,"smiles":null,"spectrum_id":"CCMSLIB00017266864","spectrum_index":29067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 151.036 Da; putative annotation: N/A; putative formula: C2HN9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.09,"smiles":null,"spectrum_id":"CCMSLIB00017266867","spectrum_index":29068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 53.0111 Da; putative annotation: N/A; putative formula: H-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.16,"smiles":null,"spectrum_id":"CCMSLIB00017266869","spectrum_index":29069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 175.0426 Da; putative annotation: N/A; putative formula: C13H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.196,"smiles":null,"spectrum_id":"CCMSLIB00017266871","spectrum_index":29070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 33.0467 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.144,"smiles":null,"spectrum_id":"CCMSLIB00017266874","spectrum_index":29071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 206.1122 Da; putative annotation: N/A; putative formula: C5H14N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.261,"smiles":null,"spectrum_id":"CCMSLIB00017266876","spectrum_index":29072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 12.0001 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.034,"smiles":null,"spectrum_id":"CCMSLIB00017266878","spectrum_index":29073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 142.0411 Da; putative annotation: N/A; putative formula: C4H7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.19,"smiles":null,"spectrum_id":"CCMSLIB00017266881","spectrum_index":29074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.149,"smiles":null,"spectrum_id":"CCMSLIB00017266884","spectrum_index":29075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptoline (delta mass: 241.8056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.913,"smiles":null,"spectrum_id":"CCMSLIB00017266887","spectrum_index":29076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 487.6726 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.785,"smiles":null,"spectrum_id":"CCMSLIB00017266888","spectrum_index":29077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 379.0919 Da; putative annotation: N/A; putative formula: C11H21N7O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.189,"smiles":null,"spectrum_id":"CCMSLIB00017266891","spectrum_index":29078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 194.0398 Da; putative annotation: N/A; putative formula: C12H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.204,"smiles":null,"spectrum_id":"CCMSLIB00017266894","spectrum_index":29079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 306.2624 Da; putative annotation: N/A; putative formula: C15H30N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.316,"smiles":null,"spectrum_id":"CCMSLIB00017266895","spectrum_index":29080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 27.9772 Da; putative annotation: N/A; putative formula: CO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.032,"smiles":null,"spectrum_id":"CCMSLIB00017266898","spectrum_index":29081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 63.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.186,"smiles":null,"spectrum_id":"CCMSLIB00017266901","spectrum_index":29082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 369.2444 Da; putative annotation: N/A; putative formula: C21H32N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.346,"smiles":null,"spectrum_id":"CCMSLIB00017266902","spectrum_index":29083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU118605 3-Methyl-3,4-dihydro-2H-1,4-benzoxazine (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017266905","spectrum_index":29084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 113.0614 Da; putative annotation: N/A; putative formula: C9H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.14,"smiles":null,"spectrum_id":"CCMSLIB00017266907","spectrum_index":29085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 81.0352 Da; putative annotation: N/A; putative formula: C3H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017266909","spectrum_index":29086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 641.2686 Da; putative annotation: N/A; putative formula: C36H35N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.339,"smiles":null,"spectrum_id":"CCMSLIB00017266912","spectrum_index":29087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 689.4685 Da; putative annotation: N/A; putative formula: C40H67NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":852.529,"smiles":null,"spectrum_id":"CCMSLIB00017266915","spectrum_index":29088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 147.0758 Da; putative annotation: N/A; putative formula: C3H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.215,"smiles":null,"spectrum_id":"CCMSLIB00017266918","spectrum_index":29089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000501 5-methoxyindole-3-carbaldehyde (delta mass: 103.0264 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.097,"smiles":null,"spectrum_id":"CCMSLIB00017266919","spectrum_index":29090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Lys (delta mass: 136.0385 Da; putative annotation: N/A; putative formula: C5H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.235,"smiles":null,"spectrum_id":"CCMSLIB00017266922","spectrum_index":29091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 365.1711 Da; putative annotation: N/A; putative formula: C17H19N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.242,"smiles":null,"spectrum_id":"CCMSLIB00017266925","spectrum_index":29092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 222.2295 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.347,"smiles":null,"spectrum_id":"CCMSLIB00017266926","spectrum_index":29093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 99.0398 Da; putative annotation: N/A; putative formula: C3H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.111,"smiles":null,"spectrum_id":"CCMSLIB00017266929","spectrum_index":29094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 17.0127 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.147,"smiles":null,"spectrum_id":"CCMSLIB00017266932","spectrum_index":29095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 67.0569 Da; putative annotation: N/A; putative formula: C3H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.196,"smiles":null,"spectrum_id":"CCMSLIB00017266933","spectrum_index":29096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 63.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.108,"smiles":null,"spectrum_id":"CCMSLIB00017266936","spectrum_index":29097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-tyrosine (delta mass: 59.0366 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.128,"smiles":null,"spectrum_id":"CCMSLIB00017266939","spectrum_index":29098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 136.0686 Da; putative annotation: N/A; putative formula: C12H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.128,"smiles":null,"spectrum_id":"CCMSLIB00017266941","spectrum_index":29099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 141.065 Da; putative annotation: N/A; putative formula: C4H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.188,"smiles":null,"spectrum_id":"CCMSLIB00017266944","spectrum_index":29100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 132.0574 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.128,"smiles":null,"spectrum_id":"CCMSLIB00017266946","spectrum_index":29101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 92.0475 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.161,"smiles":null,"spectrum_id":"CCMSLIB00017266949","spectrum_index":29102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 92.0362 Da; putative annotation: N/A; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.086,"smiles":null,"spectrum_id":"CCMSLIB00017266951","spectrum_index":29103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 64.0164 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.076,"smiles":null,"spectrum_id":"CCMSLIB00017266954","spectrum_index":29104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 173.0486 Da; putative annotation: N/A; putative formula: C3H7N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.125,"smiles":null,"spectrum_id":"CCMSLIB00017266957","spectrum_index":29105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 258.1514 Da; putative annotation: N/A; putative formula: C11H22N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.263,"smiles":null,"spectrum_id":"CCMSLIB00017266959","spectrum_index":29106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 66.0582 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017266961","spectrum_index":29107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 3.44 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.5,"smiles":null,"spectrum_id":"CCMSLIB00017266964","spectrum_index":29108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSAMINE (delta mass: 186.1005 Da; putative annotation: N/A; putative formula: C8H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.187,"smiles":null,"spectrum_id":"CCMSLIB00017266967","spectrum_index":29109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 317.1307 Da; putative annotation: N/A; putative formula: C15H27NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.555,"smiles":null,"spectrum_id":"CCMSLIB00017266968","spectrum_index":29110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 737.7682 Da; putative annotation: N/A; putative formula: C49H95N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1047.88,"smiles":null,"spectrum_id":"CCMSLIB00017266971","spectrum_index":29111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 70.1615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.258,"smiles":null,"spectrum_id":"CCMSLIB00017266974","spectrum_index":29112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 207.1068 Da; putative annotation: N/A; putative formula: C6H18N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.204,"smiles":null,"spectrum_id":"CCMSLIB00017266977","spectrum_index":29113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 133.034 Da; putative annotation: N/A; putative formula: C8H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.158,"smiles":null,"spectrum_id":"CCMSLIB00017266978","spectrum_index":29114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 508.2862 Da; putative annotation: N/A; putative formula: C28H44O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.346,"smiles":null,"spectrum_id":"CCMSLIB00017266981","spectrum_index":29115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 91.0633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.129,"smiles":null,"spectrum_id":"CCMSLIB00017266984","spectrum_index":29116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 37.0325 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.145,"smiles":null,"spectrum_id":"CCMSLIB00017266985","spectrum_index":29117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 106.036 Da; putative annotation: N/A; putative formula: C2H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.19,"smiles":null,"spectrum_id":"CCMSLIB00017266988","spectrum_index":29118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-alpha-D-glucosamine - 40.0 eV (delta mass: 321.1009 Da; putative annotation: N/A; putative formula: C20H19NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.198,"smiles":null,"spectrum_id":"CCMSLIB00017266991","spectrum_index":29119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 158.0367 Da; putative annotation: N/A; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.123,"smiles":null,"spectrum_id":"CCMSLIB00017266994","spectrum_index":29120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 783.4775 Da; putative annotation: N/A; putative formula: C41H69NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.538,"smiles":null,"spectrum_id":"CCMSLIB00017266995","spectrum_index":29121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 872.4779 Da; putative annotation: N/A; putative formula: C66H64O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1035.54,"smiles":null,"spectrum_id":"CCMSLIB00017266998","spectrum_index":29122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 85.0274 Da; putative annotation: N/A; putative formula: C2H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.114,"smiles":null,"spectrum_id":"CCMSLIB00017267001","spectrum_index":29123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 292.204 Da; putative annotation: N/A; putative formula: C18H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.301,"smiles":null,"spectrum_id":"CCMSLIB00017267002","spectrum_index":29124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017267005","spectrum_index":29125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[3-(2-Carboxyethyl)-4-methylpyrrol-2-methylidenyl]-2-indolinone (delta mass: 23.022 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.145,"smiles":null,"spectrum_id":"CCMSLIB00017267008","spectrum_index":29126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 232.089 Da; putative annotation: N/A; putative formula: C17H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.248,"smiles":null,"spectrum_id":"CCMSLIB00017267009","spectrum_index":29127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Longicaulenone (delta mass: 68.062 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017267012","spectrum_index":29128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 216.0784 Da; putative annotation: N/A; putative formula: C13H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.175,"smiles":null,"spectrum_id":"CCMSLIB00017267015","spectrum_index":29129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 114.1156 Da; putative annotation: N/A; putative formula: C6H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.202,"smiles":null,"spectrum_id":"CCMSLIB00017267016","spectrum_index":29130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 234.1216 Da; putative annotation: N/A; putative formula: C9H18N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.202,"smiles":null,"spectrum_id":"CCMSLIB00017267019","spectrum_index":29131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 75.0474 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.149,"smiles":null,"spectrum_id":"CCMSLIB00017267022","spectrum_index":29132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid, 4-(7,8,9,10-tetrahydro-5,7,7,10,10-pentamethyl-5H-benzo[e]naphtho[2,3-b][1,4]diazepin-13-yl)- (delta mass: 380.2389 Da; putative annotation: N/A; putative formula: C16H39N4P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":819.477,"smiles":null,"spectrum_id":"CCMSLIB00017267023","spectrum_index":29133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palatinose (delta mass: 133.0385 Da; putative annotation: N/A; putative formula: C5H11NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.162,"smiles":null,"spectrum_id":"CCMSLIB00017267026","spectrum_index":29134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 303.205 Da; putative annotation: N/A; putative formula: C15H29NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.26,"smiles":null,"spectrum_id":"CCMSLIB00017267029","spectrum_index":29135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 55.9211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.06,"smiles":null,"spectrum_id":"CCMSLIB00017267030","spectrum_index":29136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 148.053 Da; putative annotation: N/A; putative formula: C2H8N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.139,"smiles":null,"spectrum_id":"CCMSLIB00017267033","spectrum_index":29137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geissoschizine methyl ether (delta mass: 31.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.233,"smiles":null,"spectrum_id":"CCMSLIB00017267036","spectrum_index":29138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethoxyethoxyethanol (delta mass: 175.121 Da; putative annotation: N/A; putative formula: C8H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.223,"smiles":null,"spectrum_id":"CCMSLIB00017267039","spectrum_index":29139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 413.1499 Da; putative annotation: N/A; putative formula: C24H15N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.21,"smiles":null,"spectrum_id":"CCMSLIB00017267040","spectrum_index":29140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 170.0748 Da; putative annotation: N/A; putative formula: C5H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.151,"smiles":null,"spectrum_id":"CCMSLIB00017267043","spectrum_index":29141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 618.3206 Da; putative annotation: N/A; putative formula: C38H42N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1293.57,"smiles":null,"spectrum_id":"CCMSLIB00017267046","spectrum_index":29142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 220.2193 Da; putative annotation: N/A; putative formula: C16H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.306,"smiles":null,"spectrum_id":"CCMSLIB00017267047","spectrum_index":29143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 67.8362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.939,"smiles":null,"spectrum_id":"CCMSLIB00017267050","spectrum_index":29144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 50.9175 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.973,"smiles":null,"spectrum_id":"CCMSLIB00017267051","spectrum_index":29145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid; AIF: CE0; MS2Dec (delta mass: 87.1054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.176,"smiles":null,"spectrum_id":"CCMSLIB00017267054","spectrum_index":29146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 373.2104 Da; putative annotation: N/A; putative formula: C18H31NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.271,"smiles":null,"spectrum_id":"CCMSLIB00017267057","spectrum_index":29147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 130.0638 Da; putative annotation: N/A; putative formula: C7H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.139,"smiles":null,"spectrum_id":"CCMSLIB00017267059","spectrum_index":29148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 126.0674 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.143,"smiles":null,"spectrum_id":"CCMSLIB00017267062","spectrum_index":29149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-(Difluoromethylthio)phenyl)-N-methylmethanamine (delta mass: 166.1212 Da; putative annotation: N/A; putative formula: C8H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.186,"smiles":null,"spectrum_id":"CCMSLIB00017267064","spectrum_index":29150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 125.0609 Da; putative annotation: 1-Naphthylamine; putative formula: C10H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.142,"smiles":null,"spectrum_id":"CCMSLIB00017267066","spectrum_index":29151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 113.0849 Da; putative annotation: Massbank:PB000396 Isoleucine|2-amino-3-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017267069","spectrum_index":29152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 101.0474 Da; putative annotation: L-homoserine CollisionEnergy:102040; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.124,"smiles":null,"spectrum_id":"CCMSLIB00017267072","spectrum_index":29153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Man3 a (delta mass: 151.0549 Da; putative annotation: Guanidine, N-(4-fluorophenyl)-N'-hydroxy-; putative formula: C7H6FN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1062.39,"smiles":null,"spectrum_id":"CCMSLIB00017267074","spectrum_index":29154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 124.016 Da; putative annotation: 5-HYDROXYMETHYL-2-FURANCARBOXYLIC ACID; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.102,"smiles":null,"spectrum_id":"CCMSLIB00017267076","spectrum_index":29155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 310.1054 Da; putative annotation: 3-(4-(.beta.-D-Glucopyranosyloxy)phenyl)propanoic acid; putative formula: C15H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.176,"smiles":null,"spectrum_id":"CCMSLIB00017267079","spectrum_index":29156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 125.0846 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.155,"smiles":null,"spectrum_id":"CCMSLIB00017267082","spectrum_index":29157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[2-(2-Furyl)-2-oxoethyl]-3-hydroxy-5-nitro-1,3-dihydro-2H-indol-2-one (delta mass: 2.1136 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017267084","spectrum_index":29158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 35.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.217,"smiles":null,"spectrum_id":"CCMSLIB00017267086","spectrum_index":29159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 286.1058 Da; putative annotation: N/A; putative formula: C6H18N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.255,"smiles":null,"spectrum_id":"CCMSLIB00017267089","spectrum_index":29160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 252.2527 Da; putative annotation: N/A; putative formula: C16H32N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.339,"smiles":null,"spectrum_id":"CCMSLIB00017267091","spectrum_index":29161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 174.1667 Da; putative annotation: N/A; putative formula: C5H18N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.305,"smiles":null,"spectrum_id":"CCMSLIB00017267093","spectrum_index":29162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 253.1161 Da; putative annotation: N/A; putative formula: C9H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.186,"smiles":null,"spectrum_id":"CCMSLIB00017267096","spectrum_index":29163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 722.0504 Da; putative annotation: N/A; putative formula: C25H29N2O15P3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.105,"smiles":null,"spectrum_id":"CCMSLIB00017267099","spectrum_index":29164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.075,"smiles":null,"spectrum_id":"CCMSLIB00017267100","spectrum_index":29165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 312.2739 Da; putative annotation: N/A; putative formula: C14H32N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.349,"smiles":null,"spectrum_id":"CCMSLIB00017267103","spectrum_index":29166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 73.0169 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.065,"smiles":null,"spectrum_id":"CCMSLIB00017267106","spectrum_index":29167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-3-carbaldehyde (delta mass: 31.0138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.064,"smiles":null,"spectrum_id":"CCMSLIB00017267107","spectrum_index":29168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 60.0569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.143,"smiles":null,"spectrum_id":"CCMSLIB00017267110","spectrum_index":29169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 115.0271 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.151,"smiles":null,"spectrum_id":"CCMSLIB00017267113","spectrum_index":29170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 68.038 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.137,"smiles":null,"spectrum_id":"CCMSLIB00017267114","spectrum_index":29171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 72.0421 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.176,"smiles":null,"spectrum_id":"CCMSLIB00017267117","spectrum_index":29172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Fenoterol (delta mass: 18.0057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.16,"smiles":null,"spectrum_id":"CCMSLIB00017267120","spectrum_index":29173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 602.1632 Da; putative annotation: N/A; putative formula: C27H26N10O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.255,"smiles":null,"spectrum_id":"CCMSLIB00017267121","spectrum_index":29174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 795.4404 Da; putative annotation: N/A; putative formula: C41H65NO14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":976.511,"smiles":null,"spectrum_id":"CCMSLIB00017267124","spectrum_index":29175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 68.0325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.119,"smiles":null,"spectrum_id":"CCMSLIB00017267127","spectrum_index":29176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU022001 Labetalol|2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide (delta mass: 732.3919 Da; putative annotation: N/A; putative formula: C33H52N10O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1061.58,"smiles":null,"spectrum_id":"CCMSLIB00017267128","spectrum_index":29177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 98.0728 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.113,"smiles":null,"spectrum_id":"CCMSLIB00017267131","spectrum_index":29178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 194.0057 Da; putative annotation: N/A; putative formula: C10H2N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.101,"smiles":null,"spectrum_id":"CCMSLIB00017267134","spectrum_index":29179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 147.0533 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.15,"smiles":null,"spectrum_id":"CCMSLIB00017267136","spectrum_index":29180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 55.0427 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.14,"smiles":null,"spectrum_id":"CCMSLIB00017267139","spectrum_index":29181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 543.2981 Da; putative annotation: N/A; putative formula: C26H45N3O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.567,"smiles":null,"spectrum_id":"CCMSLIB00017267141","spectrum_index":29182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 156.094 Da; putative annotation: N/A; putative formula: C12H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.165,"smiles":null,"spectrum_id":"CCMSLIB00017267144","spectrum_index":29183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 114.0681 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.202,"smiles":null,"spectrum_id":"CCMSLIB00017267147","spectrum_index":29184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 116.0675 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.206,"smiles":null,"spectrum_id":"CCMSLIB00017267150","spectrum_index":29185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 150.1773 Da; putative annotation: N/A; putative formula: C12H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.237,"smiles":null,"spectrum_id":"CCMSLIB00017267151","spectrum_index":29186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 202.0609 Da; putative annotation: N/A; putative formula: C8H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.132,"smiles":null,"spectrum_id":"CCMSLIB00017267153","spectrum_index":29187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 304.1109 Da; putative annotation: N/A; putative formula: C13H16N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.234,"smiles":null,"spectrum_id":"CCMSLIB00017267156","spectrum_index":29188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Ergothioneine (delta mass: 189.0423 Da; putative annotation: N/A; putative formula: C10H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.138,"smiles":null,"spectrum_id":"CCMSLIB00017267159","spectrum_index":29189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169534-02_C14H18O9_Ethanone, 1-[4-(beta-D-glucopyranosyloxy)-2,6-dihydroxyphenyl]- (delta mass: 132.0402 Da; putative annotation: N/A; putative formula: C9H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.143,"smiles":null,"spectrum_id":"CCMSLIB00017267161","spectrum_index":29190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dioxy-creatinine - 40.0 eV (delta mass: 55.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.062,"smiles":null,"spectrum_id":"CCMSLIB00017267163","spectrum_index":29191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 357.1788 Da; putative annotation: N/A; putative formula: C17H27NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.307,"smiles":null,"spectrum_id":"CCMSLIB00017267166","spectrum_index":29192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 66.0468 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.289,"smiles":null,"spectrum_id":"CCMSLIB00017267169","spectrum_index":29193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 69.4294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.5,"smiles":null,"spectrum_id":"CCMSLIB00017267170","spectrum_index":29194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 109.0592 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.14,"smiles":null,"spectrum_id":"CCMSLIB00017267173","spectrum_index":29195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 604.4066 Da; putative annotation: N/A; putative formula: C46H52)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.467,"smiles":null,"spectrum_id":"CCMSLIB00017267176","spectrum_index":29196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 228.181 Da; putative annotation: N/A; putative formula: C8H20N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.32,"smiles":null,"spectrum_id":"CCMSLIB00017267177","spectrum_index":29197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 125.0857 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.24,"smiles":null,"spectrum_id":"CCMSLIB00017267180","spectrum_index":29198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.123,"smiles":null,"spectrum_id":"CCMSLIB00017267183","spectrum_index":29199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 89.0522 Da; putative annotation: N/A; putative formula: C2H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.138,"smiles":null,"spectrum_id":"CCMSLIB00017267184","spectrum_index":29200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 116.0463 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.174,"smiles":null,"spectrum_id":"CCMSLIB00017267187","spectrum_index":29201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 76.0714 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.34,"smiles":null,"spectrum_id":"CCMSLIB00017267190","spectrum_index":29202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 81.0065 Da; putative annotation: N/A; putative formula: CH-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.171,"smiles":null,"spectrum_id":"CCMSLIB00017267192","spectrum_index":29203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 284.1577 Da; putative annotation: N/A; putative formula: C13H25N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.283,"smiles":null,"spectrum_id":"CCMSLIB00017267195","spectrum_index":29204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 99.0751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.224,"smiles":null,"spectrum_id":"CCMSLIB00017267197","spectrum_index":29205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olaquindox (delta mass: 162.0623 Da; putative annotation: N/A; putative formula: C9H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.16,"smiles":null,"spectrum_id":"CCMSLIB00017267200","spectrum_index":29206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one (delta mass: 92.036 Da; putative annotation: N/A; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.063,"smiles":null,"spectrum_id":"CCMSLIB00017267203","spectrum_index":29207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 52.0279 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.093,"smiles":null,"spectrum_id":"CCMSLIB00017267205","spectrum_index":29208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 96.0675 Da; putative annotation: N/A; putative formula: C5H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.154,"smiles":null,"spectrum_id":"CCMSLIB00017267207","spectrum_index":29209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 21.0704 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.141,"smiles":null,"spectrum_id":"CCMSLIB00017267210","spectrum_index":29210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine D (delta mass: 138.0699 Da; putative annotation: N/A; putative formula: C7H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.251,"smiles":null,"spectrum_id":"CCMSLIB00017267213","spectrum_index":29211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 276.0824 Da; putative annotation: N/A; putative formula: C15H16O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.164,"smiles":null,"spectrum_id":"CCMSLIB00017267214","spectrum_index":29212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 625.3673 Da; putative annotation: N/A; putative formula: C29H55NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.404,"smiles":null,"spectrum_id":"CCMSLIB00017267217","spectrum_index":29213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 186.1369 Da; putative annotation: N/A; putative formula: C9H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.292,"smiles":null,"spectrum_id":"CCMSLIB00017267220","spectrum_index":29214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 575.4753 Da; putative annotation: N/A; putative formula: C29H57N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.535,"smiles":null,"spectrum_id":"CCMSLIB00017267221","spectrum_index":29215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 19.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.081,"smiles":null,"spectrum_id":"CCMSLIB00017267224","spectrum_index":29216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 143.1047 Da; putative annotation: N/A; putative formula: C6H13N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.186,"smiles":null,"spectrum_id":"CCMSLIB00017267226","spectrum_index":29217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 89.0477 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.075,"smiles":null,"spectrum_id":"CCMSLIB00017267229","spectrum_index":29218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 38.0169 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.119,"smiles":null,"spectrum_id":"CCMSLIB00017267231","spectrum_index":29219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 2.0498 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.127,"smiles":null,"spectrum_id":"CCMSLIB00017267234","spectrum_index":29220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 242.0196 Da; putative annotation: N/A; putative formula: C6H11O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.288,"smiles":null,"spectrum_id":"CCMSLIB00017267237","spectrum_index":29221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 440.1164 Da; putative annotation: N/A; putative formula: C22H24N4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.187,"smiles":null,"spectrum_id":"CCMSLIB00017267238","spectrum_index":29222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 125.0472 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017267241","spectrum_index":29223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 53.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.103,"smiles":null,"spectrum_id":"CCMSLIB00017267243","spectrum_index":29224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 200.0091 Da; putative annotation: N/A; putative formula: C4H9O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.133,"smiles":null,"spectrum_id":"CCMSLIB00017267245","spectrum_index":29225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 10.078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017267248","spectrum_index":29226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 56.0264 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.176,"smiles":null,"spectrum_id":"CCMSLIB00017267251","spectrum_index":29227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 346.3067 Da; putative annotation: N/A; putative formula: C24H42O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.398,"smiles":null,"spectrum_id":"CCMSLIB00017267252","spectrum_index":29228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-threonine; AIF; CE10; MS2Dec (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.103,"smiles":null,"spectrum_id":"CCMSLIB00017267255","spectrum_index":29229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 136.0874 Da; putative annotation: N/A; putative formula: C5H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":729.363,"smiles":null,"spectrum_id":"CCMSLIB00017267258","spectrum_index":29230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 718.2349 Da; putative annotation: N/A; putative formula: C41H38N2O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.295,"smiles":null,"spectrum_id":"CCMSLIB00017267259","spectrum_index":29231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP) (delta mass: 31.0434 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.157,"smiles":null,"spectrum_id":"CCMSLIB00017267262","spectrum_index":29232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 425.1169 Da; putative annotation: N/A; putative formula: C21H15N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.214,"smiles":null,"spectrum_id":"CCMSLIB00017267265","spectrum_index":29233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 88.0377 Da; putative annotation: N/A; putative formula: CH4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.312,"smiles":null,"spectrum_id":"CCMSLIB00017267267","spectrum_index":29234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 147.0532 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.181,"smiles":null,"spectrum_id":"CCMSLIB00017267269","spectrum_index":29235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diphenyl(4-piperidinyl)methanol (delta mass: 114.0512 Da; putative annotation: N/A; putative formula: C6H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.221,"smiles":null,"spectrum_id":"CCMSLIB00017267272","spectrum_index":29236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 181.2893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.36,"smiles":null,"spectrum_id":"CCMSLIB00017267274","spectrum_index":29237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 130.0977 Da; putative annotation: N/A; putative formula: C3H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.147,"smiles":null,"spectrum_id":"CCMSLIB00017267276","spectrum_index":29238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 225.0672 Da; putative annotation: N/A; putative formula: C7H15NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.138,"smiles":null,"spectrum_id":"CCMSLIB00017267279","spectrum_index":29239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017267281","spectrum_index":29240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 115.0266 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.097,"smiles":null,"spectrum_id":"CCMSLIB00017267283","spectrum_index":29241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.175,"smiles":null,"spectrum_id":"CCMSLIB00017267286","spectrum_index":29242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 59.0595 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.156,"smiles":null,"spectrum_id":"CCMSLIB00017267287","spectrum_index":29243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310825 N-Fructosyl isoleucine (delta mass: 220.0948 Da; putative annotation: N/A; putative formula: C9H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.25,"smiles":null,"spectrum_id":"CCMSLIB00017267290","spectrum_index":29244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 145.0915 Da; putative annotation: N/A; putative formula: C10H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.113,"smiles":null,"spectrum_id":"CCMSLIB00017267293","spectrum_index":29245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 146.0211 Da; putative annotation: N/A; putative formula: C5H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.048,"smiles":null,"spectrum_id":"CCMSLIB00017267294","spectrum_index":29246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terretonin (delta mass: 466.2162 Da; putative annotation: N/A; putative formula: C19H34N2O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":955.428,"smiles":null,"spectrum_id":"CCMSLIB00017267297","spectrum_index":29247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311056 Glutamylphenylalanine (isomer of 1503) (delta mass: 238.2303 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.359,"smiles":null,"spectrum_id":"CCMSLIB00017267300","spectrum_index":29248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 58.0987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.268,"smiles":null,"spectrum_id":"CCMSLIB00017267301","spectrum_index":29249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 112.0521 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.117,"smiles":null,"spectrum_id":"CCMSLIB00017267304","spectrum_index":29250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 110.0484 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.124,"smiles":null,"spectrum_id":"CCMSLIB00017267307","spectrum_index":29251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 41.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.091,"smiles":null,"spectrum_id":"CCMSLIB00017267308","spectrum_index":29252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 218.1334 Da; putative annotation: N/A; putative formula: C13H19N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.212,"smiles":null,"spectrum_id":"CCMSLIB00017267311","spectrum_index":29253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 179.0943 Da; putative annotation: N/A; putative formula: C10H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.185,"smiles":null,"spectrum_id":"CCMSLIB00017267314","spectrum_index":29254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 764.3017 Da; putative annotation: N/A; putative formula: C37H44N6O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":986.399,"smiles":null,"spectrum_id":"CCMSLIB00017267317","spectrum_index":29255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 325.2113 Da; putative annotation: N/A; putative formula: C15H27N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.344,"smiles":null,"spectrum_id":"CCMSLIB00017267318","spectrum_index":29256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 705.5813 Da; putative annotation: N/A; putative formula: C30H71N15O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.641,"smiles":null,"spectrum_id":"CCMSLIB00017267321","spectrum_index":29257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 818.4179 Da; putative annotation: N/A; putative formula: C31H58N14O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1097.52,"smiles":null,"spectrum_id":"CCMSLIB00017267324","spectrum_index":29258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Val (delta mass: 99.0687 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.223,"smiles":null,"spectrum_id":"CCMSLIB00017267326","spectrum_index":29259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 105.0787 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.143,"smiles":null,"spectrum_id":"CCMSLIB00017267328","spectrum_index":29260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.186,"smiles":null,"spectrum_id":"CCMSLIB00017267331","spectrum_index":29261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 226.2763 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.313,"smiles":null,"spectrum_id":"CCMSLIB00017267334","spectrum_index":29262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 104.0622 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.159,"smiles":null,"spectrum_id":"CCMSLIB00017267337","spectrum_index":29263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 365.3053 Da; putative annotation: N/A; putative formula: C21H39N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.429,"smiles":null,"spectrum_id":"CCMSLIB00017267339","spectrum_index":29264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 685.2691 Da; putative annotation: N/A; putative formula: C36H43N7OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1014.54,"smiles":null,"spectrum_id":"CCMSLIB00017267341","spectrum_index":29265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 191.058 Da; putative annotation: N/A; putative formula: C10H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.15,"smiles":null,"spectrum_id":"CCMSLIB00017267344","spectrum_index":29266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9H-Xanthene-4-acetic acid, 5,6-dimethyl-9-oxo- (delta mass: 60.0205 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.117,"smiles":null,"spectrum_id":"CCMSLIB00017267346","spectrum_index":29267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Ser (delta mass: 60.0358 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.144,"smiles":null,"spectrum_id":"CCMSLIB00017267348","spectrum_index":29268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 318.2338 Da; putative annotation: N/A; putative formula: C18H31N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.315,"smiles":null,"spectrum_id":"CCMSLIB00017267351","spectrum_index":29269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 159.0847 Da; putative annotation: N/A; putative formula: C6H13N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.16,"smiles":null,"spectrum_id":"CCMSLIB00017267354","spectrum_index":29270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Propenoic acid, 3-(2,4-dimethoxyphenyl)-, (E)- (delta mass: 46.0051 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.086,"smiles":null,"spectrum_id":"CCMSLIB00017267355","spectrum_index":29271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347453-02!(E)-1,7-bis(4-hydroxyphenyl)hept-4-en-3-one (delta mass: 102.0114 Da; putative annotation: N/A; putative formula: H2N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.16,"smiles":null,"spectrum_id":"CCMSLIB00017267358","spectrum_index":29272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 441.2226 Da; putative annotation: N/A; putative formula: C19H31N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.314,"smiles":null,"spectrum_id":"CCMSLIB00017267361","spectrum_index":29273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 77.923 Da; putative annotation: N/A; putative formula: H-2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.983,"smiles":null,"spectrum_id":"CCMSLIB00017267362","spectrum_index":29274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 56.9814 Da; putative annotation: N/A; putative formula: H-1N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.042,"smiles":null,"spectrum_id":"CCMSLIB00017267365","spectrum_index":29275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 673.366 Da; putative annotation: N/A; putative formula: C30H47N11O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.437,"smiles":null,"spectrum_id":"CCMSLIB00017267368","spectrum_index":29276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 153.1161 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.24,"smiles":null,"spectrum_id":"CCMSLIB00017267369","spectrum_index":29277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 4.1664 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.139,"smiles":null,"spectrum_id":"CCMSLIB00017267372","spectrum_index":29278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 26.0157 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.118,"smiles":null,"spectrum_id":"CCMSLIB00017267374","spectrum_index":29279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 140.1854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.22,"smiles":null,"spectrum_id":"CCMSLIB00017267376","spectrum_index":29280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 130.0454 Da; putative annotation: N/A; putative formula: C6H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.134,"smiles":null,"spectrum_id":"CCMSLIB00017267379","spectrum_index":29281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 72.0642 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017267382","spectrum_index":29282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 177.116 Da; putative annotation: N/A; putative formula: C11H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.234,"smiles":null,"spectrum_id":"CCMSLIB00017267383","spectrum_index":29283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE10; CorrDec (delta mass: 303.0848 Da; putative annotation: N/A; putative formula: C16H18NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.182,"smiles":null,"spectrum_id":"CCMSLIB00017267386","spectrum_index":29284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Di-p-coumaroylputrescine (delta mass: 205.1101 Da; putative annotation: N/A; putative formula: C12H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.291,"smiles":null,"spectrum_id":"CCMSLIB00017267389","spectrum_index":29285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 95.1082 Da; putative annotation: N/A; putative formula: C7H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.149,"smiles":null,"spectrum_id":"CCMSLIB00017267390","spectrum_index":29286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 523.1593 Da; putative annotation: N/A; putative formula: C26H25N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.256,"smiles":null,"spectrum_id":"CCMSLIB00017267393","spectrum_index":29287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 502.1958 Da; putative annotation: N/A; putative formula: C18H30N8O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.256,"smiles":null,"spectrum_id":"CCMSLIB00017267396","spectrum_index":29288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 310.0825 Da; putative annotation: N/A; putative formula: C12H23O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.232,"smiles":null,"spectrum_id":"CCMSLIB00017267398","spectrum_index":29289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 202.1201 Da; putative annotation: N/A; putative formula: C10H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.279,"smiles":null,"spectrum_id":"CCMSLIB00017267401","spectrum_index":29290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 793.2876 Da; putative annotation: N/A; putative formula: C45H35N11O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1298.46,"smiles":null,"spectrum_id":"CCMSLIB00017267402","spectrum_index":29291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 74.0731 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017267405","spectrum_index":29292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 438.3183 Da; putative annotation: N/A; putative formula: C27H42N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.39,"smiles":null,"spectrum_id":"CCMSLIB00017267408","spectrum_index":29293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydro-10-phenophosphazinol 10-oxide (delta mass: 23.1064 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017267409","spectrum_index":29294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 10.006 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.124,"smiles":null,"spectrum_id":"CCMSLIB00017267412","spectrum_index":29295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 263.0891 Da; putative annotation: N/A; putative formula: C14H18NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.16,"smiles":null,"spectrum_id":"CCMSLIB00017267415","spectrum_index":29296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 189.1072 Da; putative annotation: N/A; putative formula: C12H16NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.203,"smiles":null,"spectrum_id":"CCMSLIB00017267416","spectrum_index":29297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 141.0794 Da; putative annotation: N/A; putative formula: C7H11NO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.139,"smiles":null,"spectrum_id":"CCMSLIB00017267419","spectrum_index":29298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 238.2266 Da; putative annotation: N/A; putative formula: C12H26N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.313,"smiles":null,"spectrum_id":"CCMSLIB00017267422","spectrum_index":29299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 58.0273 Da; putative annotation: N/A; putative formula: H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.092,"smiles":null,"spectrum_id":"CCMSLIB00017267423","spectrum_index":29300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.171,"smiles":null,"spectrum_id":"CCMSLIB00017267426","spectrum_index":29301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luzindole (delta mass: 77.0367 Da; putative annotation: N/A; putative formula: C4H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.202,"smiles":null,"spectrum_id":"CCMSLIB00017267429","spectrum_index":29302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 60.0815 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.179,"smiles":null,"spectrum_id":"CCMSLIB00017267430","spectrum_index":29303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1095.4621 Da; putative annotation: N/A; putative formula: C48H65N13O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1317.56,"smiles":null,"spectrum_id":"CCMSLIB00017267433","spectrum_index":29304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 95.0377 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.124,"smiles":null,"spectrum_id":"CCMSLIB00017267436","spectrum_index":29305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 64.0158 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.149,"smiles":null,"spectrum_id":"CCMSLIB00017267437","spectrum_index":29306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 25.9905 Da; putative annotation: N/A; putative formula: H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.17,"smiles":null,"spectrum_id":"CCMSLIB00017267440","spectrum_index":29307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 15.9956 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.077,"smiles":null,"spectrum_id":"CCMSLIB00017267443","spectrum_index":29308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 427.2363 Da; putative annotation: N/A; putative formula: C17H39N3O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.307,"smiles":null,"spectrum_id":"CCMSLIB00017267445","spectrum_index":29309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 24.4987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.57,"smiles":null,"spectrum_id":"CCMSLIB00017267447","spectrum_index":29310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 25.5087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.58,"smiles":null,"spectrum_id":"CCMSLIB00017267450","spectrum_index":29311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 134.0415 Da; putative annotation: N/A; putative formula: C5H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.128,"smiles":null,"spectrum_id":"CCMSLIB00017267453","spectrum_index":29312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR302327 Sinapoyl aldehyde (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.144,"smiles":null,"spectrum_id":"CCMSLIB00017267454","spectrum_index":29313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 45.1154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.28,"smiles":null,"spectrum_id":"CCMSLIB00017267457","spectrum_index":29314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 170.037 Da; putative annotation: N/A; putative formula: C11H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.108,"smiles":null,"spectrum_id":"CCMSLIB00017267460","spectrum_index":29315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 318.2916 Da; putative annotation: N/A; putative formula: C22H38O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.388,"smiles":null,"spectrum_id":"CCMSLIB00017267461","spectrum_index":29316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1050.4264 Da; putative annotation: N/A; putative formula: C59H62N4O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1272.52,"smiles":null,"spectrum_id":"CCMSLIB00017267464","spectrum_index":29317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 399.2621 Da; putative annotation: N/A; putative formula: C21H37NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.322,"smiles":null,"spectrum_id":"CCMSLIB00017267467","spectrum_index":29318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 164.0844 Da; putative annotation: N/A; putative formula: C10H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.186,"smiles":null,"spectrum_id":"CCMSLIB00017267469","spectrum_index":29319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 236.1182 Da; putative annotation: N/A; putative formula: C10H21O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.23,"smiles":null,"spectrum_id":"CCMSLIB00017267471","spectrum_index":29320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 257.1776 Da; putative annotation: N/A; putative formula: C17H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.242,"smiles":null,"spectrum_id":"CCMSLIB00017267474","spectrum_index":29321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 82.078 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.138,"smiles":null,"spectrum_id":"CCMSLIB00017267477","spectrum_index":29322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 232.1312 Da; putative annotation: N/A; putative formula: C11H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.333,"smiles":null,"spectrum_id":"CCMSLIB00017267478","spectrum_index":29323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tributyl citrate (delta mass: 87.0648 Da; putative annotation: N/A; putative formula: H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.287,"smiles":null,"spectrum_id":"CCMSLIB00017267481","spectrum_index":29324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE (delta mass: 45.9941 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.085,"smiles":null,"spectrum_id":"CCMSLIB00017267484","spectrum_index":29325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 101.0465 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.18,"smiles":null,"spectrum_id":"CCMSLIB00017267485","spectrum_index":29326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 450.2216 Da; putative annotation: N/A; putative formula: C24H32N6O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.282,"smiles":null,"spectrum_id":"CCMSLIB00017267488","spectrum_index":29327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 18.05 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.138,"smiles":null,"spectrum_id":"CCMSLIB00017267491","spectrum_index":29328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 94.0425 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.123,"smiles":null,"spectrum_id":"CCMSLIB00017267492","spectrum_index":29329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 325.2274 Da; putative annotation: N/A; putative formula: C19H27N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.298,"smiles":null,"spectrum_id":"CCMSLIB00017267495","spectrum_index":29330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 190.029 Da; putative annotation: N/A; putative formula: C9H7N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.078,"smiles":null,"spectrum_id":"CCMSLIB00017267498","spectrum_index":29331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 35.9971 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.078,"smiles":null,"spectrum_id":"CCMSLIB00017267500","spectrum_index":29332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Lys (delta mass: 99.0678 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.249,"smiles":null,"spectrum_id":"CCMSLIB00017267502","spectrum_index":29333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 62.0522 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.175,"smiles":null,"spectrum_id":"CCMSLIB00017267505","spectrum_index":29334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP011101 Methyl trans-cinnamic acid|4-Methylcinnamic acid|(E)-3-(4-methylphenyl)prop-2-enoic acid (delta mass: 358.1259 Da; putative annotation: N/A; putative formula: C16H22O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.201,"smiles":null,"spectrum_id":"CCMSLIB00017267508","spectrum_index":29335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 109.0388 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.151,"smiles":null,"spectrum_id":"CCMSLIB00017267511","spectrum_index":29336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 97.1877 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.332,"smiles":null,"spectrum_id":"CCMSLIB00017267512","spectrum_index":29337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 280.2867 Da; putative annotation: N/A; putative formula: C18H36N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.373,"smiles":null,"spectrum_id":"CCMSLIB00017267515","spectrum_index":29338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 151.1287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.251,"smiles":null,"spectrum_id":"CCMSLIB00017267518","spectrum_index":29339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 139.1358 Da; putative annotation: N/A; putative formula: C9H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.285,"smiles":null,"spectrum_id":"CCMSLIB00017267520","spectrum_index":29340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Saccharic acid 1,4-lactone (delta mass: 60.0364 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.071,"smiles":null,"spectrum_id":"CCMSLIB00017267522","spectrum_index":29341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Asparagine (delta mass: 115.0264 Da; putative annotation: L-aspartic acid; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.087,"smiles":null,"spectrum_id":"CCMSLIB00017267524","spectrum_index":29342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 222.1124 Da; putative annotation: L-ANSERINE - 20.0 eV; putative formula: C10H14N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.172,"smiles":null,"spectrum_id":"CCMSLIB00017267527","spectrum_index":29343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU099404 8-Hydroxyquinoline|quinolin-8-ol (delta mass: 113.0477 Da; putative annotation: (3R)-3-Hydroxy-L-proline; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017267530","spectrum_index":29344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 178.1352 Da; putative annotation: Dodeca-2(E),4(E)-dienoic acid; putative formula: C12H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.206,"smiles":null,"spectrum_id":"CCMSLIB00017267532","spectrum_index":29345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 272.1163 Da; putative annotation: Argininosuccinic acid; putative formula: C10H16N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.187,"smiles":null,"spectrum_id":"CCMSLIB00017267535","spectrum_index":29346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 147.0995 Da; putative annotation: N/A; putative formula: C5H13N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.186,"smiles":null,"spectrum_id":"CCMSLIB00017267537","spectrum_index":29347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 352.2969 Da; putative annotation: N/A; putative formula: C22H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.378,"smiles":null,"spectrum_id":"CCMSLIB00017267540","spectrum_index":29348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 102.0372 Da; putative annotation: N/A; putative formula: C2H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.15,"smiles":null,"spectrum_id":"CCMSLIB00017267542","spectrum_index":29349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 166.1151 Da; putative annotation: N/A; putative formula: C14H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.186,"smiles":null,"spectrum_id":"CCMSLIB00017267544","spectrum_index":29350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 46.0383 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.081,"smiles":null,"spectrum_id":"CCMSLIB00017267547","spectrum_index":29351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 50.9575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.958,"smiles":null,"spectrum_id":"CCMSLIB00017267549","spectrum_index":29352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 82.0151 Da; putative annotation: N/A; putative formula: C3H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.075,"smiles":null,"spectrum_id":"CCMSLIB00017267551","spectrum_index":29353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 28.9981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.079,"smiles":null,"spectrum_id":"CCMSLIB00017267554","spectrum_index":29354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 361.8823 Da; putative annotation: N/A; putative formula: C10H8N2O-1P2S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.01,"smiles":null,"spectrum_id":"CCMSLIB00017267557","spectrum_index":29355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 923.5242 Da; putative annotation: N/A; putative formula: C48H77NO16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1116.59,"smiles":null,"spectrum_id":"CCMSLIB00017267558","spectrum_index":29356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 80.0268 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.16,"smiles":null,"spectrum_id":"CCMSLIB00017267561","spectrum_index":29357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 338.1518 Da; putative annotation: N/A; putative formula: C21H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.193,"smiles":null,"spectrum_id":"CCMSLIB00017267564","spectrum_index":29358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 41.0351 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.18,"smiles":null,"spectrum_id":"CCMSLIB00017267565","spectrum_index":29359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 167.0582 Da; putative annotation: N/A; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.181,"smiles":null,"spectrum_id":"CCMSLIB00017267568","spectrum_index":29360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017267571","spectrum_index":29361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 32.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017267574","spectrum_index":29362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 67.8726 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.0,"smiles":null,"spectrum_id":"CCMSLIB00017267575","spectrum_index":29363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 483.2583 Da; putative annotation: N/A; putative formula: C23H37N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.339,"smiles":null,"spectrum_id":"CCMSLIB00017267578","spectrum_index":29364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentamethylene bisacetamide (delta mass: 161.0325 Da; putative annotation: N/A; putative formula: C5H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.177,"smiles":null,"spectrum_id":"CCMSLIB00017267581","spectrum_index":29365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 133.1097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017267582","spectrum_index":29366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 74.0725 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.148,"smiles":null,"spectrum_id":"CCMSLIB00017267585","spectrum_index":29367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 54.0459 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.142,"smiles":null,"spectrum_id":"CCMSLIB00017267588","spectrum_index":29368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.102,"smiles":null,"spectrum_id":"CCMSLIB00017267589","spectrum_index":29369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 289.1317 Da; putative annotation: N/A; putative formula: C16H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.218,"smiles":null,"spectrum_id":"CCMSLIB00017267592","spectrum_index":29370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 76.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.128,"smiles":null,"spectrum_id":"CCMSLIB00017267595","spectrum_index":29371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 9.0002 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.087,"smiles":null,"spectrum_id":"CCMSLIB00017267597","spectrum_index":29372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (Z,E)-Tetradeca-9,12-dienol from NIST14 (delta mass: 97.0544 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.26,"smiles":null,"spectrum_id":"CCMSLIB00017267599","spectrum_index":29373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 517.1526 Da; putative annotation: N/A; putative formula: C17H27N9O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.193,"smiles":null,"spectrum_id":"CCMSLIB00017267602","spectrum_index":29374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 14.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.113,"smiles":null,"spectrum_id":"CCMSLIB00017267605","spectrum_index":29375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 54.0471 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.113,"smiles":null,"spectrum_id":"CCMSLIB00017267606","spectrum_index":29376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 69.0185 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.121,"smiles":null,"spectrum_id":"CCMSLIB00017267609","spectrum_index":29377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 148.0518 Da; putative annotation: N/A; putative formula: C3H9N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.122,"smiles":null,"spectrum_id":"CCMSLIB00017267612","spectrum_index":29378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000086 Harmane (delta mass: 86.0859 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.178,"smiles":null,"spectrum_id":"CCMSLIB00017267613","spectrum_index":29379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 46.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017267616","spectrum_index":29380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 241.2767 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.384,"smiles":null,"spectrum_id":"CCMSLIB00017267619","spectrum_index":29381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 183.0509 Da; putative annotation: N/A; putative formula: C12H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.122,"smiles":null,"spectrum_id":"CCMSLIB00017267620","spectrum_index":29382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 104.0638 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.197,"smiles":null,"spectrum_id":"CCMSLIB00017267623","spectrum_index":29383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 149.082 Da; putative annotation: N/A; putative formula: C5H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.211,"smiles":null,"spectrum_id":"CCMSLIB00017267626","spectrum_index":29384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 463.1688 Da; putative annotation: N/A; putative formula: C19H29NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.24,"smiles":null,"spectrum_id":"CCMSLIB00017267627","spectrum_index":29385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384775-01!(2R,3S)-2-[(3,4-dihydroxyphenyl)methyl]-2-hydroxy-3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxybutanedioic acid (delta mass: 152.0098 Da; putative annotation: N/A; putative formula: CH5N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.118,"smiles":null,"spectrum_id":"CCMSLIB00017267631","spectrum_index":29386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.139,"smiles":null,"spectrum_id":"CCMSLIB00017267633","spectrum_index":29387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 423.1333 Da; putative annotation: N/A; putative formula: C17H25N7S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.23,"smiles":null,"spectrum_id":"CCMSLIB00017267636","spectrum_index":29388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 642.2516 Da; putative annotation: N/A; putative formula: C43H34N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.333,"smiles":null,"spectrum_id":"CCMSLIB00017267639","spectrum_index":29389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 324.2663 Da; putative annotation: N/A; putative formula: C20H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.332,"smiles":null,"spectrum_id":"CCMSLIB00017267642","spectrum_index":29390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 90.0896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.217,"smiles":null,"spectrum_id":"CCMSLIB00017267643","spectrum_index":29391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caffeoyl putrescin (isomer of 1059) (delta mass: 207.09 Da; putative annotation: N/A; putative formula: C11H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.229,"smiles":null,"spectrum_id":"CCMSLIB00017267646","spectrum_index":29392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 55.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.09,"smiles":null,"spectrum_id":"CCMSLIB00017267648","spectrum_index":29393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 1.9742 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.128,"smiles":null,"spectrum_id":"CCMSLIB00017267650","spectrum_index":29394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Thienyl)-1H-imidazole (delta mass: 82.0758 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.108,"smiles":null,"spectrum_id":"CCMSLIB00017267653","spectrum_index":29395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 61.0315 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.128,"smiles":null,"spectrum_id":"CCMSLIB00017267656","spectrum_index":29396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 728.2343 Da; putative annotation: N/A; putative formula: C38H32N8O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1395.46,"smiles":null,"spectrum_id":"CCMSLIB00017267658","spectrum_index":29397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 989.3429 Da; putative annotation: N/A; putative formula: C36H63NO30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1494.52,"smiles":null,"spectrum_id":"CCMSLIB00017267660","spectrum_index":29398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 91.0542 Da; putative annotation: N/A; putative formula: C5H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.141,"smiles":null,"spectrum_id":"CCMSLIB00017267663","spectrum_index":29399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyltapentadol (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.191,"smiles":null,"spectrum_id":"CCMSLIB00017267666","spectrum_index":29400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 208.0735 Da; putative annotation: N/A; putative formula: C11H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.154,"smiles":null,"spectrum_id":"CCMSLIB00017267668","spectrum_index":29401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 230.152 Da; putative annotation: N/A; putative formula: C12H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.202,"smiles":null,"spectrum_id":"CCMSLIB00017267670","spectrum_index":29402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 30.0115 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.132,"smiles":null,"spectrum_id":"CCMSLIB00017267673","spectrum_index":29403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 164.1563 Da; putative annotation: N/A; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.248,"smiles":null,"spectrum_id":"CCMSLIB00017267676","spectrum_index":29404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 193.0741 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.213,"smiles":null,"spectrum_id":"CCMSLIB00017267677","spectrum_index":29405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 72.8387 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.909,"smiles":null,"spectrum_id":"CCMSLIB00017267680","spectrum_index":29406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 16.0289 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.084,"smiles":null,"spectrum_id":"CCMSLIB00017267683","spectrum_index":29407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 57.007 Da; putative annotation: N/A; putative formula: C2H3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.094,"smiles":null,"spectrum_id":"CCMSLIB00017267684","spectrum_index":29408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 73.0472 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.186,"smiles":null,"spectrum_id":"CCMSLIB00017267687","spectrum_index":29409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 20.0 eV (delta mass: 333.2132 Da; putative annotation: N/A; putative formula: C20H31NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.316,"smiles":null,"spectrum_id":"CCMSLIB00017267690","spectrum_index":29410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 114.0309 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.091,"smiles":null,"spectrum_id":"CCMSLIB00017267692","spectrum_index":29411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethoxyphenol (delta mass: 42.0101 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.08,"smiles":null,"spectrum_id":"CCMSLIB00017267694","spectrum_index":29412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 115.0285 Da; putative annotation: N/A; putative formula: C5HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.157,"smiles":null,"spectrum_id":"CCMSLIB00017267697","spectrum_index":29413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 143.0585 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.145,"smiles":null,"spectrum_id":"CCMSLIB00017267700","spectrum_index":29414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 903.541 Da; putative annotation: N/A; putative formula: C56H69N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1066.6,"smiles":null,"spectrum_id":"CCMSLIB00017267701","spectrum_index":29415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 418.2925 Da; putative annotation: N/A; putative formula: C22H42O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.353,"smiles":null,"spectrum_id":"CCMSLIB00017267704","spectrum_index":29416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 60.5511 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.627,"smiles":null,"spectrum_id":"CCMSLIB00017267707","spectrum_index":29417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 23.0196 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.1,"smiles":null,"spectrum_id":"CCMSLIB00017267708","spectrum_index":29418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 87.0222 Da; putative annotation: N/A; putative formula: C5HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.12,"smiles":null,"spectrum_id":"CCMSLIB00017267711","spectrum_index":29419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3-(2-Hydroxyethyl)indole from NIST14 (delta mass: 129.0199 Da; putative annotation: N/A; putative formula: C2H4N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.111,"smiles":null,"spectrum_id":"CCMSLIB00017267714","spectrum_index":29420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 59.0986 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.174,"smiles":null,"spectrum_id":"CCMSLIB00017267717","spectrum_index":29421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Succinyladenosine; AIF; CE30; MS2Dec (delta mass: 344.1715 Da; putative annotation: N/A; putative formula: C23H24N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.286,"smiles":null,"spectrum_id":"CCMSLIB00017267720","spectrum_index":29422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1119.3737 Da; putative annotation: N/A; putative formula: C44H57N13O22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1282.43,"smiles":null,"spectrum_id":"CCMSLIB00017267721","spectrum_index":29423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 52.0673 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.257,"smiles":null,"spectrum_id":"CCMSLIB00017267724","spectrum_index":29424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatol (delta mass: 206.1119 Da; putative annotation: N/A; putative formula: C5H14N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.193,"smiles":null,"spectrum_id":"CCMSLIB00017267727","spectrum_index":29425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-QUINOLINECARBOXYLIC ACID - 40.0 eV (delta mass: 174.0641 Da; putative annotation: N/A; putative formula: C6H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.119,"smiles":null,"spectrum_id":"CCMSLIB00017267729","spectrum_index":29426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 35.0298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.07,"smiles":null,"spectrum_id":"CCMSLIB00017267732","spectrum_index":29427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 51.0143 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.101,"smiles":null,"spectrum_id":"CCMSLIB00017267735","spectrum_index":29428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 116.0397 Da; putative annotation: N/A; putative formula: C5H9OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.162,"smiles":null,"spectrum_id":"CCMSLIB00017267737","spectrum_index":29429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 106.0279 Da; putative annotation: N/A; putative formula: C4H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.181,"smiles":null,"spectrum_id":"CCMSLIB00017267739","spectrum_index":29430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU228201 10,11-Dihydro-10-Hydroxycarbazepine|Licarbazepine|5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 46.005 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017267742","spectrum_index":29431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 60.0209 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.128,"smiles":null,"spectrum_id":"CCMSLIB00017267745","spectrum_index":29432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 12.0011 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.061,"smiles":null,"spectrum_id":"CCMSLIB00017267748","spectrum_index":29433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 377.1626 Da; putative annotation: N/A; putative formula: C23H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.244,"smiles":null,"spectrum_id":"CCMSLIB00017267749","spectrum_index":29434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 318.2512 Da; putative annotation: N/A; putative formula: C16H34N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.41,"smiles":null,"spectrum_id":"CCMSLIB00017267752","spectrum_index":29435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 256.0812 Da; putative annotation: N/A; putative formula: C15H13ClN2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.141,"smiles":null,"spectrum_id":"CCMSLIB00017267754","spectrum_index":29436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 54.0061 Da; putative annotation: N/A; putative formula: C3H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.055,"smiles":null,"spectrum_id":"CCMSLIB00017267757","spectrum_index":29437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 29.0243 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.158,"smiles":null,"spectrum_id":"CCMSLIB00017267758","spectrum_index":29438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 666.3436 Da; putative annotation: N/A; putative formula: C27H50N6O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.404,"smiles":null,"spectrum_id":"CCMSLIB00017267761","spectrum_index":29439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ascorbic acid 6-palmitate (delta mass: 80.0666 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.336,"smiles":null,"spectrum_id":"CCMSLIB00017267764","spectrum_index":29440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Colchicine (delta mass: 156.0977 Da; putative annotation: N/A; putative formula: C9H16S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.273,"smiles":null,"spectrum_id":"CCMSLIB00017267765","spectrum_index":29441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 437.1214 Da; putative annotation: N/A; putative formula: C24H24NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.39,"smiles":null,"spectrum_id":"CCMSLIB00017267768","spectrum_index":29442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 518.3812 Da; putative annotation: N/A; putative formula: C33H50N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.441,"smiles":null,"spectrum_id":"CCMSLIB00017267771","spectrum_index":29443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine glucuronide (delta mass: 234.204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.5,"smiles":null,"spectrum_id":"CCMSLIB00017267772","spectrum_index":29444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 106.0781 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017267775","spectrum_index":29445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 73.0532 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.139,"smiles":null,"spectrum_id":"CCMSLIB00017267777","spectrum_index":29446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 63.0656 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.183,"smiles":null,"spectrum_id":"CCMSLIB00017267780","spectrum_index":29447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 156.0185 Da; putative annotation: N/A; putative formula: C6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.136,"smiles":null,"spectrum_id":"CCMSLIB00017267783","spectrum_index":29448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-3-phenylbutanoic acid (delta mass: 64.0311 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017267784","spectrum_index":29449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 453.2363 Da; putative annotation: N/A; putative formula: C23H35NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.317,"smiles":null,"spectrum_id":"CCMSLIB00017267787","spectrum_index":29450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 248.0895 Da; putative annotation: N/A; putative formula: C10H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.181,"smiles":null,"spectrum_id":"CCMSLIB00017267790","spectrum_index":29451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 335.121 Da; putative annotation: N/A; putative formula: C18H17N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.192,"smiles":null,"spectrum_id":"CCMSLIB00017267791","spectrum_index":29452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.087,"smiles":null,"spectrum_id":"CCMSLIB00017267794","spectrum_index":29453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 175.0744 Da; putative annotation: N/A; putative formula: C9H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.152,"smiles":null,"spectrum_id":"CCMSLIB00017267797","spectrum_index":29454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Desmethoxy-4-chloroomeprazole (delta mass: 123.0715 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.144,"smiles":null,"spectrum_id":"CCMSLIB00017267798","spectrum_index":29455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 17.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.13,"smiles":null,"spectrum_id":"CCMSLIB00017267801","spectrum_index":29456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxyharmalan (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.129,"smiles":null,"spectrum_id":"CCMSLIB00017267804","spectrum_index":29457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetyl-5-hydroxy-3-methylphenyl .beta.-D-glucopyranoside (delta mass: 186.1258 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.249,"smiles":null,"spectrum_id":"CCMSLIB00017267805","spectrum_index":29458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 46.0011 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.113,"smiles":null,"spectrum_id":"CCMSLIB00017267808","spectrum_index":29459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 220.073 Da; putative annotation: N/A; putative formula: C6H13N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.154,"smiles":null,"spectrum_id":"CCMSLIB00017267811","spectrum_index":29460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.112,"smiles":null,"spectrum_id":"CCMSLIB00017267812","spectrum_index":29461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.098,"smiles":null,"spectrum_id":"CCMSLIB00017267815","spectrum_index":29462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 134.0421 Da; putative annotation: N/A; putative formula: C5H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.102,"smiles":null,"spectrum_id":"CCMSLIB00017267818","spectrum_index":29463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 60.0367 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.222,"smiles":null,"spectrum_id":"CCMSLIB00017267821","spectrum_index":29464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 170.1092 Da; putative annotation: N/A; putative formula: C13H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.19,"smiles":null,"spectrum_id":"CCMSLIB00017267822","spectrum_index":29465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 175.1935 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.301,"smiles":null,"spectrum_id":"CCMSLIB00017267825","spectrum_index":29466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 380.168 Da; putative annotation: N/A; putative formula: C16H28O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.207,"smiles":null,"spectrum_id":"CCMSLIB00017267828","spectrum_index":29467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3S,4S,21R)-14-Ethyl-9-(hydroxymethyl)-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid (delta mass: 61.006 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.277,"smiles":null,"spectrum_id":"CCMSLIB00017267830","spectrum_index":29468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trifluperidol (delta mass: 164.0432 Da; putative annotation: N/A; putative formula: C4H8N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.217,"smiles":null,"spectrum_id":"CCMSLIB00017267833","spectrum_index":29469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 134.0741 Da; putative annotation: N/A; putative formula: C2H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.228,"smiles":null,"spectrum_id":"CCMSLIB00017267836","spectrum_index":29470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 435.2475 Da; putative annotation: N/A; putative formula: C23H38N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.302,"smiles":null,"spectrum_id":"CCMSLIB00017267838","spectrum_index":29471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 169.021 Da; putative annotation: N/A; putative formula: C7H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.06,"smiles":null,"spectrum_id":"CCMSLIB00017267841","spectrum_index":29472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 567.3976 Da; putative annotation: N/A; putative formula: C41H49N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.468,"smiles":null,"spectrum_id":"CCMSLIB00017267844","spectrum_index":29473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 415.2421 Da; putative annotation: N/A; putative formula: C15H25N15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.297,"smiles":null,"spectrum_id":"CCMSLIB00017267847","spectrum_index":29474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 292.2402 Da; putative annotation: N/A; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.311,"smiles":null,"spectrum_id":"CCMSLIB00017267849","spectrum_index":29475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 203.0583 Da; putative annotation: N/A; putative formula: C11H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.134,"smiles":null,"spectrum_id":"CCMSLIB00017267852","spectrum_index":29476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 116.0904 Da; putative annotation: N/A; putative formula: CH8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.244,"smiles":null,"spectrum_id":"CCMSLIB00017267854","spectrum_index":29477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Pro from NIST14 (delta mass: 60.0033 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.142,"smiles":null,"spectrum_id":"CCMSLIB00017267857","spectrum_index":29478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 153.0437 Da; putative annotation: N/A; putative formula: C8H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.22,"smiles":null,"spectrum_id":"CCMSLIB00017267859","spectrum_index":29479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 108.0648 Da; putative annotation: N/A; putative formula: C6H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.13,"smiles":null,"spectrum_id":"CCMSLIB00017267861","spectrum_index":29480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 116.084 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.149,"smiles":null,"spectrum_id":"CCMSLIB00017267864","spectrum_index":29481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 298.1581 Da; putative annotation: N/A; putative formula: C20H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.218,"smiles":null,"spectrum_id":"CCMSLIB00017267867","spectrum_index":29482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 274.2297 Da; putative annotation: N/A; putative formula: C19H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.327,"smiles":null,"spectrum_id":"CCMSLIB00017267868","spectrum_index":29483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 102.0679 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.169,"smiles":null,"spectrum_id":"CCMSLIB00017267871","spectrum_index":29484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 261.1427 Da; putative annotation: N/A; putative formula: C11H24N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.213,"smiles":null,"spectrum_id":"CCMSLIB00017267874","spectrum_index":29485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 264.2457 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.415,"smiles":null,"spectrum_id":"CCMSLIB00017267877","spectrum_index":29486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 61.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.154,"smiles":null,"spectrum_id":"CCMSLIB00017267878","spectrum_index":29487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 197.2183 Da; putative annotation: N/A; putative formula: C13H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.414,"smiles":null,"spectrum_id":"CCMSLIB00017267881","spectrum_index":29488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 252.172 Da; putative annotation: N/A; putative formula: C15H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.199,"smiles":null,"spectrum_id":"CCMSLIB00017267884","spectrum_index":29489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 269.9625 Da; putative annotation: N/A; putative formula: C6H10N2O2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.03,"smiles":null,"spectrum_id":"CCMSLIB00017267887","spectrum_index":29490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 71.019 Da; putative annotation: N/A; putative formula: C3H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.084,"smiles":null,"spectrum_id":"CCMSLIB00017267889","spectrum_index":29491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lofemizole (delta mass: 73.049 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017267891","spectrum_index":29492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 28.003 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.053,"smiles":null,"spectrum_id":"CCMSLIB00017267894","spectrum_index":29493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Benzimidazol-2-one, 1-ethyl-1,3-dihydro- (delta mass: 162.1005 Da; putative annotation: N/A; putative formula: C6H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.187,"smiles":null,"spectrum_id":"CCMSLIB00017267896","spectrum_index":29494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nitro-2,4-quinolinediol (delta mass: 70.0003 Da; putative annotation: N/A; putative formula: C2H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.04,"smiles":null,"spectrum_id":"CCMSLIB00017267899","spectrum_index":29495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 480.2237 Da; putative annotation: N/A; putative formula: C20H37N2O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.31,"smiles":null,"spectrum_id":"CCMSLIB00017267902","spectrum_index":29496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 418.2388 Da; putative annotation: N/A; putative formula: C21H38O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.31,"smiles":null,"spectrum_id":"CCMSLIB00017267905","spectrum_index":29497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017267906","spectrum_index":29498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylose (delta mass: 88.0313 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017267909","spectrum_index":29499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 331.0897 Da; putative annotation: N/A; putative formula: C18H13N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.24,"smiles":null,"spectrum_id":"CCMSLIB00017267912","spectrum_index":29500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 357.5382 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.609,"smiles":null,"spectrum_id":"CCMSLIB00017267914","spectrum_index":29501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 417.267 Da; putative annotation: N/A; putative formula: C21H43N3O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.39,"smiles":null,"spectrum_id":"CCMSLIB00017267916","spectrum_index":29502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 40.9754 Da; putative annotation: N/A; putative formula: C16H23N7O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.018,"smiles":null,"spectrum_id":"CCMSLIB00017267919","spectrum_index":29503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 129.0431 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.166,"smiles":null,"spectrum_id":"CCMSLIB00017267922","spectrum_index":29504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 179.0792 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.208,"smiles":null,"spectrum_id":"CCMSLIB00017267924","spectrum_index":29505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.113,"smiles":null,"spectrum_id":"CCMSLIB00017267926","spectrum_index":29506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 40.0951 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.171,"smiles":null,"spectrum_id":"CCMSLIB00017267929","spectrum_index":29507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 57.0207 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.206,"smiles":null,"spectrum_id":"CCMSLIB00017267932","spectrum_index":29508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 130.0366 Da; putative annotation: N/A; putative formula: C6H11O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.117,"smiles":null,"spectrum_id":"CCMSLIB00017267933","spectrum_index":29509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 43.1526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.255,"smiles":null,"spectrum_id":"CCMSLIB00017267936","spectrum_index":29510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 67.013 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.115,"smiles":null,"spectrum_id":"CCMSLIB00017267939","spectrum_index":29511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2,2,6,6-tetramethyl-4-(2-methyl-1-(2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl)propyl)cyclohex-4-ene-1,3-dione (delta mass: 396.1898 Da; putative annotation: Myrtucommulone B; putative formula: C24H28O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.412,"smiles":null,"spectrum_id":"CCMSLIB00017267940","spectrum_index":29512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 152.1197 Da; putative annotation: (6E)-8-Methyl-6-nonenoic acid; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.243,"smiles":null,"spectrum_id":"CCMSLIB00017267943","spectrum_index":29513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Ile (delta mass: 113.084 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017267946","spectrum_index":29514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 280.1705 Da; putative annotation: Koninginin D; putative formula: C16H24O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.247,"smiles":null,"spectrum_id":"CCMSLIB00017267947","spectrum_index":29515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 112.0521 Da; putative annotation: DL-Mevalonic acid lactone; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.175,"smiles":null,"spectrum_id":"CCMSLIB00017267950","spectrum_index":29516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 173.0842 Da; putative annotation: 5-Methoxytryptophol; putative formula: C11H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.16,"smiles":null,"spectrum_id":"CCMSLIB00017267953","spectrum_index":29517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.081,"smiles":null,"spectrum_id":"CCMSLIB00017267954","spectrum_index":29518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 356.1607 Da; putative annotation: N/A; putative formula: C18H16N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.242,"smiles":null,"spectrum_id":"CCMSLIB00017267957","spectrum_index":29519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 163.1194 Da; putative annotation: N/A; putative formula: C8H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.184,"smiles":null,"spectrum_id":"CCMSLIB00017267960","spectrum_index":29520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 328.0864 Da; putative annotation: N/A; putative formula: C18H17O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.167,"smiles":null,"spectrum_id":"CCMSLIB00017267961","spectrum_index":29521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Hydroxy-L-proline (delta mass: 74.0005 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.066,"smiles":null,"spectrum_id":"CCMSLIB00017267964","spectrum_index":29522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 31.0305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.106,"smiles":null,"spectrum_id":"CCMSLIB00017267967","spectrum_index":29523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 187.086 Da; putative annotation: N/A; putative formula: C9H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.178,"smiles":null,"spectrum_id":"CCMSLIB00017267968","spectrum_index":29524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 967.515 Da; putative annotation: N/A; putative formula: C50H73N5O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1148.59,"smiles":null,"spectrum_id":"CCMSLIB00017267971","spectrum_index":29525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 565.2413 Da; putative annotation: N/A; putative formula: C24H36N7O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.411,"smiles":null,"spectrum_id":"CCMSLIB00017267974","spectrum_index":29526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 176.0801 Da; putative annotation: N/A; putative formula: C6H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.14,"smiles":null,"spectrum_id":"CCMSLIB00017267975","spectrum_index":29527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 138.0896 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.186,"smiles":null,"spectrum_id":"CCMSLIB00017267978","spectrum_index":29528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,2,3,4-Tetrahydro-9H-carbazol-9-yl)propanohydrazide (delta mass: 195.9793 Da; putative annotation: N/A; putative formula: C3H4N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.139,"smiles":null,"spectrum_id":"CCMSLIB00017267981","spectrum_index":29529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 50.0517 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017267982","spectrum_index":29530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 100.0274 Da; putative annotation: N/A; putative formula: C3H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.108,"smiles":null,"spectrum_id":"CCMSLIB00017267985","spectrum_index":29531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 127.0494 Da; putative annotation: N/A; putative formula: C3H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.115,"smiles":null,"spectrum_id":"CCMSLIB00017267988","spectrum_index":29532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 532.2365 Da; putative annotation: N/A; putative formula: C21H40O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.333,"smiles":null,"spectrum_id":"CCMSLIB00017267989","spectrum_index":29533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNFP III (delta mass: 62.0233 Da; putative annotation: N/A; putative formula: C4H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.337,"smiles":null,"spectrum_id":"CCMSLIB00017267992","spectrum_index":29534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017267995","spectrum_index":29535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxycoumarin (delta mass: 42.047 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017267996","spectrum_index":29536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 340.0571 Da; putative annotation: N/A; putative formula: C15H4N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.154,"smiles":null,"spectrum_id":"CCMSLIB00017267999","spectrum_index":29537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNT (delta mass: 107.0367 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":815.292,"smiles":null,"spectrum_id":"CCMSLIB00017268002","spectrum_index":29538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 107.0585 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.233,"smiles":null,"spectrum_id":"CCMSLIB00017268003","spectrum_index":29539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 767.4172 Da; putative annotation: N/A; putative formula: C44H58N5O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":948.488,"smiles":null,"spectrum_id":"CCMSLIB00017268006","spectrum_index":29540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 50.0154 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.122,"smiles":null,"spectrum_id":"CCMSLIB00017268009","spectrum_index":29541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 282.0534 Da; putative annotation: N/A; putative formula: C8H16N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.156,"smiles":null,"spectrum_id":"CCMSLIB00017268012","spectrum_index":29542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-hydroxypyrene (delta mass: 32.022 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.102,"smiles":null,"spectrum_id":"CCMSLIB00017268014","spectrum_index":29543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PAR_146.0966_8.3 (delta mass: 46.0036 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017268016","spectrum_index":29544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 158.0122 Da; putative annotation: N/A; putative formula: C8H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.109,"smiles":null,"spectrum_id":"CCMSLIB00017268019","spectrum_index":29545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of quinidine (delta mass: 87.1013 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.292,"smiles":null,"spectrum_id":"CCMSLIB00017268020","spectrum_index":29546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ser (delta mass: 198.0633 Da; putative annotation: N/A; putative formula: C10H15PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.156,"smiles":null,"spectrum_id":"CCMSLIB00017268023","spectrum_index":29547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 71.0013 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.067,"smiles":null,"spectrum_id":"CCMSLIB00017268026","spectrum_index":29548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 17.0062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.093,"smiles":null,"spectrum_id":"CCMSLIB00017268029","spectrum_index":29549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 298.1606 Da; putative annotation: N/A; putative formula: C16H26O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.242,"smiles":null,"spectrum_id":"CCMSLIB00017268030","spectrum_index":29550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 316.0393 Da; putative annotation: N/A; putative formula: C10H13N4O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.095,"smiles":null,"spectrum_id":"CCMSLIB00017268033","spectrum_index":29551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 645.2821 Da; putative annotation: N/A; putative formula: C51H35NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":826.353,"smiles":null,"spectrum_id":"CCMSLIB00017268035","spectrum_index":29552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 695.5171 Da; putative annotation: N/A; putative formula: C41H69N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":876.588,"smiles":null,"spectrum_id":"CCMSLIB00017268037","spectrum_index":29553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 101.9954 Da; putative annotation: N/A; putative formula: C3H2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.055,"smiles":null,"spectrum_id":"CCMSLIB00017268040","spectrum_index":29554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,5,7,8-Pentamethyl-6-hydroxychroman (delta mass: 101.0832 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.237,"smiles":null,"spectrum_id":"CCMSLIB00017268043","spectrum_index":29555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid (delta mass: 8.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017268044","spectrum_index":29556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 166.1719 Da; putative annotation: N/A; putative formula: C12H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.264,"smiles":null,"spectrum_id":"CCMSLIB00017268047","spectrum_index":29557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 907.5658 Da; putative annotation: N/A; putative formula: C55H73N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1088.64,"smiles":null,"spectrum_id":"CCMSLIB00017268050","spectrum_index":29558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 74.0734 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.154,"smiles":null,"spectrum_id":"CCMSLIB00017268051","spectrum_index":29559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 9.9642 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.139,"smiles":null,"spectrum_id":"CCMSLIB00017268054","spectrum_index":29560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 72.0279 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.104,"smiles":null,"spectrum_id":"CCMSLIB00017268056","spectrum_index":29561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310825 N-Fructosyl isoleucine (delta mass: 324.1103 Da; putative annotation: N/A; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.265,"smiles":null,"spectrum_id":"CCMSLIB00017268058","spectrum_index":29562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 17.0329 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017268061","spectrum_index":29563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 95.0731 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.159,"smiles":null,"spectrum_id":"CCMSLIB00017268064","spectrum_index":29564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 904.4804 Da; putative annotation: N/A; putative formula: C45H64N10O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1085.55,"smiles":null,"spectrum_id":"CCMSLIB00017268066","spectrum_index":29565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 42.0893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017268068","spectrum_index":29566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 45.1145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.19,"smiles":null,"spectrum_id":"CCMSLIB00017268071","spectrum_index":29567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yohimbic acid (delta mass: 45.9146 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.101,"smiles":null,"spectrum_id":"CCMSLIB00017268073","spectrum_index":29568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 122.0734 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017268076","spectrum_index":29569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 251.1086 Da; putative annotation: N/A; putative formula: C12H17N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.195,"smiles":null,"spectrum_id":"CCMSLIB00017268079","spectrum_index":29570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 42.0219 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.093,"smiles":null,"spectrum_id":"CCMSLIB00017268081","spectrum_index":29571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Diamino-2-methylpropane (delta mass: 40.0322 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.139,"smiles":null,"spectrum_id":"CCMSLIB00017268084","spectrum_index":29572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 58.0305 Da; putative annotation: N/A; putative formula: H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.138,"smiles":null,"spectrum_id":"CCMSLIB00017268086","spectrum_index":29573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 71.0362 Da; putative annotation: N/A; putative formula: C3H5NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.118,"smiles":null,"spectrum_id":"CCMSLIB00017268089","spectrum_index":29574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.155,"smiles":null,"spectrum_id":"CCMSLIB00017268091","spectrum_index":29575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 32.9886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.048,"smiles":null,"spectrum_id":"CCMSLIB00017268094","spectrum_index":29576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-3-ylmethanamine (delta mass: 77.02 Da; putative annotation: N/A; putative formula: H3N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.107,"smiles":null,"spectrum_id":"CCMSLIB00017268097","spectrum_index":29577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 144.0907 Da; putative annotation: N/A; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.166,"smiles":null,"spectrum_id":"CCMSLIB00017268099","spectrum_index":29578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 164.1564 Da; putative annotation: N/A; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.28,"smiles":null,"spectrum_id":"CCMSLIB00017268102","spectrum_index":29579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 45.9653 Da; putative annotation: N/A; putative formula: H-2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.041,"smiles":null,"spectrum_id":"CCMSLIB00017268104","spectrum_index":29580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 369.2382 Da; putative annotation: N/A; putative formula: C18H35N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.371,"smiles":null,"spectrum_id":"CCMSLIB00017268107","spectrum_index":29581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 88.0411 Da; putative annotation: N/A; putative formula: C6H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017268110","spectrum_index":29582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 53.0318 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.181,"smiles":null,"spectrum_id":"CCMSLIB00017268111","spectrum_index":29583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 409.3554 Da; putative annotation: N/A; putative formula: C25H47NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.421,"smiles":null,"spectrum_id":"CCMSLIB00017268114","spectrum_index":29584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 4.9768 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.126,"smiles":null,"spectrum_id":"CCMSLIB00017268117","spectrum_index":29585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 28.9946 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.065,"smiles":null,"spectrum_id":"CCMSLIB00017268119","spectrum_index":29586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 17.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.174,"smiles":null,"spectrum_id":"CCMSLIB00017268121","spectrum_index":29587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 703.5598 Da; putative annotation: N/A; putative formula: C39H77NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.62,"smiles":null,"spectrum_id":"CCMSLIB00017268124","spectrum_index":29588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 116.0827 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.142,"smiles":null,"spectrum_id":"CCMSLIB00017268127","spectrum_index":29589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 80.0243 Da; putative annotation: N/A; putative formula: CN6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.079,"smiles":null,"spectrum_id":"CCMSLIB00017268128","spectrum_index":29590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 45.0216 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.129,"smiles":null,"spectrum_id":"CCMSLIB00017268131","spectrum_index":29591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380746-01!1,7-bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 276.1153 Da; putative annotation: N/A; putative formula: C12H24N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.29,"smiles":null,"spectrum_id":"CCMSLIB00017268134","spectrum_index":29592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 345.2161 Da; putative annotation: N/A; putative formula: C18H35NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.287,"smiles":null,"spectrum_id":"CCMSLIB00017268135","spectrum_index":29593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 41.0752 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.229,"smiles":null,"spectrum_id":"CCMSLIB00017268138","spectrum_index":29594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 456.1415 Da; putative annotation: N/A; putative formula: C16H28N2O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.259,"smiles":null,"spectrum_id":"CCMSLIB00017268141","spectrum_index":29595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 60.1449 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.248,"smiles":null,"spectrum_id":"CCMSLIB00017268144","spectrum_index":29596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 90.0824 Da; putative annotation: N/A; putative formula: C8H10O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.137,"smiles":null,"spectrum_id":"CCMSLIB00017268145","spectrum_index":29597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 90.0589 Da; putative annotation: N/A; putative formula: C6H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.098,"smiles":null,"spectrum_id":"CCMSLIB00017268148","spectrum_index":29598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 125.1317 Da; putative annotation: N/A; putative formula: C7H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.192,"smiles":null,"spectrum_id":"CCMSLIB00017268151","spectrum_index":29599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 129.9057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.987,"smiles":null,"spectrum_id":"CCMSLIB00017268154","spectrum_index":29600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 368.2095 Da; putative annotation: N/A; putative formula: C14H32N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.301,"smiles":null,"spectrum_id":"CCMSLIB00017268155","spectrum_index":29601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 108.0299 Da; putative annotation: N/A; putative formula: CN8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.071,"smiles":null,"spectrum_id":"CCMSLIB00017268158","spectrum_index":29602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 212.0841 Da; putative annotation: N/A; putative formula: C7H12N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017268161","spectrum_index":29603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 214.048 Da; putative annotation: N/A; putative formula: C9H10O6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.113,"smiles":null,"spectrum_id":"CCMSLIB00017268163","spectrum_index":29604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000323 Chanoclavine-I|Isochanoclavin|(E)-2-methyl-3-[(4R,5R)-4-(methylamino)-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl]prop-2-en-1-ol (delta mass: 23.0113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.176,"smiles":null,"spectrum_id":"CCMSLIB00017268165","spectrum_index":29605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 398.2262 Da; putative annotation: N/A; putative formula: C14H22N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.323,"smiles":null,"spectrum_id":"CCMSLIB00017268168","spectrum_index":29606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE0; MS2Dec (delta mass: 84.058 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017268171","spectrum_index":29607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 55.101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.135,"smiles":null,"spectrum_id":"CCMSLIB00017268172","spectrum_index":29608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 27.0245 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.128,"smiles":null,"spectrum_id":"CCMSLIB00017268175","spectrum_index":29609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 60.1536 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.23,"smiles":null,"spectrum_id":"CCMSLIB00017268178","spectrum_index":29610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 10.0294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.107,"smiles":null,"spectrum_id":"CCMSLIB00017268180","spectrum_index":29611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 2.0196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017268182","spectrum_index":29612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 220.0877 Da; putative annotation: N/A; putative formula: C10H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.237,"smiles":null,"spectrum_id":"CCMSLIB00017268185","spectrum_index":29613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 392.2065 Da; putative annotation: N/A; putative formula: C20H40O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.302,"smiles":null,"spectrum_id":"CCMSLIB00017268188","spectrum_index":29614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine (delta mass: 78.031 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.139,"smiles":null,"spectrum_id":"CCMSLIB00017268189","spectrum_index":29615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methylquinolin-2(1H)-one (delta mass: 134.1368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.212,"smiles":null,"spectrum_id":"CCMSLIB00017268192","spectrum_index":29616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 139.0001 Da; putative annotation: N/A; putative formula: C6H6NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.062,"smiles":null,"spectrum_id":"CCMSLIB00017268195","spectrum_index":29617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 85.0103 Da; putative annotation: N/A; putative formula: C2H3N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.108,"smiles":null,"spectrum_id":"CCMSLIB00017268197","spectrum_index":29618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-(Oxydimethanediyl)bis(2-ethylpropane-1,3-diol) (delta mass: 45.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.243,"smiles":null,"spectrum_id":"CCMSLIB00017268199","spectrum_index":29619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 53.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017268202","spectrum_index":29620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 108.0215 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017268205","spectrum_index":29621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 155.0946 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.217,"smiles":null,"spectrum_id":"CCMSLIB00017268208","spectrum_index":29622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 94.0985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.179,"smiles":null,"spectrum_id":"CCMSLIB00017268209","spectrum_index":29623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 86.0364 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.149,"smiles":null,"spectrum_id":"CCMSLIB00017268212","spectrum_index":29624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 121.0399 Da; putative annotation: N/A; putative formula: C2H8N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.111,"smiles":null,"spectrum_id":"CCMSLIB00017268215","spectrum_index":29625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 267.1549 Da; putative annotation: N/A; putative formula: C9H17N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.341,"smiles":null,"spectrum_id":"CCMSLIB00017268218","spectrum_index":29626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 127.0836 Da; putative annotation: N/A; putative formula: C7H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.164,"smiles":null,"spectrum_id":"CCMSLIB00017268219","spectrum_index":29627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 98.0003 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.076,"smiles":null,"spectrum_id":"CCMSLIB00017268222","spectrum_index":29628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 27.0474 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.223,"smiles":null,"spectrum_id":"CCMSLIB00017268225","spectrum_index":29629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 374.2802 Da; putative annotation: N/A; putative formula: C20H34N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.351,"smiles":null,"spectrum_id":"CCMSLIB00017268226","spectrum_index":29630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide IV (delta mass: 217.1049 Da; putative annotation: N/A; putative formula: C10H20NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.213,"smiles":null,"spectrum_id":"CCMSLIB00017268229","spectrum_index":29631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 293.1513 Da; putative annotation: N/A; putative formula: C12H28N3O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.202,"smiles":null,"spectrum_id":"CCMSLIB00017268232","spectrum_index":29632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MELIBIOSE (delta mass: 177.9405 Da; putative annotation: N/A; putative formula: C5H6O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.064,"smiles":null,"spectrum_id":"CCMSLIB00017268233","spectrum_index":29633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Ile (delta mass: 281.1383 Da; putative annotation: N/A; putative formula: C14H23N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.299,"smiles":null,"spectrum_id":"CCMSLIB00017268236","spectrum_index":29634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 308.1076 Da; putative annotation: N/A; putative formula: C18H17N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.261,"smiles":null,"spectrum_id":"CCMSLIB00017268239","spectrum_index":29635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 846.7097 Da; putative annotation: N/A; putative formula: C56H94O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1068.81,"smiles":null,"spectrum_id":"CCMSLIB00017268240","spectrum_index":29636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 582.3027 Da; putative annotation: N/A; putative formula: C27H38N10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.363,"smiles":null,"spectrum_id":"CCMSLIB00017268243","spectrum_index":29637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 58.0205 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.096,"smiles":null,"spectrum_id":"CCMSLIB00017268245","spectrum_index":29638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 76.054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.134,"smiles":null,"spectrum_id":"CCMSLIB00017268247","spectrum_index":29639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 197.0898 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.239,"smiles":null,"spectrum_id":"CCMSLIB00017268250","spectrum_index":29640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 315.2208 Da; putative annotation: N/A; putative formula: C13H29N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.354,"smiles":null,"spectrum_id":"CCMSLIB00017268252","spectrum_index":29641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine; AIF; CE10; MS2Dec (delta mass: 185.0337 Da; putative annotation: N/A; putative formula: C8H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.12,"smiles":null,"spectrum_id":"CCMSLIB00017268254","spectrum_index":29642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 179.0947 Da; putative annotation: N/A; putative formula: C10H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.181,"smiles":null,"spectrum_id":"CCMSLIB00017268257","spectrum_index":29643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,7,8-trimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 32.0473 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.154,"smiles":null,"spectrum_id":"CCMSLIB00017268260","spectrum_index":29644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 179.1528 Da; putative annotation: N/A; putative formula: C9H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.327,"smiles":null,"spectrum_id":"CCMSLIB00017268261","spectrum_index":29645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301112 L-Oxonoreleagnine (delta mass: 59.0734 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.16,"smiles":null,"spectrum_id":"CCMSLIB00017268264","spectrum_index":29646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 367.1599 Da; putative annotation: N/A; putative formula: C14H29N3O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.257,"smiles":null,"spectrum_id":"CCMSLIB00017268267","spectrum_index":29647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 578.4672 Da; putative annotation: N/A; putative formula: C35H58N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.538,"smiles":null,"spectrum_id":"CCMSLIB00017268269","spectrum_index":29648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 65.0993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.203,"smiles":null,"spectrum_id":"CCMSLIB00017268271","spectrum_index":29649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 73.0893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.248,"smiles":null,"spectrum_id":"CCMSLIB00017268274","spectrum_index":29650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 420.2887 Da; putative annotation: N/A; putative formula: C26H36N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.375,"smiles":null,"spectrum_id":"CCMSLIB00017268277","spectrum_index":29651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 55.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.191,"smiles":null,"spectrum_id":"CCMSLIB00017268278","spectrum_index":29652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Methionine (delta mass: 128.084 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.142,"smiles":null,"spectrum_id":"CCMSLIB00017268281","spectrum_index":29653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 95.0373 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.145,"smiles":null,"spectrum_id":"CCMSLIB00017268283","spectrum_index":29654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 73.092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.18,"smiles":null,"spectrum_id":"CCMSLIB00017268285","spectrum_index":29655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 45.0572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.096,"smiles":null,"spectrum_id":"CCMSLIB00017268288","spectrum_index":29656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Thienyl)-1H-imidazole (delta mass: 492.2012 Da; putative annotation: N/A; putative formula: C27H40S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.234,"smiles":null,"spectrum_id":"CCMSLIB00017268291","spectrum_index":29657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 339.1342 Da; putative annotation: N/A; putative formula: C18H13N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.205,"smiles":null,"spectrum_id":"CCMSLIB00017268292","spectrum_index":29658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 39.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.175,"smiles":null,"spectrum_id":"CCMSLIB00017268295","spectrum_index":29659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 45.0097 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.127,"smiles":null,"spectrum_id":"CCMSLIB00017268298","spectrum_index":29660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[1-(3-Fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carbohydrazide (delta mass: 60.0236 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.103,"smiles":null,"spectrum_id":"CCMSLIB00017268301","spectrum_index":29661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-methoxybenzyl)ethanamine (delta mass: 98.0312 Da; putative annotation: N/A; putative formula: C4H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.176,"smiles":null,"spectrum_id":"CCMSLIB00017268302","spectrum_index":29662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 131.0951 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.228,"smiles":null,"spectrum_id":"CCMSLIB00017268305","spectrum_index":29663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 17.0332 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017268308","spectrum_index":29664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 140.0106 Da; putative annotation: N/A; putative formula: C6H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.086,"smiles":null,"spectrum_id":"CCMSLIB00017268309","spectrum_index":29665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 329.1844 Da; putative annotation: N/A; putative formula: C17H31NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.245,"smiles":null,"spectrum_id":"CCMSLIB00017268312","spectrum_index":29666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-2-carboxylic acid (delta mass: 60.0386 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.072,"smiles":null,"spectrum_id":"CCMSLIB00017268315","spectrum_index":29667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 37.9806 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.056,"smiles":null,"spectrum_id":"CCMSLIB00017268317","spectrum_index":29668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 391.0642 Da; putative annotation: N/A; putative formula: C18H18NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.135,"smiles":null,"spectrum_id":"CCMSLIB00017268319","spectrum_index":29669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 9.9838 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.096,"smiles":null,"spectrum_id":"CCMSLIB00017268322","spectrum_index":29670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 92.0511 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.201,"smiles":null,"spectrum_id":"CCMSLIB00017268325","spectrum_index":29671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 262.1445 Da; putative annotation: N/A; putative formula: C11H23N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.257,"smiles":null,"spectrum_id":"CCMSLIB00017268326","spectrum_index":29672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 136.1256 Da; putative annotation: Geraniol; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.196,"smiles":null,"spectrum_id":"CCMSLIB00017268329","spectrum_index":29673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxylic acid (delta mass: 120.0574 Da; putative annotation: 4-Hydroxyphenethyl alcohol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.112,"smiles":null,"spectrum_id":"CCMSLIB00017268332","spectrum_index":29674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Asp (delta mass: 200.1155 Da; putative annotation: Leu-Ser; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.244,"smiles":null,"spectrum_id":"CCMSLIB00017268333","spectrum_index":29675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 82.0421 Da; putative annotation: 3,3-Dimethylacrylic acid; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.113,"smiles":null,"spectrum_id":"CCMSLIB00017268336","spectrum_index":29676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 108.0934 Da; putative annotation: Bicyclo[2.2.1]heptane-2-methanol; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.299,"smiles":null,"spectrum_id":"CCMSLIB00017268339","spectrum_index":29677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 161.0663 Da; putative annotation: 2-Amino-2-deoxy-D-glucopyranose; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.19,"smiles":null,"spectrum_id":"CCMSLIB00017268341","spectrum_index":29678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 281.2713 Da; putative annotation: 2S-Amino-4E-octadecene-1,3S-diol; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.342,"smiles":null,"spectrum_id":"CCMSLIB00017268343","spectrum_index":29679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 386.1586 Da; putative annotation: 1-O-((2E,4E)-9-Carboxy-8-hydroxy-2,7-dimethylnona-2,4-dienoyl)-.beta.-D-glucopyranose; putative formula: C18H26O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.271,"smiles":null,"spectrum_id":"CCMSLIB00017268346","spectrum_index":29680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 160.0884 Da; putative annotation: 3-tert-Butyl-2-hydroxybenzaldehyde; putative formula: C11H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.169,"smiles":null,"spectrum_id":"CCMSLIB00017268349","spectrum_index":29681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Leu (delta mass: 113.0845 Da; putative annotation: 2-[(2-Methylpropyl)amino]acetic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017268350","spectrum_index":29682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 170.1288 Da; putative annotation: (1R,2R,4R)-4-(2-Hydroxypropan-2-yl)-1-methylcyclohexane-1,2-diol; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.21,"smiles":null,"spectrum_id":"CCMSLIB00017268353","spectrum_index":29683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 85.0154 Da; putative annotation: N-Formylglycine; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.097,"smiles":null,"spectrum_id":"CCMSLIB00017268356","spectrum_index":29684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 85.0192 Da; putative annotation: N/A; putative formula: C2H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.105,"smiles":null,"spectrum_id":"CCMSLIB00017268357","spectrum_index":29685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 428.287 Da; putative annotation: N/A; putative formula: C34H36O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.4,"smiles":null,"spectrum_id":"CCMSLIB00017268360","spectrum_index":29686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 253.1273 Da; putative annotation: N/A; putative formula: C8H19N3O6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.245,"smiles":null,"spectrum_id":"CCMSLIB00017268363","spectrum_index":29687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 383.2533 Da; putative annotation: N/A; putative formula: C18H33N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.34,"smiles":null,"spectrum_id":"CCMSLIB00017268364","spectrum_index":29688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)propane-1,2-diol (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.091,"smiles":null,"spectrum_id":"CCMSLIB00017268367","spectrum_index":29689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 91.0534 Da; putative annotation: N/A; putative formula: C5H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.14,"smiles":null,"spectrum_id":"CCMSLIB00017268370","spectrum_index":29690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 175.0522 Da; putative annotation: N/A; putative formula: C4H9N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.124,"smiles":null,"spectrum_id":"CCMSLIB00017268371","spectrum_index":29691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Hydroxymethyl)quinolin-8-ol (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.108,"smiles":null,"spectrum_id":"CCMSLIB00017268374","spectrum_index":29692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 164.0109 Da; putative annotation: N/A; putative formula: C8H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.055,"smiles":null,"spectrum_id":"CCMSLIB00017268377","spectrum_index":29693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 77.0839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.144,"smiles":null,"spectrum_id":"CCMSLIB00017268380","spectrum_index":29694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 500.2444 Da; putative annotation: N/A; putative formula: C25H40O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.419,"smiles":null,"spectrum_id":"CCMSLIB00017268381","spectrum_index":29695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 126.0173 Da; putative annotation: N/A; putative formula: C3H2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.151,"smiles":null,"spectrum_id":"CCMSLIB00017268384","spectrum_index":29696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 99.0351 Da; putative annotation: N/A; putative formula: C3H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.121,"smiles":null,"spectrum_id":"CCMSLIB00017268385","spectrum_index":29697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 258.2201 Da; putative annotation: N/A; putative formula: C15H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.291,"smiles":null,"spectrum_id":"CCMSLIB00017268388","spectrum_index":29698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 452.254 Da; putative annotation: N/A; putative formula: C21H41O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.341,"smiles":null,"spectrum_id":"CCMSLIB00017268391","spectrum_index":29699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 270.1007 Da; putative annotation: N/A; putative formula: C15H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.192,"smiles":null,"spectrum_id":"CCMSLIB00017268392","spectrum_index":29700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid (delta mass: 253.1742 Da; putative annotation: N/A; putative formula: C12H23N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.233,"smiles":null,"spectrum_id":"CCMSLIB00017268395","spectrum_index":29701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOSE (delta mass: 180.1484 Da; putative annotation: N/A; putative formula: C8H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.272,"smiles":null,"spectrum_id":"CCMSLIB00017268398","spectrum_index":29702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Pyrrol-1-yl)benzohydrazide (delta mass: 88.0406 Da; putative annotation: N/A; putative formula: C6H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.138,"smiles":null,"spectrum_id":"CCMSLIB00017268401","spectrum_index":29703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 79.0071 Da; putative annotation: N/A; putative formula: C4HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.14,"smiles":null,"spectrum_id":"CCMSLIB00017268402","spectrum_index":29704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311023 Feruloyl O-methyldopamine (delta mass: 248.0538 Da; putative annotation: N/A; putative formula: C12H13N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.203,"smiles":null,"spectrum_id":"CCMSLIB00017268406","spectrum_index":29705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 71.9892 Da; putative annotation: N/A; putative formula: N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.128,"smiles":null,"spectrum_id":"CCMSLIB00017268408","spectrum_index":29706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 142.062 Da; putative annotation: N/A; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.148,"smiles":null,"spectrum_id":"CCMSLIB00017268411","spectrum_index":29707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 222.2861 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.346,"smiles":null,"spectrum_id":"CCMSLIB00017268414","spectrum_index":29708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 158.0691 Da; putative annotation: N/A; putative formula: C6H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.155,"smiles":null,"spectrum_id":"CCMSLIB00017268415","spectrum_index":29709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 28.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.134,"smiles":null,"spectrum_id":"CCMSLIB00017268418","spectrum_index":29710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 162.043 Da; putative annotation: N/A; putative formula: C8H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.129,"smiles":null,"spectrum_id":"CCMSLIB00017268421","spectrum_index":29711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 114.0648 Da; putative annotation: N/A; putative formula: C2H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.146,"smiles":null,"spectrum_id":"CCMSLIB00017268423","spectrum_index":29712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 144.0574 Da; putative annotation: N/A; putative formula: C10H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.212,"smiles":null,"spectrum_id":"CCMSLIB00017268425","spectrum_index":29713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 86.0853 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.151,"smiles":null,"spectrum_id":"CCMSLIB00017268427","spectrum_index":29714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 255.0375 Da; putative annotation: N/A; putative formula: C10H9NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.14,"smiles":null,"spectrum_id":"CCMSLIB00017268430","spectrum_index":29715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 252.0858 Da; putative annotation: N/A; putative formula: C10H12N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.208,"smiles":null,"spectrum_id":"CCMSLIB00017268433","spectrum_index":29716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 45.0656 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.181,"smiles":null,"spectrum_id":"CCMSLIB00017268436","spectrum_index":29717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 192.2238 Da; putative annotation: N/A; putative formula: C15H28O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.294,"smiles":null,"spectrum_id":"CCMSLIB00017268437","spectrum_index":29718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 841.4848 Da; putative annotation: N/A; putative formula: C45H63N9O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1170.75,"smiles":null,"spectrum_id":"CCMSLIB00017268440","spectrum_index":29719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 36.0363 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017268443","spectrum_index":29720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-mannosamine - 40.0 eV (delta mass: 707.7221 Da; putative annotation: N/A; putative formula: C41H89N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":929.819,"smiles":null,"spectrum_id":"CCMSLIB00017268444","spectrum_index":29721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 64.0151 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.174,"smiles":null,"spectrum_id":"CCMSLIB00017268447","spectrum_index":29722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Gln-Lys (delta mass: 119.0489 Da; putative annotation: N/A; putative formula: C6H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.252,"smiles":null,"spectrum_id":"CCMSLIB00017268450","spectrum_index":29723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 241.0903 Da; putative annotation: N/A; putative formula: C3H7N13O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.177,"smiles":null,"spectrum_id":"CCMSLIB00017268452","spectrum_index":29724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 155.099 Da; putative annotation: N/A; putative formula: C7H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.228,"smiles":null,"spectrum_id":"CCMSLIB00017268454","spectrum_index":29725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 636.3714 Da; putative annotation: N/A; putative formula: C44H48N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.408,"smiles":null,"spectrum_id":"CCMSLIB00017268457","spectrum_index":29726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 84.0584 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.155,"smiles":null,"spectrum_id":"CCMSLIB00017268460","spectrum_index":29727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 226.085 Da; putative annotation: N/A; putative formula: C12H18S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.25,"smiles":null,"spectrum_id":"CCMSLIB00017268461","spectrum_index":29728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine (delta mass: 391.2654 Da; putative annotation: N/A; putative formula: C14H33N9O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":805.529,"smiles":null,"spectrum_id":"CCMSLIB00017268464","spectrum_index":29729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 343.1267 Da; putative annotation: N/A; putative formula: C15H21NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.255,"smiles":null,"spectrum_id":"CCMSLIB00017268467","spectrum_index":29730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 39.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.16,"smiles":null,"spectrum_id":"CCMSLIB00017268468","spectrum_index":29731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 51.5425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.602,"smiles":null,"spectrum_id":"CCMSLIB00017268471","spectrum_index":29732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00017 Biotin (delta mass: 515.259 Da; putative annotation: N/A; putative formula: C32H38NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.354,"smiles":null,"spectrum_id":"CCMSLIB00017268474","spectrum_index":29733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 83.0755 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.151,"smiles":null,"spectrum_id":"CCMSLIB00017268475","spectrum_index":29734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[3-(Trifluoromethyl)phenyl]ethylamine (delta mass: 27.0244 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.108,"smiles":null,"spectrum_id":"CCMSLIB00017268478","spectrum_index":29735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imazaquin (delta mass: 424.2057 Da; putative annotation: N/A; putative formula: C20H41OPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.34,"smiles":null,"spectrum_id":"CCMSLIB00017268481","spectrum_index":29736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 54.0214 Da; putative annotation: N/A; putative formula: C2H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.108,"smiles":null,"spectrum_id":"CCMSLIB00017268483","spectrum_index":29737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100147 Indole-3-acetaldehyde (delta mass: 126.0379 Da; putative annotation: N/A; putative formula: C4H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.114,"smiles":null,"spectrum_id":"CCMSLIB00017268485","spectrum_index":29738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 83.0195 Da; putative annotation: N/A; putative formula: C4H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.101,"smiles":null,"spectrum_id":"CCMSLIB00017268488","spectrum_index":29739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 828.219 Da; putative annotation: N/A; putative formula: C39H32N12O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1495.45,"smiles":null,"spectrum_id":"CCMSLIB00017268491","spectrum_index":29740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 400.2781 Da; putative annotation: N/A; putative formula: C22H36N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":743.402,"smiles":null,"spectrum_id":"CCMSLIB00017268492","spectrum_index":29741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine - 40.0 eV (delta mass: 193.1076 Da; putative annotation: N/A; putative formula: C7H11N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.158,"smiles":null,"spectrum_id":"CCMSLIB00017268495","spectrum_index":29742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-Nor-9-carboxy-.DELTA.9-tetrahydrocannabinol (delta mass: 178.0426 Da; putative annotation: N/A; putative formula: C6H6N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.249,"smiles":null,"spectrum_id":"CCMSLIB00017268498","spectrum_index":29743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 167.0487 Da; putative annotation: N/A; putative formula: C10H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.208,"smiles":null,"spectrum_id":"CCMSLIB00017268499","spectrum_index":29744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 171.261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.4,"smiles":null,"spectrum_id":"CCMSLIB00017268502","spectrum_index":29745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 354.1815 Da; putative annotation: N/A; putative formula: C16H27N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.263,"smiles":null,"spectrum_id":"CCMSLIB00017268505","spectrum_index":29746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 178.7593 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.83,"smiles":null,"spectrum_id":"CCMSLIB00017268506","spectrum_index":29747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 90.0509 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.21,"smiles":null,"spectrum_id":"CCMSLIB00017268509","spectrum_index":29748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 125.0474 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.123,"smiles":null,"spectrum_id":"CCMSLIB00017268512","spectrum_index":29749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 32.093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.171,"smiles":null,"spectrum_id":"CCMSLIB00017268515","spectrum_index":29750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 24.0005 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.087,"smiles":null,"spectrum_id":"CCMSLIB00017268518","spectrum_index":29751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-N-phenyl-1H-indole-2-carboxamide (delta mass: 159.0865 Da; putative annotation: N/A; putative formula: C3H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.204,"smiles":null,"spectrum_id":"CCMSLIB00017268520","spectrum_index":29752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 10.003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.048,"smiles":null,"spectrum_id":"CCMSLIB00017268522","spectrum_index":29753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 52.0653 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.125,"smiles":null,"spectrum_id":"CCMSLIB00017268525","spectrum_index":29754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Ile (delta mass: 115.0264 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.212,"smiles":null,"spectrum_id":"CCMSLIB00017268526","spectrum_index":29755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 227.134 Da; putative annotation: N/A; putative formula: C12H21NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.226,"smiles":null,"spectrum_id":"CCMSLIB00017268529","spectrum_index":29756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 110.0361 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.122,"smiles":null,"spectrum_id":"CCMSLIB00017268531","spectrum_index":29757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 14.016 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.102,"smiles":null,"spectrum_id":"CCMSLIB00017268534","spectrum_index":29758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 77.0186 Da; putative annotation: N/A; putative formula: H3N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.099,"smiles":null,"spectrum_id":"CCMSLIB00017268537","spectrum_index":29759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 9.05 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.126,"smiles":null,"spectrum_id":"CCMSLIB00017268539","spectrum_index":29760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 341.83 Da; putative annotation: N/A; putative formula: C8H6O-1S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.901,"smiles":null,"spectrum_id":"CCMSLIB00017268541","spectrum_index":29761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 152.0118 Da; putative annotation: N/A; putative formula: C8H8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.103,"smiles":null,"spectrum_id":"CCMSLIB00017268544","spectrum_index":29762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1077.3605 Da; putative annotation: N/A; putative formula: C37H65N11O20P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1240.42,"smiles":null,"spectrum_id":"CCMSLIB00017268547","spectrum_index":29763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin; AIF; CE10; MS2Dec (delta mass: 132.0972 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.193,"smiles":null,"spectrum_id":"CCMSLIB00017268548","spectrum_index":29764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 35.0615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.211,"smiles":null,"spectrum_id":"CCMSLIB00017268552","spectrum_index":29765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 126.0163 Da; putative annotation: N/A; putative formula: C6H8O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.092,"smiles":null,"spectrum_id":"CCMSLIB00017268554","spectrum_index":29766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:102040 (delta mass: 116.0447 Da; putative annotation: N/A; putative formula: CH4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.125,"smiles":null,"spectrum_id":"CCMSLIB00017268557","spectrum_index":29767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.112,"smiles":null,"spectrum_id":"CCMSLIB00017268560","spectrum_index":29768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 271.1785 Da; putative annotation: N/A; putative formula: C14H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.259,"smiles":null,"spectrum_id":"CCMSLIB00017268561","spectrum_index":29769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 165.0841 Da; putative annotation: N/A; putative formula: C8H12N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.243,"smiles":null,"spectrum_id":"CCMSLIB00017268564","spectrum_index":29770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 505.129 Da; putative annotation: N/A; putative formula: C27H24NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.2,"smiles":null,"spectrum_id":"CCMSLIB00017268567","spectrum_index":29771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 101.0405 Da; putative annotation: N/A; putative formula: C3H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.095,"smiles":null,"spectrum_id":"CCMSLIB00017268568","spectrum_index":29772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coniferaldehyde (delta mass: 280.1308 Da; putative annotation: N/A; putative formula: C15H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.201,"smiles":null,"spectrum_id":"CCMSLIB00017268571","spectrum_index":29773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 716.4517 Da; putative annotation: N/A; putative formula: C43H64N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.522,"smiles":null,"spectrum_id":"CCMSLIB00017268574","spectrum_index":29774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 23.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017268577","spectrum_index":29775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Trifluoromethyl)-1H-indole-2-carboxylic acid (delta mass: 84.0271 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.069,"smiles":null,"spectrum_id":"CCMSLIB00017268580","spectrum_index":29776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 285.121 Da; putative annotation: N/A; putative formula: C13H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.216,"smiles":null,"spectrum_id":"CCMSLIB00017268583","spectrum_index":29777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 504.1049 Da; putative annotation: N/A; putative formula: C19H24N2O12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.165,"smiles":null,"spectrum_id":"CCMSLIB00017268584","spectrum_index":29778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 78.0102 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017268587","spectrum_index":29779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 88.0523 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.139,"smiles":null,"spectrum_id":"CCMSLIB00017268590","spectrum_index":29780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 82.0261 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017268593","spectrum_index":29781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 13.9463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.017,"smiles":null,"spectrum_id":"CCMSLIB00017268595","spectrum_index":29782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 302.2224 Da; putative annotation: N/A; putative formula: C16H26N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.498,"smiles":null,"spectrum_id":"CCMSLIB00017268597","spectrum_index":29783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(1H-Imidazol-4-yl)ethyl]-N'-(2-phenylethyl)thiourea (delta mass: 17.0331 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.166,"smiles":null,"spectrum_id":"CCMSLIB00017268600","spectrum_index":29784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP025503 Hexanoyl-L-Carnitine|L-Hexanoylcarnitine|(3R)-3-hexanoyloxy-4-(trimethylazaniumyl)butanoate (delta mass: 70.0762 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.262,"smiles":null,"spectrum_id":"CCMSLIB00017268603","spectrum_index":29785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 65.9899 Da; putative annotation: N/A; putative formula: C7H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.143,"smiles":null,"spectrum_id":"CCMSLIB00017268606","spectrum_index":29786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 50.0 eV (delta mass: 81.0142 Da; putative annotation: N/A; putative formula: C4H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.09,"smiles":null,"spectrum_id":"CCMSLIB00017268607","spectrum_index":29787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 288.0631 Da; putative annotation: N/A; putative formula: C10H17N4PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.123,"smiles":null,"spectrum_id":"CCMSLIB00017268611","spectrum_index":29788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 141.078 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.17,"smiles":null,"spectrum_id":"CCMSLIB00017268613","spectrum_index":29789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 208.1823 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.263,"smiles":null,"spectrum_id":"CCMSLIB00017268616","spectrum_index":29790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-1-(5-chloro-2-methyl-1H-indol-3-yl)ethanone (delta mass: 81.9897 Da; putative annotation: N/A; putative formula: CH-2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.003,"smiles":null,"spectrum_id":"CCMSLIB00017268619","spectrum_index":29791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 463.1737 Da; putative annotation: N/A; putative formula: C17H29N5O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1130.4,"smiles":null,"spectrum_id":"CCMSLIB00017268622","spectrum_index":29792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 342.0681 Da; putative annotation: N/A; putative formula: C25H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.165,"smiles":null,"spectrum_id":"CCMSLIB00017268623","spectrum_index":29793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 201.074 Da; putative annotation: N/A; putative formula: C10H10F3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.243,"smiles":null,"spectrum_id":"CCMSLIB00017268626","spectrum_index":29794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 79.0423 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017268627","spectrum_index":29795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 45.0214 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.087,"smiles":null,"spectrum_id":"CCMSLIB00017268630","spectrum_index":29796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 26.0155 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.081,"smiles":null,"spectrum_id":"CCMSLIB00017268633","spectrum_index":29797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 140.0986 Da; putative annotation: N/A; putative formula: C12H12O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.164,"smiles":null,"spectrum_id":"CCMSLIB00017268634","spectrum_index":29798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 159.0896 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.186,"smiles":null,"spectrum_id":"CCMSLIB00017268637","spectrum_index":29799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 91.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.128,"smiles":null,"spectrum_id":"CCMSLIB00017268640","spectrum_index":29800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 114.0469 Da; putative annotation: N/A; putative formula: C9H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.164,"smiles":null,"spectrum_id":"CCMSLIB00017268641","spectrum_index":29801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 78.0356 Da; putative annotation: N/A; putative formula: C3H2N4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.096,"smiles":null,"spectrum_id":"CCMSLIB00017268644","spectrum_index":29802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 289.179 Da; putative annotation: N/A; putative formula: C16H23N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.244,"smiles":null,"spectrum_id":"CCMSLIB00017268647","spectrum_index":29803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 293.2718 Da; putative annotation: N/A; putative formula: C19H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.384,"smiles":null,"spectrum_id":"CCMSLIB00017268649","spectrum_index":29804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 94.0302 Da; putative annotation: N/A; putative formula: C3H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.174,"smiles":null,"spectrum_id":"CCMSLIB00017268651","spectrum_index":29805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 209.0758 Da; putative annotation: N/A; putative formula: C14H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.157,"smiles":null,"spectrum_id":"CCMSLIB00017268654","spectrum_index":29806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 524.2087 Da; putative annotation: N/A; putative formula: C29H29N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.279,"smiles":null,"spectrum_id":"CCMSLIB00017268657","spectrum_index":29807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 175.9723 Da; putative annotation: N/A; putative formula: C12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.069,"smiles":null,"spectrum_id":"CCMSLIB00017268659","spectrum_index":29808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 194.0432 Da; putative annotation: N/A; putative formula: C9H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.124,"smiles":null,"spectrum_id":"CCMSLIB00017268661","spectrum_index":29809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Pro (delta mass: 97.053 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.171,"smiles":null,"spectrum_id":"CCMSLIB00017268664","spectrum_index":29810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 378.1883 Da; putative annotation: N/A; putative formula: C22H26N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.29,"smiles":null,"spectrum_id":"CCMSLIB00017268667","spectrum_index":29811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 70.4874 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.61,"smiles":null,"spectrum_id":"CCMSLIB00017268668","spectrum_index":29812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 66.0583 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.165,"smiles":null,"spectrum_id":"CCMSLIB00017268671","spectrum_index":29813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 41.0149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.122,"smiles":null,"spectrum_id":"CCMSLIB00017268674","spectrum_index":29814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 32.4352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017268676","spectrum_index":29815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 62.0165 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.071,"smiles":null,"spectrum_id":"CCMSLIB00017268678","spectrum_index":29816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 159.0533 Da; putative annotation: N/A; putative formula: C6H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.15,"smiles":null,"spectrum_id":"CCMSLIB00017268681","spectrum_index":29817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 288.0939 Da; putative annotation: N/A; putative formula: C23H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.135,"smiles":null,"spectrum_id":"CCMSLIB00017268684","spectrum_index":29818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 30.0 eV (delta mass: 114.0301 Da; putative annotation: N/A; putative formula: CH2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.1,"smiles":null,"spectrum_id":"CCMSLIB00017268687","spectrum_index":29819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-3-methyl-5-phenyl-, (5R)- (delta mass: 228.1001 Da; putative annotation: N/A; putative formula: C11H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.215,"smiles":null,"spectrum_id":"CCMSLIB00017268688","spectrum_index":29820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 84.0003 Da; putative annotation: N/A; putative formula: C7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.061,"smiles":null,"spectrum_id":"CCMSLIB00017268691","spectrum_index":29821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005843 Cinchonine|(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl)-quinolin-4-ylmethanol (delta mass: 313.3395 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.52,"smiles":null,"spectrum_id":"CCMSLIB00017268694","spectrum_index":29822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 97.8264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.903,"smiles":null,"spectrum_id":"CCMSLIB00017268695","spectrum_index":29823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoadipic acid (delta mass: 41.9927 Da; putative annotation: N/A; putative formula: C2H2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.069,"smiles":null,"spectrum_id":"CCMSLIB00017268698","spectrum_index":29824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 27.8418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.907,"smiles":null,"spectrum_id":"CCMSLIB00017268701","spectrum_index":29825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 176.0842 Da; putative annotation: N/A; putative formula: C11H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.196,"smiles":null,"spectrum_id":"CCMSLIB00017268702","spectrum_index":29826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 46.0481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017268705","spectrum_index":29827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 78.0314 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.133,"smiles":null,"spectrum_id":"CCMSLIB00017268708","spectrum_index":29828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 66.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.109,"smiles":null,"spectrum_id":"CCMSLIB00017268709","spectrum_index":29829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 417.0408 Da; putative annotation: N/A; putative formula: C15H20N3O3PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.12,"smiles":null,"spectrum_id":"CCMSLIB00017268712","spectrum_index":29830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 62.0948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.154,"smiles":null,"spectrum_id":"CCMSLIB00017268715","spectrum_index":29831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 144.2082 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.256,"smiles":null,"spectrum_id":"CCMSLIB00017268716","spectrum_index":29832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 581.3482 Da; putative annotation: N/A; putative formula: C31H52NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.445,"smiles":null,"spectrum_id":"CCMSLIB00017268719","spectrum_index":29833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 16.8419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.97,"smiles":null,"spectrum_id":"CCMSLIB00017268722","spectrum_index":29834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 92.1223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.182,"smiles":null,"spectrum_id":"CCMSLIB00017268724","spectrum_index":29835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 136.1253 Da; putative annotation: Geraniol; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.196,"smiles":null,"spectrum_id":"CCMSLIB00017268726","spectrum_index":29836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Glu (delta mass: 97.0527 Da; putative annotation: PROLINE; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.166,"smiles":null,"spectrum_id":"CCMSLIB00017268729","spectrum_index":29837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 294.083 Da; putative annotation: 4-[(2E)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy-2,3-dihydroxy-2-methylbutanoic acid; putative formula: C14H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.124,"smiles":null,"spectrum_id":"CCMSLIB00017268732","spectrum_index":29838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Leu (delta mass: 242.1284 Da; putative annotation: Leu-Glu; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.289,"smiles":null,"spectrum_id":"CCMSLIB00017268735","spectrum_index":29839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 270.2339 Da; putative annotation: 15-Stachen-19-ol; putative formula: C20H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.362,"smiles":null,"spectrum_id":"CCMSLIB00017268736","spectrum_index":29840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381222-01!1,3,5-trihydroxy-4-[(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid (delta mass: 144.0209 Da; putative annotation: Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.139,"smiles":null,"spectrum_id":"CCMSLIB00017268739","spectrum_index":29841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 184.1212 Da; putative annotation: Leu-Ala; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.276,"smiles":null,"spectrum_id":"CCMSLIB00017268741","spectrum_index":29842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 632.3934 Da; putative annotation: 1-O-((2.alpha.,3.beta.,5.Xi.,9.Xi.,18.Xi.,19.alpha.)-2,3,19-Trihydroxy-28-oxoolean-12-en-28-yl)-.beta.-D-glucopyranose; putative formula: C36H56O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.464,"smiles":null,"spectrum_id":"CCMSLIB00017268744","spectrum_index":29843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Phe (delta mass: 83.0366 Da; putative annotation: 1-Aminocyclopropanecarboxylic acid; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.165,"smiles":null,"spectrum_id":"CCMSLIB00017268746","spectrum_index":29844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Quinolinediol (delta mass: 104.0473 Da; putative annotation: Erythritol; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017268749","spectrum_index":29845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 530.2847 Da; putative annotation: Peruvoside; putative formula: C30H42O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.355,"smiles":null,"spectrum_id":"CCMSLIB00017268752","spectrum_index":29846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 158.0367 Da; putative annotation: 7-Hydroxy-4-methylcoumarin; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.133,"smiles":null,"spectrum_id":"CCMSLIB00017268753","spectrum_index":29847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 85.0584 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.16,"smiles":null,"spectrum_id":"CCMSLIB00017268756","spectrum_index":29848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Ser-Lys (delta mass: 83.0735 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.302,"smiles":null,"spectrum_id":"CCMSLIB00017268759","spectrum_index":29849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 158.1279 Da; putative annotation: N/A; putative formula: C5H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.208,"smiles":null,"spectrum_id":"CCMSLIB00017268760","spectrum_index":29850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 260.1618 Da; putative annotation: N/A; putative formula: C13H24O5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.227,"smiles":null,"spectrum_id":"CCMSLIB00017268763","spectrum_index":29851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 108.0935 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017268766","spectrum_index":29852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 144.1518 Da; putative annotation: N/A; putative formula: C5H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.233,"smiles":null,"spectrum_id":"CCMSLIB00017268767","spectrum_index":29853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 54.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.123,"smiles":null,"spectrum_id":"CCMSLIB00017268770","spectrum_index":29854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 175.0483 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.135,"smiles":null,"spectrum_id":"CCMSLIB00017268773","spectrum_index":29855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methylserine (delta mass: 42.0145 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.08,"smiles":null,"spectrum_id":"CCMSLIB00017268775","spectrum_index":29856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 16.8844 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.971,"smiles":null,"spectrum_id":"CCMSLIB00017268777","spectrum_index":29857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 301.1737 Da; putative annotation: N/A; putative formula: C14H28N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.244,"smiles":null,"spectrum_id":"CCMSLIB00017268780","spectrum_index":29858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 248.0501 Da; putative annotation: N/A; putative formula: C15H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.177,"smiles":null,"spectrum_id":"CCMSLIB00017268782","spectrum_index":29859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 156.151 Da; putative annotation: N/A; putative formula: C10H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017268785","spectrum_index":29860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 133.0372 Da; putative annotation: N/A; putative formula: C4H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.074,"smiles":null,"spectrum_id":"CCMSLIB00017268788","spectrum_index":29861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 175.0706 Da; putative annotation: N/A; putative formula: C4H9N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.182,"smiles":null,"spectrum_id":"CCMSLIB00017268790","spectrum_index":29862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 206.1671 Da; putative annotation: N/A; putative formula: C14H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.264,"smiles":null,"spectrum_id":"CCMSLIB00017268792","spectrum_index":29863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 186.1037 Da; putative annotation: N/A; putative formula: C7H15N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.19,"smiles":null,"spectrum_id":"CCMSLIB00017268795","spectrum_index":29864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU288003 Harman|1-methyl-9H-pyrido[3,4-b]indole (delta mass: 42.0464 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.138,"smiles":null,"spectrum_id":"CCMSLIB00017268797","spectrum_index":29865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SalbutamolSulfate (delta mass: 65.0709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.35,"smiles":null,"spectrum_id":"CCMSLIB00017268799","spectrum_index":29866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 166.0621 Da; putative annotation: N/A; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.164,"smiles":null,"spectrum_id":"CCMSLIB00017268802","spectrum_index":29867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 527.2373 Da; putative annotation: N/A; putative formula: C26H41NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.297,"smiles":null,"spectrum_id":"CCMSLIB00017268805","spectrum_index":29868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 61.956 Da; putative annotation: N/A; putative formula: H-1O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.11,"smiles":null,"spectrum_id":"CCMSLIB00017268807","spectrum_index":29869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 38.002 Da; putative annotation: N/A; putative formula: H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.067,"smiles":null,"spectrum_id":"CCMSLIB00017268809","spectrum_index":29870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole-3-acetic acid CollisionEnergy:205060 (delta mass: 31.9145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.98,"smiles":null,"spectrum_id":"CCMSLIB00017268812","spectrum_index":29871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 359.1424 Da; putative annotation: N/A; putative formula: C25H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.255,"smiles":null,"spectrum_id":"CCMSLIB00017268815","spectrum_index":29872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 294.2904 Da; putative annotation: N/A; putative formula: C16H34N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.35,"smiles":null,"spectrum_id":"CCMSLIB00017268817","spectrum_index":29873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 24.0726 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017268820","spectrum_index":29874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 135.1409 Da; putative annotation: N/A; putative formula: C10H17NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.274,"smiles":null,"spectrum_id":"CCMSLIB00017268822","spectrum_index":29875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C5:0 (delta mass: 120.0407 Da; putative annotation: N/A; putative formula: C8H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.185,"smiles":null,"spectrum_id":"CCMSLIB00017268825","spectrum_index":29876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 175.0632 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.155,"smiles":null,"spectrum_id":"CCMSLIB00017268827","spectrum_index":29877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101903 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 26.0181 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.104,"smiles":null,"spectrum_id":"CCMSLIB00017268829","spectrum_index":29878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 158.1511 Da; putative annotation: N/A; putative formula: C7H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.248,"smiles":null,"spectrum_id":"CCMSLIB00017268832","spectrum_index":29879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 372.233 Da; putative annotation: N/A; putative formula: C22H33N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.402,"smiles":null,"spectrum_id":"CCMSLIB00017268835","spectrum_index":29880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 321.2878 Da; putative annotation: N/A; putative formula: C18H35N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.369,"smiles":null,"spectrum_id":"CCMSLIB00017268837","spectrum_index":29881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 111.005 Da; putative annotation: N/A; putative formula: C3HN3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.201,"smiles":null,"spectrum_id":"CCMSLIB00017268840","spectrum_index":29882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 130.1084 Da; putative annotation: N/A; putative formula: C2H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.226,"smiles":null,"spectrum_id":"CCMSLIB00017268842","spectrum_index":29883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:102040\"\" (delta mass: 408.2898 Da; putative annotation: N/A; putative formula: C23H41N2O2P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.387,"smiles":null,"spectrum_id":"CCMSLIB00017268844","spectrum_index":29884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 167.0591 Da; putative annotation: N/A; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.236,"smiles":null,"spectrum_id":"CCMSLIB00017268847","spectrum_index":29885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 226.1201 Da; putative annotation: N/A; putative formula: C12H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.186,"smiles":null,"spectrum_id":"CCMSLIB00017268849","spectrum_index":29886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 381.2044 Da; putative annotation: N/A; putative formula: C24H32NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.317,"smiles":null,"spectrum_id":"CCMSLIB00017268852","spectrum_index":29887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 690.2532 Da; putative annotation: N/A; putative formula: C48H30N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.334,"smiles":null,"spectrum_id":"CCMSLIB00017268854","spectrum_index":29888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 52.032 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.301,"smiles":null,"spectrum_id":"CCMSLIB00017268856","spectrum_index":29889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 121.0384 Da; putative annotation: N/A; putative formula: C4H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.135,"smiles":null,"spectrum_id":"CCMSLIB00017268859","spectrum_index":29890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imazaquin (delta mass: 394.1957 Da; putative annotation: N/A; putative formula: C19H31N4OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.33,"smiles":null,"spectrum_id":"CCMSLIB00017268861","spectrum_index":29891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 220.1895 Da; putative annotation: N/A; putative formula: C14H24N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.238,"smiles":null,"spectrum_id":"CCMSLIB00017268864","spectrum_index":29892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 129.0536 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.129,"smiles":null,"spectrum_id":"CCMSLIB00017268866","spectrum_index":29893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 32.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.149,"smiles":null,"spectrum_id":"CCMSLIB00017268868","spectrum_index":29894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 115.0633 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.16,"smiles":null,"spectrum_id":"CCMSLIB00017268871","spectrum_index":29895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 132.0424 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017268873","spectrum_index":29896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxy-3,5-dimethoxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 2.0226 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.13,"smiles":null,"spectrum_id":"CCMSLIB00017268876","spectrum_index":29897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:UF413204 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 14.0805 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.207,"smiles":null,"spectrum_id":"CCMSLIB00017268878","spectrum_index":29898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin; AIF; CE0; MS2Dec (delta mass: 170.4046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.5,"smiles":null,"spectrum_id":"CCMSLIB00017268880","spectrum_index":29899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 170.0823 Da; putative annotation: N/A; putative formula: C5H11N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.121,"smiles":null,"spectrum_id":"CCMSLIB00017268882","spectrum_index":29900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 408.1529 Da; putative annotation: N/A; putative formula: C19H24N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.276,"smiles":null,"spectrum_id":"CCMSLIB00017268885","spectrum_index":29901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 24.0087 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.049,"smiles":null,"spectrum_id":"CCMSLIB00017268887","spectrum_index":29902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 570.442 Da; putative annotation: N/A; putative formula: C36H54N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.586,"smiles":null,"spectrum_id":"CCMSLIB00017268889","spectrum_index":29903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 357.2894 Da; putative annotation: N/A; putative formula: C21H35N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.376,"smiles":null,"spectrum_id":"CCMSLIB00017268892","spectrum_index":29904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 67.9898 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.118,"smiles":null,"spectrum_id":"CCMSLIB00017268894","spectrum_index":29905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 266.2597 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.351,"smiles":null,"spectrum_id":"CCMSLIB00017268897","spectrum_index":29906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]- (delta mass: 61.9903 Da; putative annotation: N/A; putative formula: C3H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.183,"smiles":null,"spectrum_id":"CCMSLIB00017268899","spectrum_index":29907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 15.8369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.964,"smiles":null,"spectrum_id":"CCMSLIB00017268901","spectrum_index":29908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 33.0236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.088,"smiles":null,"spectrum_id":"CCMSLIB00017268903","spectrum_index":29909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 147.0682 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.238,"smiles":null,"spectrum_id":"CCMSLIB00017268906","spectrum_index":29910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 74.0523 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.175,"smiles":null,"spectrum_id":"CCMSLIB00017268909","spectrum_index":29911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 142.003 Da; putative annotation: N/A; putative formula: C4H3ClN4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.074,"smiles":null,"spectrum_id":"CCMSLIB00017268911","spectrum_index":29912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 515.3453 Da; putative annotation: N/A; putative formula: C27H49NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.416,"smiles":null,"spectrum_id":"CCMSLIB00017268914","spectrum_index":29913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 100.0235 Da; putative annotation: N/A; putative formula: C2H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.1,"smiles":null,"spectrum_id":"CCMSLIB00017268915","spectrum_index":29914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 103.013 Da; putative annotation: N/A; putative formula: HN5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.058,"smiles":null,"spectrum_id":"CCMSLIB00017268918","spectrum_index":29915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 444.1991 Da; putative annotation: N/A; putative formula: C19H28N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.279,"smiles":null,"spectrum_id":"CCMSLIB00017268921","spectrum_index":29916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 77.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.108,"smiles":null,"spectrum_id":"CCMSLIB00017268923","spectrum_index":29917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 119.0576 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.18,"smiles":null,"spectrum_id":"CCMSLIB00017268926","spectrum_index":29918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 46.0052 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.138,"smiles":null,"spectrum_id":"CCMSLIB00017268927","spectrum_index":29919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 25.9228 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.003,"smiles":null,"spectrum_id":"CCMSLIB00017268930","spectrum_index":29920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 170.1069 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.532,"smiles":null,"spectrum_id":"CCMSLIB00017268933","spectrum_index":29921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 29.0148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.102,"smiles":null,"spectrum_id":"CCMSLIB00017268935","spectrum_index":29922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-2-Dodecen-1-ol (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.242,"smiles":null,"spectrum_id":"CCMSLIB00017268938","spectrum_index":29923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 78.0473 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.123,"smiles":null,"spectrum_id":"CCMSLIB00017268940","spectrum_index":29924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 25.8828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.969,"smiles":null,"spectrum_id":"CCMSLIB00017268942","spectrum_index":29925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4,8-Dimethoxyfuro[2,3-b]quinolin-7-yl)oxy]-3-methylbutane-2,3-diol (delta mass: 14.0163 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.16,"smiles":null,"spectrum_id":"CCMSLIB00017268945","spectrum_index":29926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 203.0581 Da; putative annotation: N/A; putative formula: C11H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.16,"smiles":null,"spectrum_id":"CCMSLIB00017268946","spectrum_index":29927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 307.1422 Da; putative annotation: N/A; putative formula: C16H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.213,"smiles":null,"spectrum_id":"CCMSLIB00017268949","spectrum_index":29928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 128.0586 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.198,"smiles":null,"spectrum_id":"CCMSLIB00017268952","spectrum_index":29929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-Gentiobiose (delta mass: 499.3286 Da; putative annotation: N/A; putative formula: C24H46N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":842.452,"smiles":null,"spectrum_id":"CCMSLIB00017268953","spectrum_index":29930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 327.0952 Da; putative annotation: N/A; putative formula: C14H17NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.197,"smiles":null,"spectrum_id":"CCMSLIB00017268956","spectrum_index":29931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 175.0671 Da; putative annotation: N/A; putative formula: C7H13NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.153,"smiles":null,"spectrum_id":"CCMSLIB00017268959","spectrum_index":29932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 163.0367 Da; putative annotation: N/A; putative formula: C3HN9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.123,"smiles":null,"spectrum_id":"CCMSLIB00017268961","spectrum_index":29933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 195.0921 Da; putative annotation: N/A; putative formula: C9H14N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.142,"smiles":null,"spectrum_id":"CCMSLIB00017268964","spectrum_index":29934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 361.2459 Da; putative annotation: N/A; putative formula: C18H35NO6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.301,"smiles":null,"spectrum_id":"CCMSLIB00017268966","spectrum_index":29935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 157.0004 Da; putative annotation: N/A; putative formula: C5H3NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.081,"smiles":null,"spectrum_id":"CCMSLIB00017268969","spectrum_index":29936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 145.052 Da; putative annotation: N/A; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.134,"smiles":null,"spectrum_id":"CCMSLIB00017268971","spectrum_index":29937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 117.8899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.976,"smiles":null,"spectrum_id":"CCMSLIB00017268974","spectrum_index":29938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phlorin (delta mass: 53.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.139,"smiles":null,"spectrum_id":"CCMSLIB00017268976","spectrum_index":29939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-3-Hexen-1-ol (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":111.08,"smiles":null,"spectrum_id":"CCMSLIB00017268978","spectrum_index":29940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 56.0215 Da; putative annotation: N/A; putative formula: C3H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.056,"smiles":null,"spectrum_id":"CCMSLIB00017268981","spectrum_index":29941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 853.4318 Da; putative annotation: N/A; putative formula: C40H63N5O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1034.5,"smiles":null,"spectrum_id":"CCMSLIB00017268983","spectrum_index":29942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 809.4052 Da; putative annotation: N/A; putative formula: C51H51N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.476,"smiles":null,"spectrum_id":"CCMSLIB00017268985","spectrum_index":29943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 69.0131 Da; putative annotation: N/A; putative formula: C3H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.09,"smiles":null,"spectrum_id":"CCMSLIB00017268988","spectrum_index":29944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 631.3352 Da; putative annotation: N/A; putative formula: C47H41N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.406,"smiles":null,"spectrum_id":"CCMSLIB00017268990","spectrum_index":29945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 45.9279 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.978,"smiles":null,"spectrum_id":"CCMSLIB00017268992","spectrum_index":29946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 24.0001 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.076,"smiles":null,"spectrum_id":"CCMSLIB00017268994","spectrum_index":29947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 274.065 Da; putative annotation: N/A; putative formula: C9H15N4O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.13,"smiles":null,"spectrum_id":"CCMSLIB00017268997","spectrum_index":29948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 82.053 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.171,"smiles":null,"spectrum_id":"CCMSLIB00017268999","spectrum_index":29949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 506.1205 Da; putative annotation: N/A; putative formula: C21H23N4O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.181,"smiles":null,"spectrum_id":"CCMSLIB00017269002","spectrum_index":29950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 186.1588 Da; putative annotation: N/A; putative formula: C7H18N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.261,"smiles":null,"spectrum_id":"CCMSLIB00017269004","spectrum_index":29951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 57.0694 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.14,"smiles":null,"spectrum_id":"CCMSLIB00017269006","spectrum_index":29952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 113.0942 Da; putative annotation: N/A; putative formula: C5H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.159,"smiles":null,"spectrum_id":"CCMSLIB00017269009","spectrum_index":29953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 56.0609 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.22,"smiles":null,"spectrum_id":"CCMSLIB00017269010","spectrum_index":29954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 14.0447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017269013","spectrum_index":29955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 2.0196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017269015","spectrum_index":29956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 195.4001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.596,"smiles":null,"spectrum_id":"CCMSLIB00017269017","spectrum_index":29957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 92.0099 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.037,"smiles":null,"spectrum_id":"CCMSLIB00017269020","spectrum_index":29958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-(4-hydroxyphenyl)butyric Acid (delta mass: 46.0205 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.117,"smiles":null,"spectrum_id":"CCMSLIB00017269022","spectrum_index":29959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 18.0172 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.076,"smiles":null,"spectrum_id":"CCMSLIB00017269024","spectrum_index":29960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 237.2069 Da; putative annotation: N/A; putative formula: C11H23N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.278,"smiles":null,"spectrum_id":"CCMSLIB00017269027","spectrum_index":29961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinine (delta mass: 63.0762 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.267,"smiles":null,"spectrum_id":"CCMSLIB00017269029","spectrum_index":29962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 111.0691 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.108,"smiles":null,"spectrum_id":"CCMSLIB00017269032","spectrum_index":29963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005821 3,4,5-Trimethoxycinnamic acid|(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid (delta mass: 162.0511 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.142,"smiles":null,"spectrum_id":"CCMSLIB00017269034","spectrum_index":29964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 208.1223 Da; putative annotation: N/A; putative formula: C11H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.229,"smiles":null,"spectrum_id":"CCMSLIB00017269037","spectrum_index":29965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 162.05 Da; putative annotation: N/A; putative formula: C2H6N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.189,"smiles":null,"spectrum_id":"CCMSLIB00017269039","spectrum_index":29966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 261.1214 Da; putative annotation: N/A; putative formula: C11H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.298,"smiles":null,"spectrum_id":"CCMSLIB00017269042","spectrum_index":29967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 428.2484 Da; putative annotation: N/A; putative formula: C16H36N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.387,"smiles":null,"spectrum_id":"CCMSLIB00017269044","spectrum_index":29968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 196.0801 Da; putative annotation: N/A; putative formula: C14H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.171,"smiles":null,"spectrum_id":"CCMSLIB00017269046","spectrum_index":29969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 261.1015 Da; putative annotation: N/A; putative formula: C15H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.172,"smiles":null,"spectrum_id":"CCMSLIB00017269049","spectrum_index":29970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1161.3513 Da; putative annotation: N/A; putative formula: C36H79N11O15S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1383.45,"smiles":null,"spectrum_id":"CCMSLIB00017269050","spectrum_index":29971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 257.0115 Da; putative annotation: N/A; putative formula: C9H11N3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.06,"smiles":null,"spectrum_id":"CCMSLIB00017269053","spectrum_index":29972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 131.0897 Da; putative annotation: N/A; putative formula: C5H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.149,"smiles":null,"spectrum_id":"CCMSLIB00017269056","spectrum_index":29973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine; AIF; CE10; MS2Dec (delta mass: 25.5225 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.618,"smiles":null,"spectrum_id":"CCMSLIB00017269058","spectrum_index":29974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 60.0289 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.093,"smiles":null,"spectrum_id":"CCMSLIB00017269060","spectrum_index":29975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 258.1463 Da; putative annotation: N/A; putative formula: C13H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.217,"smiles":null,"spectrum_id":"CCMSLIB00017269063","spectrum_index":29976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 126.8305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.922,"smiles":null,"spectrum_id":"CCMSLIB00017269065","spectrum_index":29977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 16.0487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.155,"smiles":null,"spectrum_id":"CCMSLIB00017269068","spectrum_index":29978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 370.1723 Da; putative annotation: N/A; putative formula: C29H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.284,"smiles":null,"spectrum_id":"CCMSLIB00017269069","spectrum_index":29979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 142.2263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.274,"smiles":null,"spectrum_id":"CCMSLIB00017269072","spectrum_index":29980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ambiguine_F_isonitrile (delta mass: 60.0243 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.234,"smiles":null,"spectrum_id":"CCMSLIB00017269075","spectrum_index":29981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 503.1734 Da; putative annotation: N/A; putative formula: C25H33N3O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.42,"smiles":null,"spectrum_id":"CCMSLIB00017269077","spectrum_index":29982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 272.1617 Da; putative annotation: N/A; putative formula: C14H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.222,"smiles":null,"spectrum_id":"CCMSLIB00017269079","spectrum_index":29983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 501.2213 Da; putative annotation: N/A; putative formula: C26H36N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.292,"smiles":null,"spectrum_id":"CCMSLIB00017269082","spectrum_index":29984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 244.9919 Da; putative annotation: N/A; putative formula: C6H3N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.078,"smiles":null,"spectrum_id":"CCMSLIB00017269084","spectrum_index":29985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 193.0944 Da; putative annotation: N/A; putative formula: C7H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.165,"smiles":null,"spectrum_id":"CCMSLIB00017269087","spectrum_index":29986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 385.1355 Da; putative annotation: N/A; putative formula: C14H23N7O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.3,"smiles":null,"spectrum_id":"CCMSLIB00017269089","spectrum_index":29987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 178.2117 Da; putative annotation: N/A; putative formula: C14H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.335,"smiles":null,"spectrum_id":"CCMSLIB00017269091","spectrum_index":29988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 364.6969 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.8,"smiles":null,"spectrum_id":"CCMSLIB00017269094","spectrum_index":29989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 73.0432 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.27,"smiles":null,"spectrum_id":"CCMSLIB00017269097","spectrum_index":29990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA017009 Sotalol|N-[4-[1-hydroxy-2-(isopropylamino)ethyl]phenyl]methanesulfonamide (delta mass: 27.0172 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.144,"smiles":null,"spectrum_id":"CCMSLIB00017269098","spectrum_index":29991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.134,"smiles":null,"spectrum_id":"CCMSLIB00017269101","spectrum_index":29992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 61.0176 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.104,"smiles":null,"spectrum_id":"CCMSLIB00017269103","spectrum_index":29993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 255.2195 Da; putative annotation: N/A; putative formula: C15H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.29,"smiles":null,"spectrum_id":"CCMSLIB00017269106","spectrum_index":29994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 180.0587 Da; putative annotation: N/A; putative formula: C6H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.212,"smiles":null,"spectrum_id":"CCMSLIB00017269107","spectrum_index":29995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:102040\"\" (delta mass: 15.0215 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.118,"smiles":null,"spectrum_id":"CCMSLIB00017269110","spectrum_index":29996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 192.1144 Da; putative annotation: N/A; putative formula: C6H17N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.201,"smiles":null,"spectrum_id":"CCMSLIB00017269113","spectrum_index":29997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 104.1025 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.114,"smiles":null,"spectrum_id":"CCMSLIB00017269114","spectrum_index":29998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 301.2978 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.488,"smiles":null,"spectrum_id":"CCMSLIB00017269117","spectrum_index":29999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 293.1119 Da; putative annotation: N/A; putative formula: C12H23NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.183,"smiles":null,"spectrum_id":"CCMSLIB00017269120","spectrum_index":30000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 110.0429 Da; putative annotation: N/A; putative formula: CH2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.125,"smiles":null,"spectrum_id":"CCMSLIB00017269122","spectrum_index":30001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 199.1917 Da; putative annotation: N/A; putative formula: C8H21N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.232,"smiles":null,"spectrum_id":"CCMSLIB00017269124","spectrum_index":30002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 526.2056 Da; putative annotation: N/A; putative formula: C28H35N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":855.474,"smiles":null,"spectrum_id":"CCMSLIB00017269127","spectrum_index":30003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroluciferin (delta mass: 148.0955 Da; putative annotation: N/A; putative formula: C4H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.085,"smiles":null,"spectrum_id":"CCMSLIB00017269129","spectrum_index":30004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 167.1043 Da; putative annotation: N/A; putative formula: C4H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.191,"smiles":null,"spectrum_id":"CCMSLIB00017269131","spectrum_index":30005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.087,"smiles":null,"spectrum_id":"CCMSLIB00017269133","spectrum_index":30006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.118,"smiles":null,"spectrum_id":"CCMSLIB00017269136","spectrum_index":30007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 170.1454 Da; putative annotation: N/A; putative formula: C14H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017269137","spectrum_index":30008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 102.0249 Da; putative annotation: N/A; putative formula: C3H6N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.095,"smiles":null,"spectrum_id":"CCMSLIB00017269140","spectrum_index":30009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 190.0476 Da; putative annotation: N/A; putative formula: C7H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.129,"smiles":null,"spectrum_id":"CCMSLIB00017269141","spectrum_index":30010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 104.0393 Da; putative annotation: N/A; putative formula: C4H9OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.087,"smiles":null,"spectrum_id":"CCMSLIB00017269144","spectrum_index":30011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 26.0547 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.13,"smiles":null,"spectrum_id":"CCMSLIB00017269146","spectrum_index":30012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 285.1988 Da; putative annotation: N/A; putative formula: C13H27N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.247,"smiles":null,"spectrum_id":"CCMSLIB00017269148","spectrum_index":30013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(1H)-Quinolinone, 3,4-dihydro-4-hydroxy-3-methoxy-4-(4-methoxyphenyl)- (delta mass: 237.2449 Da; putative annotation: N/A; putative formula: C16H31N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.368,"smiles":null,"spectrum_id":"CCMSLIB00017269151","spectrum_index":30014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa - 30.0 eV (delta mass: 98.9985 Da; putative annotation: N/A; putative formula: C2H2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.075,"smiles":null,"spectrum_id":"CCMSLIB00017269154","spectrum_index":30015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 440.2093 Da; putative annotation: N/A; putative formula: C20H32N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.28,"smiles":null,"spectrum_id":"CCMSLIB00017269155","spectrum_index":30016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 28.0831 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.207,"smiles":null,"spectrum_id":"CCMSLIB00017269158","spectrum_index":30017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.06,"smiles":null,"spectrum_id":"CCMSLIB00017269160","spectrum_index":30018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 69.0747 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.163,"smiles":null,"spectrum_id":"CCMSLIB00017269162","spectrum_index":30019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 438.3501 Da; putative annotation: (1R,3aS,9bS,11aR)-7-hydroxy-1-[(2R,4E)-6-hydroxy-6-methylhept-4-en-2-yl]-3a,6,6,9b,11a-pentamethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-4-one; putative formula: C30H46O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1105.58,"smiles":null,"spectrum_id":"CCMSLIB00017269165","spectrum_index":30020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 732.4453 Da; putative annotation: Massbank:PR301882 alpha-Hederin; putative formula: C41H64O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":925.516,"smiles":null,"spectrum_id":"CCMSLIB00017269168","spectrum_index":30021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 131.0401 Da; putative annotation: L-Methionine; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.126,"smiles":null,"spectrum_id":"CCMSLIB00017269170","spectrum_index":30022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 185.1048 Da; putative annotation: Acetyl-L-carnitine; putative formula: C9H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.17,"smiles":null,"spectrum_id":"CCMSLIB00017269173","spectrum_index":30023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 145.0739 Da; putative annotation: 1-Deoxynojirimycin; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.145,"smiles":null,"spectrum_id":"CCMSLIB00017269175","spectrum_index":30024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 129.0427 Da; putative annotation: Spectral Match to L-Glutamic acid from NIST14; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.129,"smiles":null,"spectrum_id":"CCMSLIB00017269178","spectrum_index":30025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 129.0424 Da; putative annotation: Glutamate - 30.00 eV; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.139,"smiles":null,"spectrum_id":"CCMSLIB00017269181","spectrum_index":30026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 457.3905 Da; putative annotation: N/A; putative formula: C26H47N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.523,"smiles":null,"spectrum_id":"CCMSLIB00017269183","spectrum_index":30027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 102.0679 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.117,"smiles":null,"spectrum_id":"CCMSLIB00017269186","spectrum_index":30028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 120.0571 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.102,"smiles":null,"spectrum_id":"CCMSLIB00017269187","spectrum_index":30029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 231.0853 Da; putative annotation: N/A; putative formula: C8H13N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.177,"smiles":null,"spectrum_id":"CCMSLIB00017269190","spectrum_index":30030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006102 Tyramine|4-(2-aminoethyl)phenol (delta mass: 402.3449 Da; putative annotation: N/A; putative formula: C22H46N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.436,"smiles":null,"spectrum_id":"CCMSLIB00017269193","spectrum_index":30031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 186.1006 Da; putative annotation: N/A; putative formula: C9H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.187,"smiles":null,"spectrum_id":"CCMSLIB00017269194","spectrum_index":30032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mycophenolic acid IV (delta mass: 298.2538 Da; putative annotation: N/A; putative formula: C17H35N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.45,"smiles":null,"spectrum_id":"CCMSLIB00017269197","spectrum_index":30033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 14.0047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.092,"smiles":null,"spectrum_id":"CCMSLIB00017269200","spectrum_index":30034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophol (delta mass: 71.0846 Da; putative annotation: N/A; putative formula: C3H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.176,"smiles":null,"spectrum_id":"CCMSLIB00017269202","spectrum_index":30035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-n-benzoyl-2-hydroxy-2-phenylethylamine (delta mass: 58.0266 Da; putative annotation: N/A; putative formula: H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.144,"smiles":null,"spectrum_id":"CCMSLIB00017269204","spectrum_index":30036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 18.1777 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.15,"smiles":null,"spectrum_id":"CCMSLIB00017269207","spectrum_index":30037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 18.0849 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.21,"smiles":null,"spectrum_id":"CCMSLIB00017269210","spectrum_index":30038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 461.152 Da; putative annotation: N/A; putative formula: C23H29NO5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.233,"smiles":null,"spectrum_id":"CCMSLIB00017269211","spectrum_index":30039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 82.161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.248,"smiles":null,"spectrum_id":"CCMSLIB00017269214","spectrum_index":30040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 401.1679 Da; putative annotation: N/A; putative formula: C23H23N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.259,"smiles":null,"spectrum_id":"CCMSLIB00017269217","spectrum_index":30041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pistillarin (delta mass: 132.0419 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.239,"smiles":null,"spectrum_id":"CCMSLIB00017269218","spectrum_index":30042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 188.1167 Da; putative annotation: N/A; putative formula: C8H16N2O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.203,"smiles":null,"spectrum_id":"CCMSLIB00017269221","spectrum_index":30043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300266 Pteropodine (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.208,"smiles":null,"spectrum_id":"CCMSLIB00017269224","spectrum_index":30044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 132.0411 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.143,"smiles":null,"spectrum_id":"CCMSLIB00017269225","spectrum_index":30045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 601.3314 Da; putative annotation: N/A; putative formula: C29H52N3O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.402,"smiles":null,"spectrum_id":"CCMSLIB00017269228","spectrum_index":30046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 42.0113 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.134,"smiles":null,"spectrum_id":"CCMSLIB00017269231","spectrum_index":30047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 309.2587 Da; putative annotation: N/A; putative formula: C19H36NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.35,"smiles":null,"spectrum_id":"CCMSLIB00017269234","spectrum_index":30048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 240.1729 Da; putative annotation: N/A; putative formula: C14H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.27,"smiles":null,"spectrum_id":"CCMSLIB00017269236","spectrum_index":30049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 82.0305 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.169,"smiles":null,"spectrum_id":"CCMSLIB00017269238","spectrum_index":30050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 51.9942 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.096,"smiles":null,"spectrum_id":"CCMSLIB00017269241","spectrum_index":30051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 62.9192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017269243","spectrum_index":30052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 100.0519 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.091,"smiles":null,"spectrum_id":"CCMSLIB00017269245","spectrum_index":30053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 337.2462 Da; putative annotation: N/A; putative formula: C20H37NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.285,"smiles":null,"spectrum_id":"CCMSLIB00017269248","spectrum_index":30054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 228.0832 Da; putative annotation: N/A; putative formula: C11H18OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.169,"smiles":null,"spectrum_id":"CCMSLIB00017269251","spectrum_index":30055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 86.0361 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.086,"smiles":null,"spectrum_id":"CCMSLIB00017269252","spectrum_index":30056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 16.0326 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.15,"smiles":null,"spectrum_id":"CCMSLIB00017269255","spectrum_index":30057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 129.1505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.279,"smiles":null,"spectrum_id":"CCMSLIB00017269257","spectrum_index":30058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 654.3439 Da; putative annotation: N/A; putative formula: C34H54O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":835.415,"smiles":null,"spectrum_id":"CCMSLIB00017269259","spectrum_index":30059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 326.2464 Da; putative annotation: N/A; putative formula: C20H38O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.296,"smiles":null,"spectrum_id":"CCMSLIB00017269262","spectrum_index":30060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 119.0455 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.158,"smiles":null,"spectrum_id":"CCMSLIB00017269263","spectrum_index":30061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 133.0952 Da; putative annotation: N/A; putative formula: C3H11N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.249,"smiles":null,"spectrum_id":"CCMSLIB00017269266","spectrum_index":30062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 605.4707 Da; putative annotation: N/A; putative formula: C42H59N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.566,"smiles":null,"spectrum_id":"CCMSLIB00017269269","spectrum_index":30063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 223.1215 Da; putative annotation: N/A; putative formula: C12H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.202,"smiles":null,"spectrum_id":"CCMSLIB00017269271","spectrum_index":30064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 430.0809 Da; putative annotation: N/A; putative formula: C24H18N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.167,"smiles":null,"spectrum_id":"CCMSLIB00017269273","spectrum_index":30065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 544.2671 Da; putative annotation: N/A; putative formula: C28H28N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.406,"smiles":null,"spectrum_id":"CCMSLIB00017269276","spectrum_index":30066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 610.2993 Da; putative annotation: N/A; putative formula: C36H44N4OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.391,"smiles":null,"spectrum_id":"CCMSLIB00017269278","spectrum_index":30067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 88.0063 Da; putative annotation: N/A; putative formula: C5N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.082,"smiles":null,"spectrum_id":"CCMSLIB00017269281","spectrum_index":30068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311082 Dicoumaroyl Spermidine (delta mass: 177.0505 Da; putative annotation: N/A; putative formula: C3H7N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.289,"smiles":null,"spectrum_id":"CCMSLIB00017269283","spectrum_index":30069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 316.2399 Da; putative annotation: N/A; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.363,"smiles":null,"spectrum_id":"CCMSLIB00017269286","spectrum_index":30070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 312.2449 Da; putative annotation: N/A; putative formula: C22H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.348,"smiles":null,"spectrum_id":"CCMSLIB00017269289","spectrum_index":30071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 461.2473 Da; putative annotation: N/A; putative formula: C24H31N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.318,"smiles":null,"spectrum_id":"CCMSLIB00017269291","spectrum_index":30072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 247.1272 Da; putative annotation: N/A; putative formula: C10H22N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.198,"smiles":null,"spectrum_id":"CCMSLIB00017269293","spectrum_index":30073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 170.0729 Da; putative annotation: N/A; putative formula: C12H10O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.133,"smiles":null,"spectrum_id":"CCMSLIB00017269295","spectrum_index":30074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.138,"smiles":null,"spectrum_id":"CCMSLIB00017269298","spectrum_index":30075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzylpenicillin_20eV (delta mass: 117.079 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.185,"smiles":null,"spectrum_id":"CCMSLIB00017269300","spectrum_index":30076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 127.0629 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.164,"smiles":null,"spectrum_id":"CCMSLIB00017269302","spectrum_index":30077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 135.032 Da; putative annotation: N/A; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.118,"smiles":null,"spectrum_id":"CCMSLIB00017269305","spectrum_index":30078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 12.0139 Da; putative annotation: N/A; putative formula: N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.055,"smiles":null,"spectrum_id":"CCMSLIB00017269308","spectrum_index":30079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 51.996 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.103,"smiles":null,"spectrum_id":"CCMSLIB00017269309","spectrum_index":30080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 41.063 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.149,"smiles":null,"spectrum_id":"CCMSLIB00017269312","spectrum_index":30081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 209.0613 Da; putative annotation: N/A; putative formula: C10H12NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.238,"smiles":null,"spectrum_id":"CCMSLIB00017269315","spectrum_index":30082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 234.0527 Da; putative annotation: N/A; putative formula: C12H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.118,"smiles":null,"spectrum_id":"CCMSLIB00017269317","spectrum_index":30083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 691.6325 Da; putative annotation: N/A; putative formula: C41H81N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":921.728,"smiles":null,"spectrum_id":"CCMSLIB00017269319","spectrum_index":30084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 74.0736 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017269322","spectrum_index":30085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 834.8986 Da; putative annotation: N/A; putative formula: C59H114N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1114.0,"smiles":null,"spectrum_id":"CCMSLIB00017269323","spectrum_index":30086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-HYDANTOIN (delta mass: 86.0018 Da; putative annotation: N/A; putative formula: C4H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.052,"smiles":null,"spectrum_id":"CCMSLIB00017269326","spectrum_index":30087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 231.0372 Da; putative annotation: N/A; putative formula: C12H11NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.124,"smiles":null,"spectrum_id":"CCMSLIB00017269329","spectrum_index":30088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 131.0508 Da; putative annotation: N/A; putative formula: C5H10NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.138,"smiles":null,"spectrum_id":"CCMSLIB00017269330","spectrum_index":30089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 74.0371 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.243,"smiles":null,"spectrum_id":"CCMSLIB00017269333","spectrum_index":30090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 73.0269 Da; putative annotation: N/A; putative formula: CH3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.082,"smiles":null,"spectrum_id":"CCMSLIB00017269336","spectrum_index":30091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 39.0788 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.16,"smiles":null,"spectrum_id":"CCMSLIB00017269337","spectrum_index":30092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 63.9997 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.07,"smiles":null,"spectrum_id":"CCMSLIB00017269340","spectrum_index":30093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 90.0464 Da; putative annotation: N/A; putative formula: CH7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.169,"smiles":null,"spectrum_id":"CCMSLIB00017269343","spectrum_index":30094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 339.1163 Da; putative annotation: N/A; putative formula: C12H21NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.176,"smiles":null,"spectrum_id":"CCMSLIB00017269344","spectrum_index":30095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 45.0206 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.117,"smiles":null,"spectrum_id":"CCMSLIB00017269347","spectrum_index":30096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 66.0474 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.092,"smiles":null,"spectrum_id":"CCMSLIB00017269350","spectrum_index":30097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 129.0575 Da; putative annotation: N/A; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.186,"smiles":null,"spectrum_id":"CCMSLIB00017269352","spectrum_index":30098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 388.2607 Da; putative annotation: N/A; putative formula: C18H37N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.357,"smiles":null,"spectrum_id":"CCMSLIB00017269354","spectrum_index":30099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 383.3546 Da; putative annotation: N/A; putative formula: C27H45N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.425,"smiles":null,"spectrum_id":"CCMSLIB00017269357","spectrum_index":30100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-fluoro-1H-indazole-3-carboxylate (delta mass: 14.0005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.057,"smiles":null,"spectrum_id":"CCMSLIB00017269360","spectrum_index":30101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thelephoric acid (delta mass: 50.0357 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.065,"smiles":null,"spectrum_id":"CCMSLIB00017269361","spectrum_index":30102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 143.1671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.296,"smiles":null,"spectrum_id":"CCMSLIB00017269364","spectrum_index":30103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 217.2046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.312,"smiles":null,"spectrum_id":"CCMSLIB00017269367","spectrum_index":30104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 129.0423 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.155,"smiles":null,"spectrum_id":"CCMSLIB00017269368","spectrum_index":30105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 114.0668 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.174,"smiles":null,"spectrum_id":"CCMSLIB00017269371","spectrum_index":30106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 62.0409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.18,"smiles":null,"spectrum_id":"CCMSLIB00017269373","spectrum_index":30107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 343.3475 Da; putative annotation: N/A; putative formula: C17H41N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.537,"smiles":null,"spectrum_id":"CCMSLIB00017269376","spectrum_index":30108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 53.0629 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017269378","spectrum_index":30109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 114.0681 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.17,"smiles":null,"spectrum_id":"CCMSLIB00017269381","spectrum_index":30110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phlorin (delta mass: 293.061 Da; putative annotation: N/A; putative formula: C17H12NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.153,"smiles":null,"spectrum_id":"CCMSLIB00017269384","spectrum_index":30111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 27.1014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.113,"smiles":null,"spectrum_id":"CCMSLIB00017269386","spectrum_index":30112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 141.0792 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.176,"smiles":null,"spectrum_id":"CCMSLIB00017269388","spectrum_index":30113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-DIHYDROXY-L-PHENYLALANINE - 20.0 eV (delta mass: 114.0079 Da; putative annotation: N/A; putative formula: C4H-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.084,"smiles":null,"spectrum_id":"CCMSLIB00017269391","spectrum_index":30114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 35.0437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.15,"smiles":null,"spectrum_id":"CCMSLIB00017269393","spectrum_index":30115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 669.2984 Da; putative annotation: N/A; putative formula: C37H43N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.369,"smiles":null,"spectrum_id":"CCMSLIB00017269395","spectrum_index":30116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 49.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017269398","spectrum_index":30117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 43.1253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.203,"smiles":null,"spectrum_id":"CCMSLIB00017269400","spectrum_index":30118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 186.0498 Da; putative annotation: N/A; putative formula: C4H6N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.137,"smiles":null,"spectrum_id":"CCMSLIB00017269402","spectrum_index":30119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 83.0466 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017269405","spectrum_index":30120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 443.2293 Da; putative annotation: N/A; putative formula: C22H25N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.3,"smiles":null,"spectrum_id":"CCMSLIB00017269406","spectrum_index":30121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 348.1576 Da; putative annotation: N/A; putative formula: C12H24N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.322,"smiles":null,"spectrum_id":"CCMSLIB00017269409","spectrum_index":30122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 42.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.167,"smiles":null,"spectrum_id":"CCMSLIB00017269412","spectrum_index":30123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 70.0416 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017269414","spectrum_index":30124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 90.072 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.132,"smiles":null,"spectrum_id":"CCMSLIB00017269417","spectrum_index":30125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 96.0062 Da; putative annotation: N/A; putative formula: C2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.108,"smiles":null,"spectrum_id":"CCMSLIB00017269419","spectrum_index":30126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 543.146 Da; putative annotation: N/A; putative formula: C21H29N5O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.187,"smiles":null,"spectrum_id":"CCMSLIB00017269422","spectrum_index":30127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GULONIC ACID GAMA-LACTONE (delta mass: 37.0275 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.093,"smiles":null,"spectrum_id":"CCMSLIB00017269424","spectrum_index":30128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 475.3215 Da; putative annotation: N/A; putative formula: C28H46NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.359,"smiles":null,"spectrum_id":"CCMSLIB00017269427","spectrum_index":30129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 98.0728 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.242,"smiles":null,"spectrum_id":"CCMSLIB00017269429","spectrum_index":30130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 132.1153 Da; putative annotation: N/A; putative formula: C3H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.207,"smiles":null,"spectrum_id":"CCMSLIB00017269431","spectrum_index":30131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 137.1204 Da; putative annotation: N/A; putative formula: C9H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.207,"smiles":null,"spectrum_id":"CCMSLIB00017269434","spectrum_index":30132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 852.456 Da; putative annotation: N/A; putative formula: C48H52N16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1033.53,"smiles":null,"spectrum_id":"CCMSLIB00017269437","spectrum_index":30133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 81.043 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.092,"smiles":null,"spectrum_id":"CCMSLIB00017269438","spectrum_index":30134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP022902 D-Sorbitol|Sorbo|(3S,4S,5R)-hexane-1,2,3,4,5,6-hexol (delta mass: 226.2085 Da; putative annotation: N/A; putative formula: C18H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.295,"smiles":null,"spectrum_id":"CCMSLIB00017269441","spectrum_index":30135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 144.0305 Da; putative annotation: N/A; putative formula: C4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.111,"smiles":null,"spectrum_id":"CCMSLIB00017269444","spectrum_index":30136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-[(3-formamido-2-hydroxybenzoyl)amino]-3-hydroxybutanoate (delta mass: 60.0251 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017269445","spectrum_index":30137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 30.0 eV (delta mass: 14.018 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.088,"smiles":null,"spectrum_id":"CCMSLIB00017269448","spectrum_index":30138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 247.0515 Da; putative annotation: N/A; putative formula: C9H13NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.169,"smiles":null,"spectrum_id":"CCMSLIB00017269451","spectrum_index":30139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 186.0531 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.14,"smiles":null,"spectrum_id":"CCMSLIB00017269453","spectrum_index":30140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydromorphone (delta mass: 113.0384 Da; putative annotation: N/A; putative formula: C7H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.182,"smiles":null,"spectrum_id":"CCMSLIB00017269456","spectrum_index":30141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 333.2872 Da; putative annotation: N/A; putative formula: C22H39NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.347,"smiles":null,"spectrum_id":"CCMSLIB00017269458","spectrum_index":30142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 50.0 eV (delta mass: 225.2513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.349,"smiles":null,"spectrum_id":"CCMSLIB00017269461","spectrum_index":30143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 78.0309 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.117,"smiles":null,"spectrum_id":"CCMSLIB00017269463","spectrum_index":30144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 86.073 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017269466","spectrum_index":30145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 576.9337 Da; putative annotation: N/A; putative formula: C16H11N5O11S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.031,"smiles":null,"spectrum_id":"CCMSLIB00017269469","spectrum_index":30146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 767.2773 Da; putative annotation: N/A; putative formula: C36H45N7O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.328,"smiles":null,"spectrum_id":"CCMSLIB00017269470","spectrum_index":30147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 69.0214 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.097,"smiles":null,"spectrum_id":"CCMSLIB00017269473","spectrum_index":30148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 38.0934 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.18,"smiles":null,"spectrum_id":"CCMSLIB00017269476","spectrum_index":30149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 177.0455 Da; putative annotation: N/A; putative formula: C8H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":844.275,"smiles":null,"spectrum_id":"CCMSLIB00017269478","spectrum_index":30150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 52.0709 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.159,"smiles":null,"spectrum_id":"CCMSLIB00017269481","spectrum_index":30151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 90.0139 Da; putative annotation: N/A; putative formula: C3H6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.105,"smiles":null,"spectrum_id":"CCMSLIB00017269483","spectrum_index":30152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 94.0497 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.111,"smiles":null,"spectrum_id":"CCMSLIB00017269486","spectrum_index":30153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00802 Quinidine (delta mass: 164.0941 Da; putative annotation: N/A; putative formula: C3H13N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.285,"smiles":null,"spectrum_id":"CCMSLIB00017269489","spectrum_index":30154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 305.1479 Da; putative annotation: N/A; putative formula: C16H24N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.219,"smiles":null,"spectrum_id":"CCMSLIB00017269491","spectrum_index":30155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 229.1386 Da; putative annotation: N/A; putative formula: C10H19N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.289,"smiles":null,"spectrum_id":"CCMSLIB00017269494","spectrum_index":30156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 96.1667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.263,"smiles":null,"spectrum_id":"CCMSLIB00017269496","spectrum_index":30157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 63.0676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.253,"smiles":null,"spectrum_id":"CCMSLIB00017269499","spectrum_index":30158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 90.0466 Da; putative annotation: N/A; putative formula: C7H6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.112,"smiles":null,"spectrum_id":"CCMSLIB00017269501","spectrum_index":30159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 55.078 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.201,"smiles":null,"spectrum_id":"CCMSLIB00017269504","spectrum_index":30160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 141.078 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.175,"smiles":null,"spectrum_id":"CCMSLIB00017269507","spectrum_index":30161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 123.0572 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017269509","spectrum_index":30162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 256.1305 Da; putative annotation: N/A; putative formula: C13H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.211,"smiles":null,"spectrum_id":"CCMSLIB00017269512","spectrum_index":30163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 648.2789 Da; putative annotation: N/A; putative formula: C26H44N6O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.35,"smiles":null,"spectrum_id":"CCMSLIB00017269514","spectrum_index":30164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 136.1252 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.237,"smiles":null,"spectrum_id":"CCMSLIB00017269517","spectrum_index":30165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 58.0769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.173,"smiles":null,"spectrum_id":"CCMSLIB00017269520","spectrum_index":30166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 105.0426 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.145,"smiles":null,"spectrum_id":"CCMSLIB00017269522","spectrum_index":30167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 214.1355 Da; putative annotation: N/A; putative formula: C15H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017269525","spectrum_index":30168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 264.2664 Da; putative annotation: N/A; putative formula: C16H32N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.345,"smiles":null,"spectrum_id":"CCMSLIB00017269527","spectrum_index":30169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-2,4-Diaminobutyric acid (delta mass: 154.1359 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.217,"smiles":null,"spectrum_id":"CCMSLIB00017269530","spectrum_index":30170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 207.1109 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.182,"smiles":null,"spectrum_id":"CCMSLIB00017269532","spectrum_index":30171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyquinoline (delta mass: 120.0355 Da; putative annotation: N/A; putative formula: C3H8N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.095,"smiles":null,"spectrum_id":"CCMSLIB00017269535","spectrum_index":30172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 32.0008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.134,"smiles":null,"spectrum_id":"CCMSLIB00017269538","spectrum_index":30173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-serine (delta mass: 11.9998 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.065,"smiles":null,"spectrum_id":"CCMSLIB00017269540","spectrum_index":30174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 299.0482 Da; putative annotation: N/A; putative formula: C13H9N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.124,"smiles":null,"spectrum_id":"CCMSLIB00017269542","spectrum_index":30175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Valine, N-[[1-(5-fluoropentyl)-1H-indazol-3-yl]carbonyl]-, methyl ester (delta mass: 162.0607 Da; putative annotation: N/A; putative formula: C9H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.264,"smiles":null,"spectrum_id":"CCMSLIB00017269545","spectrum_index":30176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of sinomenine (delta mass: 17.0273 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.197,"smiles":null,"spectrum_id":"CCMSLIB00017269546","spectrum_index":30177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 38.0196 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.116,"smiles":null,"spectrum_id":"CCMSLIB00017269549","spectrum_index":30178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 90.026 Da; putative annotation: N/A; putative formula: C2H6N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.103,"smiles":null,"spectrum_id":"CCMSLIB00017269552","spectrum_index":30179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Octopamine from NIST14 (delta mass: 118.0377 Da; putative annotation: N/A; putative formula: C3H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.124,"smiles":null,"spectrum_id":"CCMSLIB00017269554","spectrum_index":30180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 382.1576 Da; putative annotation: N/A; putative formula: C19H22N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.245,"smiles":null,"spectrum_id":"CCMSLIB00017269556","spectrum_index":30181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 296.9399 Da; putative annotation: N/A; putative formula: C11H7NOS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.0,"smiles":null,"spectrum_id":"CCMSLIB00017269559","spectrum_index":30182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 60.0156 Da; putative annotation: N/A; putative formula: CH4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.124,"smiles":null,"spectrum_id":"CCMSLIB00017269561","spectrum_index":30183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 242.0142 Da; putative annotation: (E)-1-Hydroxy-2-methylbut-2-enyl 4-diphosphate; putative formula: C6H12O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.051,"smiles":null,"spectrum_id":"CCMSLIB00017269563","spectrum_index":30184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 312.1728 Da; putative annotation: 4,7,7-trimethylbicyclo[2.2.1]heptan-2-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate; putative formula: C20H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.316,"smiles":null,"spectrum_id":"CCMSLIB00017269566","spectrum_index":30185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxy-2-oxo-1-pyrrolidinyl)acetamide (delta mass: 128.0569 Da; putative annotation: L-(+)-glutamine - 30.0 eV; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.133,"smiles":null,"spectrum_id":"CCMSLIB00017269569","spectrum_index":30186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOSE (delta mass: 161.0691 Da; putative annotation: Galactosamine; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.193,"smiles":null,"spectrum_id":"CCMSLIB00017269570","spectrum_index":30187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 476.1987 Da; putative annotation: (2R,3R,4S,5S,6R)-2-[(3R)-1,7-bis(3,4-dihydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; putative formula: C25H32O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.358,"smiles":null,"spectrum_id":"CCMSLIB00017269573","spectrum_index":30188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 312.2089 Da; putative annotation: 11-Hydroxy-.DELTA.9-tetrahydrocannabinol; putative formula: C21H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.332,"smiles":null,"spectrum_id":"CCMSLIB00017269576","spectrum_index":30189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 79.9531 Da; putative annotation: N/A; putative formula: H3O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.964,"smiles":null,"spectrum_id":"CCMSLIB00017269578","spectrum_index":30190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 259.0675 Da; putative annotation: N/A; putative formula: C7H13N7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.159,"smiles":null,"spectrum_id":"CCMSLIB00017269581","spectrum_index":30191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 152.0624 Da; putative annotation: N/A; putative formula: C12H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.186,"smiles":null,"spectrum_id":"CCMSLIB00017269583","spectrum_index":30192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Subsessiline (delta mass: 137.0774 Da; putative annotation: N/A; putative formula: C8H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.18,"smiles":null,"spectrum_id":"CCMSLIB00017269586","spectrum_index":30193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 98.1086 Da; putative annotation: N/A; putative formula: C7H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.237,"smiles":null,"spectrum_id":"CCMSLIB00017269589","spectrum_index":30194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 329.132 Da; putative annotation: N/A; putative formula: C16H21N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.265,"smiles":null,"spectrum_id":"CCMSLIB00017269591","spectrum_index":30195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 74.0436 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.318,"smiles":null,"spectrum_id":"CCMSLIB00017269593","spectrum_index":30196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU100205 2,2'-(Tetradecylimino)diethanol|Tetradecyldiethanolamine (delta mass: 38.0515 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.357,"smiles":null,"spectrum_id":"CCMSLIB00017269596","spectrum_index":30197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 17.1096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017269598","spectrum_index":30198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 59.074 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.129,"smiles":null,"spectrum_id":"CCMSLIB00017269601","spectrum_index":30199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 76.0677 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.143,"smiles":null,"spectrum_id":"CCMSLIB00017269604","spectrum_index":30200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxyamphetamine (delta mass: 8.9883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.132,"smiles":null,"spectrum_id":"CCMSLIB00017269606","spectrum_index":30201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.112,"smiles":null,"spectrum_id":"CCMSLIB00017269608","spectrum_index":30202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 383.8007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.903,"smiles":null,"spectrum_id":"CCMSLIB00017269611","spectrum_index":30203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 145.9597 Da; putative annotation: N/A; putative formula: C2H-2N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.082,"smiles":null,"spectrum_id":"CCMSLIB00017269614","spectrum_index":30204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 109.0409 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.127,"smiles":null,"spectrum_id":"CCMSLIB00017269617","spectrum_index":30205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 106.041 Da; putative annotation: N/A; putative formula: CH7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.164,"smiles":null,"spectrum_id":"CCMSLIB00017269619","spectrum_index":30206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 98.0371 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.081,"smiles":null,"spectrum_id":"CCMSLIB00017269622","spectrum_index":30207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-exo)-3-[3-Methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octane (delta mass: 60.0351 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017269624","spectrum_index":30208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 103.1239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.19,"smiles":null,"spectrum_id":"CCMSLIB00017269627","spectrum_index":30209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 35.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.112,"smiles":null,"spectrum_id":"CCMSLIB00017269630","spectrum_index":30210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 292.1714 Da; putative annotation: N/A; putative formula: C14H28O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.268,"smiles":null,"spectrum_id":"CCMSLIB00017269632","spectrum_index":30211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 16.0086 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.079,"smiles":null,"spectrum_id":"CCMSLIB00017269634","spectrum_index":30212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; MS2Dec (delta mass: 42.0224 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.082,"smiles":null,"spectrum_id":"CCMSLIB00017269637","spectrum_index":30213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 24.9024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.004,"smiles":null,"spectrum_id":"CCMSLIB00017269640","spectrum_index":30214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 69.0577 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.118,"smiles":null,"spectrum_id":"CCMSLIB00017269642","spectrum_index":30215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 192.0553 Da; putative annotation: N/A; putative formula: C7H13O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.111,"smiles":null,"spectrum_id":"CCMSLIB00017269645","spectrum_index":30216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 876.4839 Da; putative annotation: N/A; putative formula: C56H60N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1207.64,"smiles":null,"spectrum_id":"CCMSLIB00017269647","spectrum_index":30217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 177.0271 Da; putative annotation: N/A; putative formula: C5H7NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.087,"smiles":null,"spectrum_id":"CCMSLIB00017269649","spectrum_index":30218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 145.0014 Da; putative annotation: N/A; putative formula: C4H3NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.135,"smiles":null,"spectrum_id":"CCMSLIB00017269652","spectrum_index":30219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101904 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 9.9842 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.07,"smiles":null,"spectrum_id":"CCMSLIB00017269655","spectrum_index":30220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 154.0244 Da; putative annotation: N/A; putative formula: C11H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.184,"smiles":null,"spectrum_id":"CCMSLIB00017269658","spectrum_index":30221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE-3-ACETIC ACID (delta mass: 97.0294 Da; putative annotation: N/A; putative formula: C3H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.095,"smiles":null,"spectrum_id":"CCMSLIB00017269660","spectrum_index":30222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 284.0261 Da; putative annotation: N/A; putative formula: C22H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.18,"smiles":null,"spectrum_id":"CCMSLIB00017269663","spectrum_index":30223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 100.0467 Da; putative annotation: N/A; putative formula: C4H8N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.129,"smiles":null,"spectrum_id":"CCMSLIB00017269665","spectrum_index":30224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 16.016 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.128,"smiles":null,"spectrum_id":"CCMSLIB00017269668","spectrum_index":30225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Keto-1-methyl-3H-imidazo[4,5-b]pyridin-6-yl)benzamide (delta mass: 16.04 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.143,"smiles":null,"spectrum_id":"CCMSLIB00017269671","spectrum_index":30226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dioxy-creatinine - 40.0 eV (delta mass: 45.0822 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.132,"smiles":null,"spectrum_id":"CCMSLIB00017269673","spectrum_index":30227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 704.2678 Da; putative annotation: N/A; putative formula: C35H44O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.349,"smiles":null,"spectrum_id":"CCMSLIB00017269676","spectrum_index":30228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-6-carboxaldehyde (delta mass: 77.0534 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.113,"smiles":null,"spectrum_id":"CCMSLIB00017269678","spectrum_index":30229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 167.0434 Da; putative annotation: N/A; putative formula: C8H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.103,"smiles":null,"spectrum_id":"CCMSLIB00017269681","spectrum_index":30230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 219.8907 Da; putative annotation: N/A; putative formula: C2H5O2PS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.035,"smiles":null,"spectrum_id":"CCMSLIB00017269683","spectrum_index":30231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1191.5621 Da; putative annotation: N/A; putative formula: C61H73N15O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1354.62,"smiles":null,"spectrum_id":"CCMSLIB00017269686","spectrum_index":30232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 182.0924 Da; putative annotation: N/A; putative formula: C6H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.152,"smiles":null,"spectrum_id":"CCMSLIB00017269688","spectrum_index":30233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE10; MS2Dec (delta mass: 106.0375 Da; putative annotation: N/A; putative formula: C2H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.143,"smiles":null,"spectrum_id":"CCMSLIB00017269691","spectrum_index":30234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine (delta mass: 18.0707 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.178,"smiles":null,"spectrum_id":"CCMSLIB00017269693","spectrum_index":30235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 120.0374 Da; putative annotation: N/A; putative formula: C3H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.182,"smiles":null,"spectrum_id":"CCMSLIB00017269696","spectrum_index":30236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 277.2708 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.541,"smiles":null,"spectrum_id":"CCMSLIB00017269699","spectrum_index":30237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 89.0477 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.102,"smiles":null,"spectrum_id":"CCMSLIB00017269701","spectrum_index":30238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006010 Adenosine|(2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol (delta mass: 140.1059 Da; putative annotation: N/A; putative formula: C6H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.21,"smiles":null,"spectrum_id":"CCMSLIB00017269703","spectrum_index":30239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 172.0696 Da; putative annotation: N/A; putative formula: C4H8N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.171,"smiles":null,"spectrum_id":"CCMSLIB00017269706","spectrum_index":30240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 1249.7624 Da; putative annotation: N/A; putative formula: C55H99N19O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1471.86,"smiles":null,"spectrum_id":"CCMSLIB00017269708","spectrum_index":30241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Acetyloxy)omeprazole (delta mass: 178.0692 Da; putative annotation: N/A; putative formula: C6H15N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.186,"smiles":null,"spectrum_id":"CCMSLIB00017269710","spectrum_index":30242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 115.0271 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.124,"smiles":null,"spectrum_id":"CCMSLIB00017269713","spectrum_index":30243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 58.0422 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.17,"smiles":null,"spectrum_id":"CCMSLIB00017269715","spectrum_index":30244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 130.0658 Da; putative annotation: N/A; putative formula: C5H11N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.145,"smiles":null,"spectrum_id":"CCMSLIB00017269717","spectrum_index":30245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 181.0747 Da; putative annotation: N/A; putative formula: C10H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.155,"smiles":null,"spectrum_id":"CCMSLIB00017269720","spectrum_index":30246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 74.0354 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.168,"smiles":null,"spectrum_id":"CCMSLIB00017269723","spectrum_index":30247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 100.0167 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017269725","spectrum_index":30248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 78.0312 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.237,"smiles":null,"spectrum_id":"CCMSLIB00017269728","spectrum_index":30249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 72.0363 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017269731","spectrum_index":30250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 324.2032 Da; putative annotation: N/A; putative formula: C21H28N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.316,"smiles":null,"spectrum_id":"CCMSLIB00017269733","spectrum_index":30251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7,8-Trimethyl-2-(.beta.-carboxyethyl)-6-hydroxychroman (delta mass: 38.0125 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.156,"smiles":null,"spectrum_id":"CCMSLIB00017269736","spectrum_index":30252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:102040\"\" (delta mass: 88.0526 Da; putative annotation: N/A; putative formula: C4H8O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.17,"smiles":null,"spectrum_id":"CCMSLIB00017269738","spectrum_index":30253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 85.0528 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.144,"smiles":null,"spectrum_id":"CCMSLIB00017269741","spectrum_index":30254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 1.9677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.99,"smiles":null,"spectrum_id":"CCMSLIB00017269743","spectrum_index":30255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 51.0144 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.09,"smiles":null,"spectrum_id":"CCMSLIB00017269746","spectrum_index":30256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 9.9859 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.088,"smiles":null,"spectrum_id":"CCMSLIB00017269748","spectrum_index":30257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 41.9929 Da; putative annotation: N/A; putative formula: C2H2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.115,"smiles":null,"spectrum_id":"CCMSLIB00017269751","spectrum_index":30258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 26.0053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.065,"smiles":null,"spectrum_id":"CCMSLIB00017269752","spectrum_index":30259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 72.0397 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.128,"smiles":null,"spectrum_id":"CCMSLIB00017269755","spectrum_index":30260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 105.0406 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.164,"smiles":null,"spectrum_id":"CCMSLIB00017269758","spectrum_index":30261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 111.0436 Da; putative annotation: N/A; putative formula: C4H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.131,"smiles":null,"spectrum_id":"CCMSLIB00017269759","spectrum_index":30262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 599.2994 Da; putative annotation: N/A; putative formula: C30H46N7PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":744.364,"smiles":null,"spectrum_id":"CCMSLIB00017269762","spectrum_index":30263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 93.0771 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.168,"smiles":null,"spectrum_id":"CCMSLIB00017269765","spectrum_index":30264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 42.045 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.251,"smiles":null,"spectrum_id":"CCMSLIB00017269766","spectrum_index":30265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 34.0054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.195,"smiles":null,"spectrum_id":"CCMSLIB00017269769","spectrum_index":30266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 14.0503 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.162,"smiles":null,"spectrum_id":"CCMSLIB00017269772","spectrum_index":30267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Leu (delta mass: 169.1475 Da; putative annotation: N/A; putative formula: C10H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.318,"smiles":null,"spectrum_id":"CCMSLIB00017269774","spectrum_index":30268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 27.9956 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.051,"smiles":null,"spectrum_id":"CCMSLIB00017269776","spectrum_index":30269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 415.1984 Da; putative annotation: N/A; putative formula: C17H30N5O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.269,"smiles":null,"spectrum_id":"CCMSLIB00017269779","spectrum_index":30270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 513.1666 Da; putative annotation: N/A; putative formula: C25H28N3O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.269,"smiles":null,"spectrum_id":"CCMSLIB00017269782","spectrum_index":30271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 260.2129 Da; putative annotation: N/A; putative formula: C12H29N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.309,"smiles":null,"spectrum_id":"CCMSLIB00017269784","spectrum_index":30272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 129.976 Da; putative annotation: N/A; putative formula: CH-2N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.145,"smiles":null,"spectrum_id":"CCMSLIB00017269786","spectrum_index":30273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 42.0 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.15,"smiles":null,"spectrum_id":"CCMSLIB00017269789","spectrum_index":30274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 188.0799 Da; putative annotation: N/A; putative formula: C7H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.182,"smiles":null,"spectrum_id":"CCMSLIB00017269791","spectrum_index":30275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 128.073 Da; putative annotation: N/A; putative formula: C9H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.212,"smiles":null,"spectrum_id":"CCMSLIB00017269794","spectrum_index":30276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-2,5-Dimethoxyphenethylamine (delta mass: 29.003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.082,"smiles":null,"spectrum_id":"CCMSLIB00017269796","spectrum_index":30277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 58.1507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.232,"smiles":null,"spectrum_id":"CCMSLIB00017269799","spectrum_index":30278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 809.4561 Da; putative annotation: N/A; putative formula: C42H67NO14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1136.58,"smiles":null,"spectrum_id":"CCMSLIB00017269801","spectrum_index":30279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 856.482 Da; putative annotation: N/A; putative formula: C44H72O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1019.54,"smiles":null,"spectrum_id":"CCMSLIB00017269803","spectrum_index":30280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 59.08 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017269806","spectrum_index":30281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxylysine CollisionEnergy:102040 (delta mass: 21.9843 Da; putative annotation: N/A; putative formula: C2H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.092,"smiles":null,"spectrum_id":"CCMSLIB00017269809","spectrum_index":30282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 96.0938 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.299,"smiles":null,"spectrum_id":"CCMSLIB00017269811","spectrum_index":30283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 30.0105 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.081,"smiles":null,"spectrum_id":"CCMSLIB00017269813","spectrum_index":30284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 451.2207 Da; putative annotation: N/A; putative formula: C23H33NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.291,"smiles":null,"spectrum_id":"CCMSLIB00017269816","spectrum_index":30285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 91.0995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.18,"smiles":null,"spectrum_id":"CCMSLIB00017269818","spectrum_index":30286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 487.3139 Da; putative annotation: N/A; putative formula: C25H45NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.385,"smiles":null,"spectrum_id":"CCMSLIB00017269820","spectrum_index":30287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 100.0738 Da; putative annotation: N/A; putative formula: C3H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.165,"smiles":null,"spectrum_id":"CCMSLIB00017269823","spectrum_index":30288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 124.0886 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.232,"smiles":null,"spectrum_id":"CCMSLIB00017269826","spectrum_index":30289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 277.1201 Da; putative annotation: N/A; putative formula: C11H16N7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.211,"smiles":null,"spectrum_id":"CCMSLIB00017269828","spectrum_index":30290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 575.707 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1242.94,"smiles":null,"spectrum_id":"CCMSLIB00017269831","spectrum_index":30291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 78.032 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.228,"smiles":null,"spectrum_id":"CCMSLIB00017269833","spectrum_index":30292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HarmalolHCl2H2O///harmalol///Harmalol CollisionEnergy:205060 (delta mass: 44.9951 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.097,"smiles":null,"spectrum_id":"CCMSLIB00017269836","spectrum_index":30293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 34.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.133,"smiles":null,"spectrum_id":"CCMSLIB00017269839","spectrum_index":30294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-serine (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.061,"smiles":null,"spectrum_id":"CCMSLIB00017269841","spectrum_index":30295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 160.0343 Da; putative annotation: N/A; putative formula: C2H4N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.099,"smiles":null,"spectrum_id":"CCMSLIB00017269844","spectrum_index":30296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 307.2236 Da; putative annotation: N/A; putative formula: C13H25N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.32,"smiles":null,"spectrum_id":"CCMSLIB00017269846","spectrum_index":30297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 773.294 Da; putative annotation: N/A; putative formula: C46H48NO6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":924.354,"smiles":null,"spectrum_id":"CCMSLIB00017269849","spectrum_index":30298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 334.6579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.755,"smiles":null,"spectrum_id":"CCMSLIB00017269851","spectrum_index":30299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.beta.-Homophenylalanine (delta mass: 57.0213 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.123,"smiles":null,"spectrum_id":"CCMSLIB00017269854","spectrum_index":30300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 110.0214 Da; putative annotation: N/A; putative formula: C3H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017269857","spectrum_index":30301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 146.0371 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.124,"smiles":null,"spectrum_id":"CCMSLIB00017269859","spectrum_index":30302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 82.0269 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017269861","spectrum_index":30303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ambiguine_F_isonitrile (delta mass: 100.0553 Da; putative annotation: N/A; putative formula: C4H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.265,"smiles":null,"spectrum_id":"CCMSLIB00017269864","spectrum_index":30304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa (delta mass: 25.0313 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.107,"smiles":null,"spectrum_id":"CCMSLIB00017269867","spectrum_index":30305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 47.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.17,"smiles":null,"spectrum_id":"CCMSLIB00017269869","spectrum_index":30306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 610.3887 Da; putative annotation: N/A; putative formula: C38H50N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.459,"smiles":null,"spectrum_id":"CCMSLIB00017269871","spectrum_index":30307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 211.0679 Da; putative annotation: N/A; putative formula: C3H5N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.18,"smiles":null,"spectrum_id":"CCMSLIB00017269874","spectrum_index":30308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 132.1155 Da; putative annotation: N/A; putative formula: C3H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.202,"smiles":null,"spectrum_id":"CCMSLIB00017269877","spectrum_index":30309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 244.1252 Da; putative annotation: N/A; putative formula: C19H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.279,"smiles":null,"spectrum_id":"CCMSLIB00017269879","spectrum_index":30310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 317.2356 Da; putative annotation: N/A; putative formula: C20H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.306,"smiles":null,"spectrum_id":"CCMSLIB00017269881","spectrum_index":30311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 513.287 Da; putative annotation: N/A; putative formula: C27H40N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.342,"smiles":null,"spectrum_id":"CCMSLIB00017269884","spectrum_index":30312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 138.0837 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017269887","spectrum_index":30313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 115.0633 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.218,"smiles":null,"spectrum_id":"CCMSLIB00017269888","spectrum_index":30314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 246.2348 Da; putative annotation: N/A; putative formula: C18H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.31,"smiles":null,"spectrum_id":"CCMSLIB00017269891","spectrum_index":30315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017269894","spectrum_index":30316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 19.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.129,"smiles":null,"spectrum_id":"CCMSLIB00017269896","spectrum_index":30317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Difluoro-N-[2-(1H-indol-3-yl)ethyl]benzamide (delta mass: 18.0142 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017269899","spectrum_index":30318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 317.199 Da; putative annotation: N/A; putative formula: C19H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.332,"smiles":null,"spectrum_id":"CCMSLIB00017269901","spectrum_index":30319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 53.0366 Da; putative annotation: N/A; putative formula: C2H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017269904","spectrum_index":30320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 190.1792 Da; putative annotation: N/A; putative formula: C4H18N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.227,"smiles":null,"spectrum_id":"CCMSLIB00017269906","spectrum_index":30321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hydroquinidine (delta mass: 15.9906 Da; putative annotation: N/A; putative formula: HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.197,"smiles":null,"spectrum_id":"CCMSLIB00017269909","spectrum_index":30322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 39.0399 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.099,"smiles":null,"spectrum_id":"CCMSLIB00017269911","spectrum_index":30323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 84.0648 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.131,"smiles":null,"spectrum_id":"CCMSLIB00017269914","spectrum_index":30324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 144.0413 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.123,"smiles":null,"spectrum_id":"CCMSLIB00017269916","spectrum_index":30325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Methoxybenzyl)(2-nitrophenyl)methanamine (delta mass: 103.1115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.235,"smiles":null,"spectrum_id":"CCMSLIB00017269918","spectrum_index":30326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 350.0757 Da; putative annotation: N/A; putative formula: C8H14N8O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.199,"smiles":null,"spectrum_id":"CCMSLIB00017269920","spectrum_index":30327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C9:0 (delta mass: 153.0536 Da; putative annotation: N/A; putative formula: C6H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.26,"smiles":null,"spectrum_id":"CCMSLIB00017269923","spectrum_index":30328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 372.194 Da; putative annotation: N/A; putative formula: C22H28O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.291,"smiles":null,"spectrum_id":"CCMSLIB00017269926","spectrum_index":30329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Ile (delta mass: 144.0539 Da; putative annotation: N/A; putative formula: C5H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.224,"smiles":null,"spectrum_id":"CCMSLIB00017269929","spectrum_index":30330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 63.0322 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.103,"smiles":null,"spectrum_id":"CCMSLIB00017269930","spectrum_index":30331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 92.0804 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.14,"smiles":null,"spectrum_id":"CCMSLIB00017269933","spectrum_index":30332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 69.1003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.182,"smiles":null,"spectrum_id":"CCMSLIB00017269936","spectrum_index":30333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(1-Methylindol-5-yl)-3-(3-pyridyl)urea (delta mass: 142.1089 Da; putative annotation: N/A; putative formula: C3H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.233,"smiles":null,"spectrum_id":"CCMSLIB00017269937","spectrum_index":30334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 122.2029 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.3,"smiles":null,"spectrum_id":"CCMSLIB00017269940","spectrum_index":30335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 23.0114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.103,"smiles":null,"spectrum_id":"CCMSLIB00017269943","spectrum_index":30336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 120.0761 Da; putative annotation: N/A; putative formula: C6H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.246,"smiles":null,"spectrum_id":"CCMSLIB00017269946","spectrum_index":30337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 245.5874 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.659,"smiles":null,"spectrum_id":"CCMSLIB00017269947","spectrum_index":30338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 128.0742 Da; putative annotation: N/A; putative formula: C9H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.145,"smiles":null,"spectrum_id":"CCMSLIB00017269950","spectrum_index":30339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 50.059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017269953","spectrum_index":30340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 262.2302 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.337,"smiles":null,"spectrum_id":"CCMSLIB00017269955","spectrum_index":30341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; MS2Dec (delta mass: 254.1339 Da; putative annotation: N/A; putative formula: C6H18N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.24,"smiles":null,"spectrum_id":"CCMSLIB00017269958","spectrum_index":30342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 69.0466 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.113,"smiles":null,"spectrum_id":"CCMSLIB00017269960","spectrum_index":30343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 74.0497 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.141,"smiles":null,"spectrum_id":"CCMSLIB00017269963","spectrum_index":30344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 102.0469 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.133,"smiles":null,"spectrum_id":"CCMSLIB00017269965","spectrum_index":30345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl(3-quinolinyl)methanamine (delta mass: 72.0389 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.146,"smiles":null,"spectrum_id":"CCMSLIB00017269968","spectrum_index":30346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 53.1247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.18,"smiles":null,"spectrum_id":"CCMSLIB00017269970","spectrum_index":30347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 337.1677 Da; putative annotation: N/A; putative formula: C21H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.238,"smiles":null,"spectrum_id":"CCMSLIB00017269973","spectrum_index":30348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-5-phenyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-one (delta mass: 18.0144 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.093,"smiles":null,"spectrum_id":"CCMSLIB00017269975","spectrum_index":30349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 45.0607 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.149,"smiles":null,"spectrum_id":"CCMSLIB00017269978","spectrum_index":30350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.108,"smiles":null,"spectrum_id":"CCMSLIB00017269980","spectrum_index":30351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 430.3812 Da; putative annotation: N/A; putative formula: C29H50O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.458,"smiles":null,"spectrum_id":"CCMSLIB00017269983","spectrum_index":30352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 280.2397 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.363,"smiles":null,"spectrum_id":"CCMSLIB00017269986","spectrum_index":30353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 795.4766 Da; putative annotation: N/A; putative formula: C55H61N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.537,"smiles":null,"spectrum_id":"CCMSLIB00017269988","spectrum_index":30354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 30.0107 Da; putative annotation: N/A; putative formula: CH2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017269991","spectrum_index":30355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 99.0684 Da; putative annotation: 4-Amino-2-methylbutanoic acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.134,"smiles":null,"spectrum_id":"CCMSLIB00017269994","spectrum_index":30356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 230.0945 Da; putative annotation: NCGC00168939-02!8-hydroxy-3-(4-oxopentyl)-3,4-dihydroisochromen-1-one [IIN-based: Match]; putative formula: C14H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.17,"smiles":null,"spectrum_id":"CCMSLIB00017269996","spectrum_index":30357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 143.0714 Da; putative annotation: INDOLE-3-ETHANOL; putative formula: C10H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.153,"smiles":null,"spectrum_id":"CCMSLIB00017269999","spectrum_index":30358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 129.0419 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.133,"smiles":null,"spectrum_id":"CCMSLIB00017270001","spectrum_index":30359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 148.089 Da; putative annotation: (S)-Perillic acid; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017270004","spectrum_index":30360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 119.0734 Da; putative annotation: 2-Amino-1-phenylethanol; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.16,"smiles":null,"spectrum_id":"CCMSLIB00017270007","spectrum_index":30361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 198.1252 Da; putative annotation: Virginiaebutanolide C; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.206,"smiles":null,"spectrum_id":"CCMSLIB00017270008","spectrum_index":30362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 142.1715 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.236,"smiles":null,"spectrum_id":"CCMSLIB00017270011","spectrum_index":30363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 159.0359 Da; putative annotation: N/A; putative formula: C6H9NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.112,"smiles":null,"spectrum_id":"CCMSLIB00017270014","spectrum_index":30364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 172.1613 Da; putative annotation: N/A; putative formula: C14H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.242,"smiles":null,"spectrum_id":"CCMSLIB00017270015","spectrum_index":30365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 99.0688 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.16,"smiles":null,"spectrum_id":"CCMSLIB00017270018","spectrum_index":30366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017270021","spectrum_index":30367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ACETAMIDE - 20.0 eV (delta mass: 84.0783 Da; putative annotation: N/A; putative formula: C3H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017270022","spectrum_index":30368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of lysergol (delta mass: 290.1627 Da; putative annotation: N/A; putative formula: C16H22N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.312,"smiles":null,"spectrum_id":"CCMSLIB00017270025","spectrum_index":30369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Mannitol from NIST14 (delta mass: 186.0903 Da; putative annotation: N/A; putative formula: C10H18O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.177,"smiles":null,"spectrum_id":"CCMSLIB00017270027","spectrum_index":30370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-hydroxypyrene (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.091,"smiles":null,"spectrum_id":"CCMSLIB00017270030","spectrum_index":30371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 138.0681 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.17,"smiles":null,"spectrum_id":"CCMSLIB00017270033","spectrum_index":30372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 170.1099 Da; putative annotation: N/A; putative formula: C13H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.181,"smiles":null,"spectrum_id":"CCMSLIB00017270036","spectrum_index":30373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 223.1573 Da; putative annotation: N/A; putative formula: C13H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.426,"smiles":null,"spectrum_id":"CCMSLIB00017270038","spectrum_index":30374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatinine (delta mass: 326.2457 Da; putative annotation: N/A; putative formula: C19H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.312,"smiles":null,"spectrum_id":"CCMSLIB00017270040","spectrum_index":30375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 762.4184 Da; putative annotation: N/A; putative formula: C54H54N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.489,"smiles":null,"spectrum_id":"CCMSLIB00017270043","spectrum_index":30376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 835.4715 Da; putative annotation: N/A; putative formula: C57H61N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1016.54,"smiles":null,"spectrum_id":"CCMSLIB00017270046","spectrum_index":30377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Peniprequinolone (delta mass: 12.0037 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.184,"smiles":null,"spectrum_id":"CCMSLIB00017270048","spectrum_index":30378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 966.5168 Da; putative annotation: N/A; putative formula: C46H84N2O13P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1147.59,"smiles":null,"spectrum_id":"CCMSLIB00017270051","spectrum_index":30379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 99.2545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.5,"smiles":null,"spectrum_id":"CCMSLIB00017270053","spectrum_index":30380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 298.0468 Da; putative annotation: N/A; putative formula: C10H11N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.112,"smiles":null,"spectrum_id":"CCMSLIB00017270056","spectrum_index":30381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 249.199 Da; putative annotation: N/A; putative formula: C16H28NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.258,"smiles":null,"spectrum_id":"CCMSLIB00017270058","spectrum_index":30382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 99.0695 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.177,"smiles":null,"spectrum_id":"CCMSLIB00017270061","spectrum_index":30383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 208.0944 Da; putative annotation: N/A; putative formula: C8H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.165,"smiles":null,"spectrum_id":"CCMSLIB00017270064","spectrum_index":30384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 75.0318 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.086,"smiles":null,"spectrum_id":"CCMSLIB00017270066","spectrum_index":30385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 55.0714 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.143,"smiles":null,"spectrum_id":"CCMSLIB00017270069","spectrum_index":30386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gln (delta mass: 129.042 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.161,"smiles":null,"spectrum_id":"CCMSLIB00017270071","spectrum_index":30387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 817.4534 Da; putative annotation: N/A; putative formula: C34H67N5O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":951.513,"smiles":null,"spectrum_id":"CCMSLIB00017270074","spectrum_index":30388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 73.9149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.952,"smiles":null,"spectrum_id":"CCMSLIB00017270077","spectrum_index":30389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nordeprenyl (delta mass: 28.6623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.79,"smiles":null,"spectrum_id":"CCMSLIB00017270079","spectrum_index":30390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 276.1897 Da; putative annotation: N/A; putative formula: C12H29N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.302,"smiles":null,"spectrum_id":"CCMSLIB00017270082","spectrum_index":30391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-phenyl-1-(2,4,6-trihydroxyphenyl)nonan-1-one (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.211,"smiles":null,"spectrum_id":"CCMSLIB00017270085","spectrum_index":30392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 38.0518 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.174,"smiles":null,"spectrum_id":"CCMSLIB00017270086","spectrum_index":30393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 78.0835 Da; putative annotation: N/A; putative formula: C7H10O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.144,"smiles":null,"spectrum_id":"CCMSLIB00017270089","spectrum_index":30394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 55.0415 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.159,"smiles":null,"spectrum_id":"CCMSLIB00017270092","spectrum_index":30395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 101.0629 Da; putative annotation: N/A; putative formula: C8H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.149,"smiles":null,"spectrum_id":"CCMSLIB00017270093","spectrum_index":30396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 29.0361 Da; putative annotation: N/A; putative formula: H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.122,"smiles":null,"spectrum_id":"CCMSLIB00017270096","spectrum_index":30397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 122.0733 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017270099","spectrum_index":30398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 84.0206 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.118,"smiles":null,"spectrum_id":"CCMSLIB00017270101","spectrum_index":30399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 230.1533 Da; putative annotation: N/A; putative formula: C13H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.26,"smiles":null,"spectrum_id":"CCMSLIB00017270103","spectrum_index":30400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 71.1973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.336,"smiles":null,"spectrum_id":"CCMSLIB00017270106","spectrum_index":30401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methylquinolin-4-amine (delta mass: 4.4083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017270107","spectrum_index":30402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylquinolin-4-amine (delta mass: 4.4083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017270110","spectrum_index":30403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 255.2237 Da; putative annotation: N/A; putative formula: C14H30N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.31,"smiles":null,"spectrum_id":"CCMSLIB00017270113","spectrum_index":30404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 120.0436 Da; putative annotation: N/A; putative formula: C5H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.193,"smiles":null,"spectrum_id":"CCMSLIB00017270115","spectrum_index":30405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 152.0688 Da; putative annotation: N/A; putative formula: C6H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.171,"smiles":null,"spectrum_id":"CCMSLIB00017270117","spectrum_index":30406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Debromohymenialdisine (delta mass: 17.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.146,"smiles":null,"spectrum_id":"CCMSLIB00017270120","spectrum_index":30407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 178.2142 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.394,"smiles":null,"spectrum_id":"CCMSLIB00017270123","spectrum_index":30408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cassythicine (delta mass: 378.9435 Da; putative annotation: N/A; putative formula: C6H9N3O10S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.082,"smiles":null,"spectrum_id":"CCMSLIB00017270125","spectrum_index":30409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 579.5379 Da; putative annotation: N/A; putative formula: C40H69NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.609,"smiles":null,"spectrum_id":"CCMSLIB00017270127","spectrum_index":30410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 46.0106 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.083,"smiles":null,"spectrum_id":"CCMSLIB00017270130","spectrum_index":30411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000501 5-methoxyindole-3-carbaldehyde (delta mass: 42.0469 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.117,"smiles":null,"spectrum_id":"CCMSLIB00017270132","spectrum_index":30412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 445.3771 Da; putative annotation: N/A; putative formula: C25H51NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.448,"smiles":null,"spectrum_id":"CCMSLIB00017270134","spectrum_index":30413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 120.0555 Da; putative annotation: N/A; putative formula: C4H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.184,"smiles":null,"spectrum_id":"CCMSLIB00017270137","spectrum_index":30414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1065.7961 Da; putative annotation: N/A; putative formula: C34H18O24S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1287.89,"smiles":null,"spectrum_id":"CCMSLIB00017270139","spectrum_index":30415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 44.0514 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.138,"smiles":null,"spectrum_id":"CCMSLIB00017270141","spectrum_index":30416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 63.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.165,"smiles":null,"spectrum_id":"CCMSLIB00017270144","spectrum_index":30417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 158.142 Da; putative annotation: N/A; putative formula: C8H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.265,"smiles":null,"spectrum_id":"CCMSLIB00017270146","spectrum_index":30418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 1017.7547 Da; putative annotation: N/A; putative formula: C63H104NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1206.9,"smiles":null,"spectrum_id":"CCMSLIB00017270149","spectrum_index":30419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 299.1028 Da; putative annotation: N/A; putative formula: C15H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.173,"smiles":null,"spectrum_id":"CCMSLIB00017270151","spectrum_index":30420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 168.0598 Da; putative annotation: N/A; putative formula: C9H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.108,"smiles":null,"spectrum_id":"CCMSLIB00017270153","spectrum_index":30421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Arsanilic acid (delta mass: 89.023 Da; putative annotation: N/A; putative formula: CH3N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.002,"smiles":null,"spectrum_id":"CCMSLIB00017270156","spectrum_index":30422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 380.9787 Da; putative annotation: N/A; putative formula: C7H14NO11P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.046,"smiles":null,"spectrum_id":"CCMSLIB00017270159","spectrum_index":30423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 28.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.216,"smiles":null,"spectrum_id":"CCMSLIB00017270161","spectrum_index":30424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 98.0521 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017270164","spectrum_index":30425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 57.081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.272,"smiles":null,"spectrum_id":"CCMSLIB00017270167","spectrum_index":30426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 396.1246 Da; putative annotation: N/A; putative formula: C19H24O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.185,"smiles":null,"spectrum_id":"CCMSLIB00017270168","spectrum_index":30427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 100.0744 Da; putative annotation: N/A; putative formula: C3H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.17,"smiles":null,"spectrum_id":"CCMSLIB00017270171","spectrum_index":30428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 100.019 Da; putative annotation: N/A; putative formula: C3H5N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.095,"smiles":null,"spectrum_id":"CCMSLIB00017270174","spectrum_index":30429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 25.009 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.076,"smiles":null,"spectrum_id":"CCMSLIB00017270177","spectrum_index":30430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 54.1003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.15,"smiles":null,"spectrum_id":"CCMSLIB00017270178","spectrum_index":30431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 36.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.139,"smiles":null,"spectrum_id":"CCMSLIB00017270181","spectrum_index":30432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 213.1982 Da; putative annotation: N/A; putative formula: C13H28NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.295,"smiles":null,"spectrum_id":"CCMSLIB00017270184","spectrum_index":30433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 116.0982 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.153,"smiles":null,"spectrum_id":"CCMSLIB00017270187","spectrum_index":30434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 665.2353 Da; putative annotation: N/A; putative formula: C49H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.306,"smiles":null,"spectrum_id":"CCMSLIB00017270189","spectrum_index":30435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 167.0948 Da; putative annotation: N/A; putative formula: C9H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.16,"smiles":null,"spectrum_id":"CCMSLIB00017270191","spectrum_index":30436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2-methoxybenzaldehyde (delta mass: 225.101 Da; putative annotation: N/A; putative formula: C12H19NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.156,"smiles":null,"spectrum_id":"CCMSLIB00017270194","spectrum_index":30437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 176.0798 Da; putative annotation: N/A; putative formula: C6H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.13,"smiles":null,"spectrum_id":"CCMSLIB00017270196","spectrum_index":30438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 73.0512 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.19,"smiles":null,"spectrum_id":"CCMSLIB00017270198","spectrum_index":30439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoyl)-6,7-dimethoxy-N-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide (delta mass: 44.0195 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.243,"smiles":null,"spectrum_id":"CCMSLIB00017270201","spectrum_index":30440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 284.1053 Da; putative annotation: N/A; putative formula: C17H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.181,"smiles":null,"spectrum_id":"CCMSLIB00017270204","spectrum_index":30441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 127.027 Da; putative annotation: N/A; putative formula: C5H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.087,"smiles":null,"spectrum_id":"CCMSLIB00017270206","spectrum_index":30442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 58.0033 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.1,"smiles":null,"spectrum_id":"CCMSLIB00017270208","spectrum_index":30443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 352.1018 Da; putative annotation: N/A; putative formula: C14H16N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.172,"smiles":null,"spectrum_id":"CCMSLIB00017270211","spectrum_index":30444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 146.0581 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.186,"smiles":null,"spectrum_id":"CCMSLIB00017270213","spectrum_index":30445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Paxitriol (delta mass: 114.0279 Da; putative annotation: N/A; putative formula: CH2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.292,"smiles":null,"spectrum_id":"CCMSLIB00017270215","spectrum_index":30446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 157.3038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.384,"smiles":null,"spectrum_id":"CCMSLIB00017270218","spectrum_index":30447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 64.0662 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.199,"smiles":null,"spectrum_id":"CCMSLIB00017270221","spectrum_index":30448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 15.9497 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":126.021,"smiles":null,"spectrum_id":"CCMSLIB00017270223","spectrum_index":30449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.185,"smiles":null,"spectrum_id":"CCMSLIB00017270225","spectrum_index":30450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 345.2882 Da; putative annotation: N/A; putative formula: C19H39NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.375,"smiles":null,"spectrum_id":"CCMSLIB00017270228","spectrum_index":30451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 209.0092 Da; putative annotation: N/A; putative formula: C5H8NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.095,"smiles":null,"spectrum_id":"CCMSLIB00017270231","spectrum_index":30452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 235.1056 Da; putative annotation: N/A; putative formula: C9H17NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.186,"smiles":null,"spectrum_id":"CCMSLIB00017270233","spectrum_index":30453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NALOXONE (delta mass: 290.1379 Da; putative annotation: N/A; putative formula: C14H18N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.292,"smiles":null,"spectrum_id":"CCMSLIB00017270236","spectrum_index":30454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 84.0211 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.092,"smiles":null,"spectrum_id":"CCMSLIB00017270239","spectrum_index":30455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 57.0059 Da; putative annotation: N/A; putative formula: C2H3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.054,"smiles":null,"spectrum_id":"CCMSLIB00017270241","spectrum_index":30456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; CorrDec (delta mass: 44.0253 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":130.085,"smiles":null,"spectrum_id":"CCMSLIB00017270243","spectrum_index":30457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 437.2564 Da; putative annotation: N/A; putative formula: C27H35NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.405,"smiles":null,"spectrum_id":"CCMSLIB00017270246","spectrum_index":30458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(5-Chloro-1H-indol-3-yl)acetic acid (delta mass: 60.0295 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.061,"smiles":null,"spectrum_id":"CCMSLIB00017270249","spectrum_index":30459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3-Hydroxycotinine (delta mass: 47.0238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.121,"smiles":null,"spectrum_id":"CCMSLIB00017270251","spectrum_index":30460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 521.2054 Da; putative annotation: N/A; putative formula: C21H37N3O8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.276,"smiles":null,"spectrum_id":"CCMSLIB00017270253","spectrum_index":30461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 125.0478 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.155,"smiles":null,"spectrum_id":"CCMSLIB00017270256","spectrum_index":30462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 80.9883 Da; putative annotation: N/A; putative formula: C2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.08,"smiles":null,"spectrum_id":"CCMSLIB00017270258","spectrum_index":30463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 128.0834 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.206,"smiles":null,"spectrum_id":"CCMSLIB00017270260","spectrum_index":30464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 118.0783 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.227,"smiles":null,"spectrum_id":"CCMSLIB00017270263","spectrum_index":30465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 7.9686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.07,"smiles":null,"spectrum_id":"CCMSLIB00017270265","spectrum_index":30466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 60.1111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.122,"smiles":null,"spectrum_id":"CCMSLIB00017270267","spectrum_index":30467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 106.0735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.149,"smiles":null,"spectrum_id":"CCMSLIB00017270270","spectrum_index":30468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 23.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.139,"smiles":null,"spectrum_id":"CCMSLIB00017270272","spectrum_index":30469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 74.073 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.159,"smiles":null,"spectrum_id":"CCMSLIB00017270274","spectrum_index":30470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 440.3457 Da; putative annotation: N/A; putative formula: C18H40N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.437,"smiles":null,"spectrum_id":"CCMSLIB00017270277","spectrum_index":30471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 395.1762 Da; putative annotation: N/A; putative formula: C22H26N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.247,"smiles":null,"spectrum_id":"CCMSLIB00017270280","spectrum_index":30472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 211.0361 Da; putative annotation: N/A; putative formula: C4H10N3O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.133,"smiles":null,"spectrum_id":"CCMSLIB00017270282","spectrum_index":30473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 197.0846 Da; putative annotation: N/A; putative formula: C6H11N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.155,"smiles":null,"spectrum_id":"CCMSLIB00017270284","spectrum_index":30474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.064,"smiles":null,"spectrum_id":"CCMSLIB00017270287","spectrum_index":30475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.203,"smiles":null,"spectrum_id":"CCMSLIB00017270289","spectrum_index":30476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 130.0345 Da; putative annotation: N/A; putative formula: H2N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.077,"smiles":null,"spectrum_id":"CCMSLIB00017270291","spectrum_index":30477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 227.1519 Da; putative annotation: N/A; putative formula: C12H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.223,"smiles":null,"spectrum_id":"CCMSLIB00017270294","spectrum_index":30478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 132.0212 Da; putative annotation: N/A; putative formula: C8H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.211,"smiles":null,"spectrum_id":"CCMSLIB00017270297","spectrum_index":30479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 156.042 Da; putative annotation: N/A; putative formula: C7H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.134,"smiles":null,"spectrum_id":"CCMSLIB00017270299","spectrum_index":30480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 136.0759 Da; putative annotation: N/A; putative formula: C6H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017270301","spectrum_index":30481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 149.1057 Da; putative annotation: N/A; putative formula: C7H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.275,"smiles":null,"spectrum_id":"CCMSLIB00017270304","spectrum_index":30482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 60.0 eV (delta mass: 203.0437 Da; putative annotation: N/A; putative formula: C8H13NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.13,"smiles":null,"spectrum_id":"CCMSLIB00017270306","spectrum_index":30483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.186,"smiles":null,"spectrum_id":"CCMSLIB00017270308","spectrum_index":30484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 633.4651 Da; putative annotation: N/A; putative formula: C43H59N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.578,"smiles":null,"spectrum_id":"CCMSLIB00017270311","spectrum_index":30485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 372.2644 Da; putative annotation: N/A; putative formula: C20H32N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.372,"smiles":null,"spectrum_id":"CCMSLIB00017270314","spectrum_index":30486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 392.2353 Da; putative annotation: N/A; putative formula: C26H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.295,"smiles":null,"spectrum_id":"CCMSLIB00017270316","spectrum_index":30487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 58.0178 Da; putative annotation: N/A; putative formula: CH2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.193,"smiles":null,"spectrum_id":"CCMSLIB00017270318","spectrum_index":30488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 75.032 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.123,"smiles":null,"spectrum_id":"CCMSLIB00017270321","spectrum_index":30489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 241.0325 Da; putative annotation: N/A; putative formula: C10H12NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.103,"smiles":null,"spectrum_id":"CCMSLIB00017270324","spectrum_index":30490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 156.1334 Da; putative annotation: N/A; putative formula: C10H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.283,"smiles":null,"spectrum_id":"CCMSLIB00017270325","spectrum_index":30491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017270328","spectrum_index":30492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 862.1122 Da; putative annotation: N/A; putative formula: C28H33N8O18P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1084.21,"smiles":null,"spectrum_id":"CCMSLIB00017270331","spectrum_index":30493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 102.0835 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.358,"smiles":null,"spectrum_id":"CCMSLIB00017270333","spectrum_index":30494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 122.108 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.335,"smiles":null,"spectrum_id":"CCMSLIB00017270335","spectrum_index":30495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 420.0523 Da; putative annotation: N/A; putative formula: C20H20O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.139,"smiles":null,"spectrum_id":"CCMSLIB00017270338","spectrum_index":30496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 372.701 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.761,"smiles":null,"spectrum_id":"CCMSLIB00017270340","spectrum_index":30497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 294.1621 Da; putative annotation: N/A; putative formula: C20H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.242,"smiles":null,"spectrum_id":"CCMSLIB00017270342","spectrum_index":30498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 28.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017270345","spectrum_index":30499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 116.0137 Da; putative annotation: N/A; putative formula: C3H5N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.1,"smiles":null,"spectrum_id":"CCMSLIB00017270348","spectrum_index":30500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 309.302 Da; putative annotation: N/A; putative formula: C20H39NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.373,"smiles":null,"spectrum_id":"CCMSLIB00017270350","spectrum_index":30501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 108.0935 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.19,"smiles":null,"spectrum_id":"CCMSLIB00017270352","spectrum_index":30502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 211.0727 Da; putative annotation: N/A; putative formula: C5H14N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.222,"smiles":null,"spectrum_id":"CCMSLIB00017270355","spectrum_index":30503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 105.0579 Da; putative annotation: N/A; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.181,"smiles":null,"spectrum_id":"CCMSLIB00017270357","spectrum_index":30504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 45.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.222,"smiles":null,"spectrum_id":"CCMSLIB00017270360","spectrum_index":30505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 120.0486 Da; putative annotation: N/A; putative formula: C8H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.146,"smiles":null,"spectrum_id":"CCMSLIB00017270362","spectrum_index":30506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 27.0549 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.131,"smiles":null,"spectrum_id":"CCMSLIB00017270365","spectrum_index":30507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 39.4137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017270367","spectrum_index":30508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-MANNOSAMINE (delta mass: 38.0169 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.104,"smiles":null,"spectrum_id":"CCMSLIB00017270370","spectrum_index":30509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP016601 Indolacetic acid|indole-3-acetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 280.0648 Da; putative annotation: N/A; putative formula: C9H17N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.135,"smiles":null,"spectrum_id":"CCMSLIB00017270372","spectrum_index":30510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 208.1714 Da; putative annotation: N/A; putative formula: CH16N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017270375","spectrum_index":30511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.103,"smiles":null,"spectrum_id":"CCMSLIB00017270377","spectrum_index":30512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 104.0259 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.107,"smiles":null,"spectrum_id":"CCMSLIB00017270379","spectrum_index":30513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 359.1806 Da; putative annotation: N/A; putative formula: C14H25N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.283,"smiles":null,"spectrum_id":"CCMSLIB00017270382","spectrum_index":30514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 162.0683 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.128,"smiles":null,"spectrum_id":"CCMSLIB00017270385","spectrum_index":30515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 350.1735 Da; putative annotation: N/A; putative formula: C12H26N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.234,"smiles":null,"spectrum_id":"CCMSLIB00017270387","spectrum_index":30516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 60.0115 Da; putative annotation: N/A; putative formula: C4N2O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.082,"smiles":null,"spectrum_id":"CCMSLIB00017270389","spectrum_index":30517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(+)-4-Amino-3-hydroxybutyric acid (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.092,"smiles":null,"spectrum_id":"CCMSLIB00017270392","spectrum_index":30518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 292.0624 Da; putative annotation: Spectral Match to Sulfadimethoxine from NIST14; putative formula: C12H12N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.186,"smiles":null,"spectrum_id":"CCMSLIB00017270394","spectrum_index":30519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 108.0212 Da; putative annotation: 1,3,5-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017270396","spectrum_index":30520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Prolylphenylalanine (delta mass: 225.1117 Da; putative annotation: Pro-Gln; putative formula: C10H15N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.251,"smiles":null,"spectrum_id":"CCMSLIB00017270399","spectrum_index":30521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 134.0727 Da; putative annotation: 4-Hydroxynonenal alkyne; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.148,"smiles":null,"spectrum_id":"CCMSLIB00017270401","spectrum_index":30522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 135.078 Da; putative annotation: 2-Amino-6-propyl-1H-pyrimidin-4-one; putative formula: C7H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.128,"smiles":null,"spectrum_id":"CCMSLIB00017270403","spectrum_index":30523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 318.2248 Da; putative annotation: 14-hydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.0,?.0?,?]hexadecane-5-carboxylic acid; putative formula: C20H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.29,"smiles":null,"spectrum_id":"CCMSLIB00017270406","spectrum_index":30524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 318.0823 Da; putative annotation: NCGC00180823-02!(3R,4R,5R)-5-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4-dihydroxycyclohexene-1-carboxylic acid; putative formula: C16H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.123,"smiles":null,"spectrum_id":"CCMSLIB00017270408","spectrum_index":30525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 183.0701 Da; putative annotation: Carbaryl; putative formula: C12H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.13,"smiles":null,"spectrum_id":"CCMSLIB00017270410","spectrum_index":30526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 178.063 Da; putative annotation: 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.102,"smiles":null,"spectrum_id":"CCMSLIB00017270413","spectrum_index":30527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 86.0547 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.15,"smiles":null,"spectrum_id":"CCMSLIB00017270416","spectrum_index":30528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenoxy-N-(2-pyridinylmethyl)benzamide (delta mass: 81.057 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.185,"smiles":null,"spectrum_id":"CCMSLIB00017270417","spectrum_index":30529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 590.3388 Da; putative annotation: N/A; putative formula: C22H34N22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.452,"smiles":null,"spectrum_id":"CCMSLIB00017270420","spectrum_index":30530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 101.0478 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.145,"smiles":null,"spectrum_id":"CCMSLIB00017270423","spectrum_index":30531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 615.2361 Da; putative annotation: N/A; putative formula: C21H33N11O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.307,"smiles":null,"spectrum_id":"CCMSLIB00017270425","spectrum_index":30532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 128.0506 Da; putative annotation: N/A; putative formula: C5H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.19,"smiles":null,"spectrum_id":"CCMSLIB00017270427","spectrum_index":30533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Amino-2-methylpropyl)urea (delta mass: 57.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.15,"smiles":null,"spectrum_id":"CCMSLIB00017270429","spectrum_index":30534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 203.1524 Da; putative annotation: N/A; putative formula: C10H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.275,"smiles":null,"spectrum_id":"CCMSLIB00017270432","spectrum_index":30535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 62.0514 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017270434","spectrum_index":30536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-crinamine (delta mass: 18.0913 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.23,"smiles":null,"spectrum_id":"CCMSLIB00017270436","spectrum_index":30537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltotriose from NIST14 (delta mass: 67.0793 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.256,"smiles":null,"spectrum_id":"CCMSLIB00017270439","spectrum_index":30538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 672.4424 Da; putative annotation: N/A; putative formula: C40H64O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.513,"smiles":null,"spectrum_id":"CCMSLIB00017270442","spectrum_index":30539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 239.2438 Da; putative annotation: N/A; putative formula: C13H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.326,"smiles":null,"spectrum_id":"CCMSLIB00017270443","spectrum_index":30540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 615.1608 Da; putative annotation: N/A; putative formula: C31H29N5O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.221,"smiles":null,"spectrum_id":"CCMSLIB00017270446","spectrum_index":30541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 147.0659 Da; putative annotation: N/A; putative formula: C5H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.171,"smiles":null,"spectrum_id":"CCMSLIB00017270449","spectrum_index":30542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 74.0004 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.087,"smiles":null,"spectrum_id":"CCMSLIB00017270451","spectrum_index":30543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hernagine (delta mass: 3.3457 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.5,"smiles":null,"spectrum_id":"CCMSLIB00017270453","spectrum_index":30544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 161.0556 Da; putative annotation: N/A; putative formula: C4H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.12,"smiles":null,"spectrum_id":"CCMSLIB00017270456","spectrum_index":30545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 45.9643 Da; putative annotation: N/A; putative formula: H-1OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017270458","spectrum_index":30546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 497.2486 Da; putative annotation: N/A; putative formula: C22H35N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.34,"smiles":null,"spectrum_id":"CCMSLIB00017270460","spectrum_index":30547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 178.2085 Da; putative annotation: N/A; putative formula: C14H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.29,"smiles":null,"spectrum_id":"CCMSLIB00017270463","spectrum_index":30548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 46.9794 Da; putative annotation: N/A; putative formula: HNS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.118,"smiles":null,"spectrum_id":"CCMSLIB00017270466","spectrum_index":30549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 533.2258 Da; putative annotation: N/A; putative formula: C25H31N11O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.312,"smiles":null,"spectrum_id":"CCMSLIB00017270468","spectrum_index":30550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 46.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017270471","spectrum_index":30551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 60.0304 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.169,"smiles":null,"spectrum_id":"CCMSLIB00017270473","spectrum_index":30552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 14.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.149,"smiles":null,"spectrum_id":"CCMSLIB00017270476","spectrum_index":30553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 552.203 Da; putative annotation: N/A; putative formula: C27H36O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.284,"smiles":null,"spectrum_id":"CCMSLIB00017270479","spectrum_index":30554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU132801 Biotin|5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid (delta mass: 848.3448 Da; putative annotation: N/A; putative formula: C52H40N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1093.44,"smiles":null,"spectrum_id":"CCMSLIB00017270482","spectrum_index":30555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 1004.2847 Da; putative annotation: N/A; putative formula: C39H56O30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1185.36,"smiles":null,"spectrum_id":"CCMSLIB00017270484","spectrum_index":30556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 330.0948 Da; putative annotation: N/A; putative formula: C14H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.165,"smiles":null,"spectrum_id":"CCMSLIB00017270487","spectrum_index":30557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 101.0598 Da; putative annotation: N/A; putative formula: C3H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.193,"smiles":null,"spectrum_id":"CCMSLIB00017270489","spectrum_index":30558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 294.1214 Da; putative annotation: N/A; putative formula: C14H18N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.192,"smiles":null,"spectrum_id":"CCMSLIB00017270492","spectrum_index":30559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 158.9354 Da; putative annotation: N/A; putative formula: C3HN3O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.115,"smiles":null,"spectrum_id":"CCMSLIB00017270494","spectrum_index":30560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 198.0645 Da; putative annotation: N/A; putative formula: C13H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.145,"smiles":null,"spectrum_id":"CCMSLIB00017270497","spectrum_index":30561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 35.0606 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.126,"smiles":null,"spectrum_id":"CCMSLIB00017270499","spectrum_index":30562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 61.0241 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.105,"smiles":null,"spectrum_id":"CCMSLIB00017270502","spectrum_index":30563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 30.0 eV (delta mass: 237.047 Da; putative annotation: N/A; putative formula: C4H3N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.117,"smiles":null,"spectrum_id":"CCMSLIB00017270504","spectrum_index":30564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 399.7043 Da; putative annotation: N/A; putative formula: C4O2S10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.764,"smiles":null,"spectrum_id":"CCMSLIB00017270507","spectrum_index":30565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 794.5164 Da; putative annotation: N/A; putative formula: C41H66N10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.576,"smiles":null,"spectrum_id":"CCMSLIB00017270510","spectrum_index":30566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 701.3469 Da; putative annotation: N/A; putative formula: C36H47N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.407,"smiles":null,"spectrum_id":"CCMSLIB00017270512","spectrum_index":30567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 339.1522 Da; putative annotation: N/A; putative formula: C18H21N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.276,"smiles":null,"spectrum_id":"CCMSLIB00017270514","spectrum_index":30568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimetidine amide (delta mass: 26.9864 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.12,"smiles":null,"spectrum_id":"CCMSLIB00017270517","spectrum_index":30569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine ethyl ester (delta mass: 70.041 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017270520","spectrum_index":30570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 34.1321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.253,"smiles":null,"spectrum_id":"CCMSLIB00017270522","spectrum_index":30571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 160.998 Da; putative annotation: N/A; putative formula: C5H-1N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.116,"smiles":null,"spectrum_id":"CCMSLIB00017270524","spectrum_index":30572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 60.0209 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017270527","spectrum_index":30573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 79.0434 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.109,"smiles":null,"spectrum_id":"CCMSLIB00017270530","spectrum_index":30574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.076,"smiles":null,"spectrum_id":"CCMSLIB00017270531","spectrum_index":30575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 197.0899 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.202,"smiles":null,"spectrum_id":"CCMSLIB00017270534","spectrum_index":30576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxycoumarin (delta mass: 79.9561 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.995,"smiles":null,"spectrum_id":"CCMSLIB00017270537","spectrum_index":30577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 72.0165 Da; putative annotation: N/A; putative formula: C2H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.097,"smiles":null,"spectrum_id":"CCMSLIB00017270539","spectrum_index":30578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1069.314 Da; putative annotation: N/A; putative formula: C71H43N9O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1291.41,"smiles":null,"spectrum_id":"CCMSLIB00017270541","spectrum_index":30579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 101.0656 Da; putative annotation: N/A; putative formula: C5H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.13,"smiles":null,"spectrum_id":"CCMSLIB00017270544","spectrum_index":30580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 87.0462 Da; putative annotation: N/A; putative formula: C7H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.148,"smiles":null,"spectrum_id":"CCMSLIB00017270545","spectrum_index":30581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 67.0524 Da; putative annotation: N/A; putative formula: C3H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.15,"smiles":null,"spectrum_id":"CCMSLIB00017270548","spectrum_index":30582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 779.1919 Da; putative annotation: N/A; putative formula: C49H37N3O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.263,"smiles":null,"spectrum_id":"CCMSLIB00017270551","spectrum_index":30583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 24.0099 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.102,"smiles":null,"spectrum_id":"CCMSLIB00017270553","spectrum_index":30584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 104.0445 Da; putative annotation: N/A; putative formula: H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.204,"smiles":null,"spectrum_id":"CCMSLIB00017270555","spectrum_index":30585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017270558","spectrum_index":30586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 268.1333 Da; putative annotation: N/A; putative formula: C13H21N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.282,"smiles":null,"spectrum_id":"CCMSLIB00017270560","spectrum_index":30587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethan CollisionEnergy:102040 (delta mass: 262.068 Da; putative annotation: N/A; putative formula: C15H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.217,"smiles":null,"spectrum_id":"CCMSLIB00017270562","spectrum_index":30588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 191.1671 Da; putative annotation: N/A; putative formula: C13H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.253,"smiles":null,"spectrum_id":"CCMSLIB00017270565","spectrum_index":30589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 598.4888 Da; putative annotation: N/A; putative formula: C30H62N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":818.531,"smiles":null,"spectrum_id":"CCMSLIB00017270567","spectrum_index":30590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 149.0469 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.197,"smiles":null,"spectrum_id":"CCMSLIB00017270569","spectrum_index":30591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 188.0662 Da; putative annotation: N/A; putative formula: C12H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.205,"smiles":null,"spectrum_id":"CCMSLIB00017270572","spectrum_index":30592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 141.1495 Da; putative annotation: N/A; putative formula: C9H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.335,"smiles":null,"spectrum_id":"CCMSLIB00017270575","spectrum_index":30593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 92.0621 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017270576","spectrum_index":30594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 324.25 Da; putative annotation: N/A; putative formula: C20H38O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.4,"smiles":null,"spectrum_id":"CCMSLIB00017270579","spectrum_index":30595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,2,3,4-Tetrahydro-9H-carbazol-9-yl)propanohydrazide (delta mass: 285.0236 Da; putative annotation: N/A; putative formula: C9H7N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.184,"smiles":null,"spectrum_id":"CCMSLIB00017270582","spectrum_index":30596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 78.0319 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017270583","spectrum_index":30597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 67.0746 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.155,"smiles":null,"spectrum_id":"CCMSLIB00017270586","spectrum_index":30598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 24.962 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.07,"smiles":null,"spectrum_id":"CCMSLIB00017270589","spectrum_index":30599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 78.0115 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.098,"smiles":null,"spectrum_id":"CCMSLIB00017270590","spectrum_index":30600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 399.2497 Da; putative annotation: N/A; putative formula: C19H29N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.398,"smiles":null,"spectrum_id":"CCMSLIB00017270593","spectrum_index":30601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hernagine (delta mass: 18.0047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.159,"smiles":null,"spectrum_id":"CCMSLIB00017270596","spectrum_index":30602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3-(2-Hydroxyethyl)indole from NIST14 (delta mass: 24.8654 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.957,"smiles":null,"spectrum_id":"CCMSLIB00017270597","spectrum_index":30603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 136.6053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.677,"smiles":null,"spectrum_id":"CCMSLIB00017270600","spectrum_index":30604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 40.0675 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.149,"smiles":null,"spectrum_id":"CCMSLIB00017270603","spectrum_index":30605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 490.1027 Da; putative annotation: N/A; putative formula: C34H18O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.182,"smiles":null,"spectrum_id":"CCMSLIB00017270604","spectrum_index":30606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 520.1158 Da; putative annotation: N/A; putative formula: C31H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.195,"smiles":null,"spectrum_id":"CCMSLIB00017270607","spectrum_index":30607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 38.0523 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.149,"smiles":null,"spectrum_id":"CCMSLIB00017270610","spectrum_index":30608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-4-hydroxyphenylalanine (delta mass: 103.0314 Da; putative annotation: N/A; putative formula: CH5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.124,"smiles":null,"spectrum_id":"CCMSLIB00017270611","spectrum_index":30609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 92.0104 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.065,"smiles":null,"spectrum_id":"CCMSLIB00017270614","spectrum_index":30610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 156.1027 Da; putative annotation: N/A; putative formula: C6H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.153,"smiles":null,"spectrum_id":"CCMSLIB00017270615","spectrum_index":30611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 310.156 Da; putative annotation: N/A; putative formula: C14H23N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.268,"smiles":null,"spectrum_id":"CCMSLIB00017270618","spectrum_index":30612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pergolide sulfoxide (delta mass: 23.0185 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.202,"smiles":null,"spectrum_id":"CCMSLIB00017270621","spectrum_index":30613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione (delta mass: 244.1051 Da; putative annotation: N/A; putative formula: C12H21OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.234,"smiles":null,"spectrum_id":"CCMSLIB00017270622","spectrum_index":30614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 587.3361 Da; putative annotation: N/A; putative formula: C35H45N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.438,"smiles":null,"spectrum_id":"CCMSLIB00017270625","spectrum_index":30615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-3-carboxylic acid (delta mass: 92.0111 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.045,"smiles":null,"spectrum_id":"CCMSLIB00017270628","spectrum_index":30616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ozagrel (delta mass: 89.9401 Da; putative annotation: N/A; putative formula: CH-2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.037,"smiles":null,"spectrum_id":"CCMSLIB00017270629","spectrum_index":30617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.102,"smiles":null,"spectrum_id":"CCMSLIB00017270632","spectrum_index":30618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004801 2-naphthoic acid|naphthalene-2-carboxylic acid (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017270635","spectrum_index":30619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 167.0498 Da; putative annotation: N/A; putative formula: C8H10NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.127,"smiles":null,"spectrum_id":"CCMSLIB00017270636","spectrum_index":30620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 661.3851 Da; putative annotation: N/A; putative formula: C38H47N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":842.456,"smiles":null,"spectrum_id":"CCMSLIB00017270639","spectrum_index":30621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 751.487 Da; putative annotation: N/A; putative formula: C39H57N15O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":932.558,"smiles":null,"spectrum_id":"CCMSLIB00017270642","spectrum_index":30622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 194.1242 Da; putative annotation: N/A; putative formula: C11H18N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.221,"smiles":null,"spectrum_id":"CCMSLIB00017270643","spectrum_index":30623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 298.1552 Da; putative annotation: N/A; putative formula: C19H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.215,"smiles":null,"spectrum_id":"CCMSLIB00017270646","spectrum_index":30624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 84.0574 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.237,"smiles":null,"spectrum_id":"CCMSLIB00017270648","spectrum_index":30625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 76.0348 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.09,"smiles":null,"spectrum_id":"CCMSLIB00017270650","spectrum_index":30626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 493.3043 Da; putative annotation: N/A; putative formula: C27H43NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.37,"smiles":null,"spectrum_id":"CCMSLIB00017270653","spectrum_index":30627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 52.0312 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017270655","spectrum_index":30628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 129.0794 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.15,"smiles":null,"spectrum_id":"CCMSLIB00017270657","spectrum_index":30629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 28.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.132,"smiles":null,"spectrum_id":"CCMSLIB00017270660","spectrum_index":30630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 76.0881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017270662","spectrum_index":30631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 477.1859 Da; putative annotation: N/A; putative formula: C21H27N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.257,"smiles":null,"spectrum_id":"CCMSLIB00017270664","spectrum_index":30632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptamine (delta mass: 52.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.165,"smiles":null,"spectrum_id":"CCMSLIB00017270667","spectrum_index":30633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acridine-2,9-diol (delta mass: 18.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017270669","spectrum_index":30634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311112 Caffeoyl putrescin (isomer of 1059) (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.15,"smiles":null,"spectrum_id":"CCMSLIB00017270672","spectrum_index":30635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 158.1456 Da; putative annotation: N/A; putative formula: C13H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.273,"smiles":null,"spectrum_id":"CCMSLIB00017270674","spectrum_index":30636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 472.1377 Da; putative annotation: N/A; putative formula: C17H24N6O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.198,"smiles":null,"spectrum_id":"CCMSLIB00017270677","spectrum_index":30637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 306.1266 Da; putative annotation: N/A; putative formula: C20H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.25,"smiles":null,"spectrum_id":"CCMSLIB00017270680","spectrum_index":30638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 136.0013 Da; putative annotation: N/A; putative formula: C4H8OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.093,"smiles":null,"spectrum_id":"CCMSLIB00017270682","spectrum_index":30639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 283.2648 Da; putative annotation: N/A; putative formula: C21H33NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.33,"smiles":null,"spectrum_id":"CCMSLIB00017270684","spectrum_index":30640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 179.08 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.223,"smiles":null,"spectrum_id":"CCMSLIB00017270687","spectrum_index":30641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 89.047 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.128,"smiles":null,"spectrum_id":"CCMSLIB00017270690","spectrum_index":30642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 126.1035 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.273,"smiles":null,"spectrum_id":"CCMSLIB00017270692","spectrum_index":30643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptamine (delta mass: 54.9918 Da; putative annotation: N/A; putative formula: C2HNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.099,"smiles":null,"spectrum_id":"CCMSLIB00017270694","spectrum_index":30644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 245.0544 Da; putative annotation: N/A; putative formula: C10H15NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.141,"smiles":null,"spectrum_id":"CCMSLIB00017270697","spectrum_index":30645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 60.0564 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.226,"smiles":null,"spectrum_id":"CCMSLIB00017270700","spectrum_index":30646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 42.0188 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.126,"smiles":null,"spectrum_id":"CCMSLIB00017270703","spectrum_index":30647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)phenol (delta mass: 51.0472 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.123,"smiles":null,"spectrum_id":"CCMSLIB00017270704","spectrum_index":30648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 87.0184 Da; putative annotation: N/A; putative formula: HN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.105,"smiles":null,"spectrum_id":"CCMSLIB00017270707","spectrum_index":30649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 497.1774 Da; putative annotation: N/A; putative formula: C18H32N3O11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.248,"smiles":null,"spectrum_id":"CCMSLIB00017270710","spectrum_index":30650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 296.1463 Da; putative annotation: N/A; putative formula: C17H20N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.285,"smiles":null,"spectrum_id":"CCMSLIB00017270713","spectrum_index":30651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 110.0362 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.122,"smiles":null,"spectrum_id":"CCMSLIB00017270714","spectrum_index":30652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.174,"smiles":null,"spectrum_id":"CCMSLIB00017270717","spectrum_index":30653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 64.0163 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.028,"smiles":null,"spectrum_id":"CCMSLIB00017270720","spectrum_index":30654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 11.0155 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.165,"smiles":null,"spectrum_id":"CCMSLIB00017270721","spectrum_index":30655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 19.8237 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017270724","spectrum_index":30656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 487.3848 Da; putative annotation: N/A; putative formula: C31H53NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.502,"smiles":null,"spectrum_id":"CCMSLIB00017270727","spectrum_index":30657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 77.0828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.143,"smiles":null,"spectrum_id":"CCMSLIB00017270729","spectrum_index":30658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dextrorphan (delta mass: 218.1217 Da; putative annotation: N/A; putative formula: C8H20N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.307,"smiles":null,"spectrum_id":"CCMSLIB00017270732","spectrum_index":30659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 82.9987 Da; putative annotation: N/A; putative formula: C3HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.038,"smiles":null,"spectrum_id":"CCMSLIB00017270734","spectrum_index":30660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 504.1688 Da; putative annotation: N/A; putative formula: C24H32N4O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.26,"smiles":null,"spectrum_id":"CCMSLIB00017270737","spectrum_index":30661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"6-amino-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazole-5-carb onitrile CollisionEnergy:102040\"\" (delta mass: 71.9881 Da; putative annotation: N/A; putative formula: CHN2P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.102,"smiles":null,"spectrum_id":"CCMSLIB00017270740","spectrum_index":30662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 245.163 Da; putative annotation: N/A; putative formula: C12H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.234,"smiles":null,"spectrum_id":"CCMSLIB00017270742","spectrum_index":30663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ301405 Cefalexin|7-[(2-amino-1-oxo-2-phenylethyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.138,"smiles":null,"spectrum_id":"CCMSLIB00017270744","spectrum_index":30664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-Deoxyguanosine (delta mass: 96.0575 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.161,"smiles":null,"spectrum_id":"CCMSLIB00017270747","spectrum_index":30665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 122.0469 Da; putative annotation: N/A; putative formula: H7N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.123,"smiles":null,"spectrum_id":"CCMSLIB00017270750","spectrum_index":30666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.159,"smiles":null,"spectrum_id":"CCMSLIB00017270752","spectrum_index":30667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 475.2997 Da; putative annotation: N/A; putative formula: C23H46N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.354,"smiles":null,"spectrum_id":"CCMSLIB00017270755","spectrum_index":30668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 152.1199 Da; putative annotation: N/A; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.191,"smiles":null,"spectrum_id":"CCMSLIB00017270757","spectrum_index":30669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 45.9942 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017270760","spectrum_index":30670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 281.2866 Da; putative annotation: N/A; putative formula: C17H35N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.375,"smiles":null,"spectrum_id":"CCMSLIB00017270763","spectrum_index":30671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 923.4054 Da; putative annotation: N/A; putative formula: C47H61N3O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1145.5,"smiles":null,"spectrum_id":"CCMSLIB00017270765","spectrum_index":30672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 136.0727 Da; putative annotation: N/A; putative formula: C9H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.2,"smiles":null,"spectrum_id":"CCMSLIB00017270767","spectrum_index":30673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Saccharic acid 1,4-lactone (delta mass: 55.0419 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.076,"smiles":null,"spectrum_id":"CCMSLIB00017270770","spectrum_index":30674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 260.143 Da; putative annotation: N/A; putative formula: C17H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.211,"smiles":null,"spectrum_id":"CCMSLIB00017270772","spectrum_index":30675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxo-1,2-dihydro-quinoline-3,4-dicarboxylic acid (delta mass: 207.0344 Da; putative annotation: N/A; putative formula: C12H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.074,"smiles":null,"spectrum_id":"CCMSLIB00017270774","spectrum_index":30676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 812.4799 Da; putative annotation: N/A; putative formula: C49H68N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":975.54,"smiles":null,"spectrum_id":"CCMSLIB00017270777","spectrum_index":30677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 141.1169 Da; putative annotation: N/A; putative formula: C8H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.24,"smiles":null,"spectrum_id":"CCMSLIB00017270779","spectrum_index":30678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 120.094 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.175,"smiles":null,"spectrum_id":"CCMSLIB00017270781","spectrum_index":30679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 8.0052 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017270784","spectrum_index":30680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100147 Indole-3-acetaldehyde (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017270786","spectrum_index":30681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 296.1457 Da; putative annotation: N/A; putative formula: C9H16N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.299,"smiles":null,"spectrum_id":"CCMSLIB00017270788","spectrum_index":30682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 328.2622 Da; putative annotation: N/A; putative formula: C20H40O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.299,"smiles":null,"spectrum_id":"CCMSLIB00017270791","spectrum_index":30683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 112.016 Da; putative annotation: N/A; putative formula: C5H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.087,"smiles":null,"spectrum_id":"CCMSLIB00017270793","spectrum_index":30684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 36.9203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.024,"smiles":null,"spectrum_id":"CCMSLIB00017270795","spectrum_index":30685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C9:0 (delta mass: 221.142 Da; putative annotation: N/A; putative formula: C13H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.369,"smiles":null,"spectrum_id":"CCMSLIB00017270798","spectrum_index":30686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 426.2414 Da; putative annotation: N/A; putative formula: C27H38S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.312,"smiles":null,"spectrum_id":"CCMSLIB00017270800","spectrum_index":30687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatol (delta mass: 60.0205 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.102,"smiles":null,"spectrum_id":"CCMSLIB00017270802","spectrum_index":30688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 75.0162 Da; putative annotation: N/A; putative formula: C2H5NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.097,"smiles":null,"spectrum_id":"CCMSLIB00017270805","spectrum_index":30689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltotetraose from NIST14 (delta mass: 108.0207 Da; putative annotation: 1,3,5-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":775.25,"smiles":null,"spectrum_id":"CCMSLIB00017270807","spectrum_index":30690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eseroline (delta mass: 161.0842 Da; putative annotation: .beta.-Phenyl-.gamma.-aminobutyric acid; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.233,"smiles":null,"spectrum_id":"CCMSLIB00017270809","spectrum_index":30691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 188.1205 Da; putative annotation: Aureonitol; putative formula: C13H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.244,"smiles":null,"spectrum_id":"CCMSLIB00017270812","spectrum_index":30692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 275.1368 Da; putative annotation: Massbank:PR310824 N-Fructosyl isoleucine; putative formula: C12H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.26,"smiles":null,"spectrum_id":"CCMSLIB00017270813","spectrum_index":30693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentianose (delta mass: 107.0369 Da; putative annotation: 4-Amino-1,2-benzenediol; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.213,"smiles":null,"spectrum_id":"CCMSLIB00017270816","spectrum_index":30694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gly-Glu (delta mass: 111.0321 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.157,"smiles":null,"spectrum_id":"CCMSLIB00017270819","spectrum_index":30695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ser (delta mass: 198.063 Da; putative annotation: 4,4'-Thiodianiline; putative formula: C12H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.155,"smiles":null,"spectrum_id":"CCMSLIB00017270820","spectrum_index":30696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 130.0418 Da; putative annotation: trans-Cinnamic acid; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017270823","spectrum_index":30697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 119.0734 Da; putative annotation: 4-(Dimethylamino)phenol; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.15,"smiles":null,"spectrum_id":"CCMSLIB00017270826","spectrum_index":30698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 90.0682 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.181,"smiles":null,"spectrum_id":"CCMSLIB00017270828","spectrum_index":30699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 318.2543 Da; putative annotation: N/A; putative formula: C17H30N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.346,"smiles":null,"spectrum_id":"CCMSLIB00017270830","spectrum_index":30700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 174.0574 Da; putative annotation: N/A; putative formula: C5H10N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.196,"smiles":null,"spectrum_id":"CCMSLIB00017270833","spectrum_index":30701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 82.0727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.164,"smiles":null,"spectrum_id":"CCMSLIB00017270836","spectrum_index":30702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 23.0121 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.119,"smiles":null,"spectrum_id":"CCMSLIB00017270837","spectrum_index":30703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Methoxybenzyl)(2-nitrophenyl)methanamine (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017270840","spectrum_index":30704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 144.0581 Da; putative annotation: N/A; putative formula: C3H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.14,"smiles":null,"spectrum_id":"CCMSLIB00017270843","spectrum_index":30705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 167.0655 Da; putative annotation: N/A; putative formula: C2H9N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.204,"smiles":null,"spectrum_id":"CCMSLIB00017270844","spectrum_index":30706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-propanoic acid (delta mass: 98.2031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.289,"smiles":null,"spectrum_id":"CCMSLIB00017270847","spectrum_index":30707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 731.2352 Da; putative annotation: N/A; putative formula: C47H33N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.276,"smiles":null,"spectrum_id":"CCMSLIB00017270849","spectrum_index":30708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 135.0886 Da; putative annotation: N/A; putative formula: C6H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.191,"smiles":null,"spectrum_id":"CCMSLIB00017270851","spectrum_index":30709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 188.0451 Da; putative annotation: N/A; putative formula: C7H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.116,"smiles":null,"spectrum_id":"CCMSLIB00017270854","spectrum_index":30710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 245.09 Da; putative annotation: N/A; putative formula: C10H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.161,"smiles":null,"spectrum_id":"CCMSLIB00017270856","spectrum_index":30711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 67.0422 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.129,"smiles":null,"spectrum_id":"CCMSLIB00017270858","spectrum_index":30712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloropropyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 88.0493 Da; putative annotation: N/A; putative formula: H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.113,"smiles":null,"spectrum_id":"CCMSLIB00017270861","spectrum_index":30713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 136.049 Da; putative annotation: N/A; putative formula: C3H8N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.199,"smiles":null,"spectrum_id":"CCMSLIB00017270863","spectrum_index":30714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 172.0737 Da; putative annotation: N/A; putative formula: C8H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.16,"smiles":null,"spectrum_id":"CCMSLIB00017270865","spectrum_index":30715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 27.9852 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.077,"smiles":null,"spectrum_id":"CCMSLIB00017270868","spectrum_index":30716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 718.0536 Da; putative annotation: N/A; putative formula: C29H18N8O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.109,"smiles":null,"spectrum_id":"CCMSLIB00017270870","spectrum_index":30717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 447.1503 Da; putative annotation: N/A; putative formula: C18H21N7O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.237,"smiles":null,"spectrum_id":"CCMSLIB00017270872","spectrum_index":30718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Cyclopropylmethyl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide (delta mass: 71.0518 Da; putative annotation: N/A; putative formula: C2H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.238,"smiles":null,"spectrum_id":"CCMSLIB00017270875","spectrum_index":30719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 120.1018 Da; putative annotation: N/A; putative formula: C8H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.209,"smiles":null,"spectrum_id":"CCMSLIB00017270877","spectrum_index":30720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 266.262 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.448,"smiles":null,"spectrum_id":"CCMSLIB00017270879","spectrum_index":30721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 22.0216 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.103,"smiles":null,"spectrum_id":"CCMSLIB00017270882","spectrum_index":30722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 78.0283 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.084,"smiles":null,"spectrum_id":"CCMSLIB00017270884","spectrum_index":30723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 266.1383 Da; putative annotation: N/A; putative formula: C12H18N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.225,"smiles":null,"spectrum_id":"CCMSLIB00017270886","spectrum_index":30724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 274.1869 Da; putative annotation: N/A; putative formula: C17H26N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.273,"smiles":null,"spectrum_id":"CCMSLIB00017270889","spectrum_index":30725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 235.1422 Da; putative annotation: N/A; putative formula: C10H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.213,"smiles":null,"spectrum_id":"CCMSLIB00017270890","spectrum_index":30726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 206.1368 Da; putative annotation: N/A; putative formula: C7H18N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.254,"smiles":null,"spectrum_id":"CCMSLIB00017270893","spectrum_index":30727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 59.0224 Da; putative annotation: N/A; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017270896","spectrum_index":30728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 36.9829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.064,"smiles":null,"spectrum_id":"CCMSLIB00017270897","spectrum_index":30729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Formyltryptophan (delta mass: 100.0497 Da; putative annotation: N/A; putative formula: CH4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.142,"smiles":null,"spectrum_id":"CCMSLIB00017270900","spectrum_index":30730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 198.1259 Da; putative annotation: N/A; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.254,"smiles":null,"spectrum_id":"CCMSLIB00017270903","spectrum_index":30731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 35.9799 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.052,"smiles":null,"spectrum_id":"CCMSLIB00017270904","spectrum_index":30732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcocaine (delta mass: 125.0843 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.223,"smiles":null,"spectrum_id":"CCMSLIB00017270907","spectrum_index":30733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 468.3193 Da; putative annotation: N/A; putative formula: C27H49O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.39,"smiles":null,"spectrum_id":"CCMSLIB00017270909","spectrum_index":30734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of n-[2-(4-sec-butyl-phenoxy)-4,5-dihydroxy-6-hydroxymethyl-tetrahydro-pyran-3-yl]-acetamide (delta mass: 83.0459 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.237,"smiles":null,"spectrum_id":"CCMSLIB00017270911","spectrum_index":30735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 263.2531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.34,"smiles":null,"spectrum_id":"CCMSLIB00017270914","spectrum_index":30736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 724.5256 Da; putative annotation: N/A; putative formula: C41H68N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":905.596,"smiles":null,"spectrum_id":"CCMSLIB00017270916","spectrum_index":30737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 533.4653 Da; putative annotation: N/A; putative formula: C31H59N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.536,"smiles":null,"spectrum_id":"CCMSLIB00017270918","spectrum_index":30738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 334.1769 Da; putative annotation: N/A; putative formula: C13H27N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.269,"smiles":null,"spectrum_id":"CCMSLIB00017270921","spectrum_index":30739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 314.1449 Da; putative annotation: N/A; putative formula: C10H18N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.299,"smiles":null,"spectrum_id":"CCMSLIB00017270923","spectrum_index":30740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 249.2899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.371,"smiles":null,"spectrum_id":"CCMSLIB00017270925","spectrum_index":30741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 81.9728 Da; putative annotation: N/A; putative formula: C2H-1N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.178,"smiles":null,"spectrum_id":"CCMSLIB00017270928","spectrum_index":30742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 170.1126 Da; putative annotation: N/A; putative formula: C10H18S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.167,"smiles":null,"spectrum_id":"CCMSLIB00017270930","spectrum_index":30743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 269.0411 Da; putative annotation: N/A; putative formula: C13H7N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.112,"smiles":null,"spectrum_id":"CCMSLIB00017270932","spectrum_index":30744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cefotaxime (delta mass: 264.1097 Da; putative annotation: N/A; putative formula: C7H17N6O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":720.174,"smiles":null,"spectrum_id":"CCMSLIB00017270935","spectrum_index":30745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3,4-Dimethoxyphenyl)-1H-indole (delta mass: 32.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.138,"smiles":null,"spectrum_id":"CCMSLIB00017270937","spectrum_index":30746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 237.1211 Da; putative annotation: N/A; putative formula: C9H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.197,"smiles":null,"spectrum_id":"CCMSLIB00017270939","spectrum_index":30747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 195.2363 Da; putative annotation: N/A; putative formula: C14H29NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.302,"smiles":null,"spectrum_id":"CCMSLIB00017270942","spectrum_index":30748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epinephrine (delta mass: 29.9929 Da; putative annotation: N/A; putative formula: CH2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.09,"smiles":null,"spectrum_id":"CCMSLIB00017270944","spectrum_index":30749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 187.069 Da; putative annotation: N/A; putative formula: C7H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.108,"smiles":null,"spectrum_id":"CCMSLIB00017270946","spectrum_index":30750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 147.1336 Da; putative annotation: N/A; putative formula: C2H13N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.195,"smiles":null,"spectrum_id":"CCMSLIB00017270949","spectrum_index":30751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 38.0164 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.087,"smiles":null,"spectrum_id":"CCMSLIB00017270951","spectrum_index":30752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 341.1321 Da; putative annotation: N/A; putative formula: C12H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.308,"smiles":null,"spectrum_id":"CCMSLIB00017270953","spectrum_index":30753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tryptamine-C6:0 (delta mass: 115.0732 Da; putative annotation: N/A; putative formula: H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.254,"smiles":null,"spectrum_id":"CCMSLIB00017270956","spectrum_index":30754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 214.1571 Da; putative annotation: N/A; putative formula: C12H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.254,"smiles":null,"spectrum_id":"CCMSLIB00017270958","spectrum_index":30755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylputrescine; AIF; CE0; MS2Dec (delta mass: 442.3545 Da; putative annotation: N/A; putative formula: C24H42N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.472,"smiles":null,"spectrum_id":"CCMSLIB00017270960","spectrum_index":30756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381340-01!(5E)-heptadeca-5,16-diene-1,2,4-triol (delta mass: 94.0781 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.32,"smiles":null,"spectrum_id":"CCMSLIB00017270963","spectrum_index":30757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 15.9327 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.993,"smiles":null,"spectrum_id":"CCMSLIB00017270965","spectrum_index":30758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 146.0582 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.124,"smiles":null,"spectrum_id":"CCMSLIB00017270967","spectrum_index":30759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 261.2445 Da; putative annotation: N/A; putative formula: C18H31N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.331,"smiles":null,"spectrum_id":"CCMSLIB00017270970","spectrum_index":30760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 85.0499 Da; putative annotation: N/A; putative formula: H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.089,"smiles":null,"spectrum_id":"CCMSLIB00017270972","spectrum_index":30761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 187.0586 Da; putative annotation: N/A; putative formula: C8H14NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.155,"smiles":null,"spectrum_id":"CCMSLIB00017270974","spectrum_index":30762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 86.062 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.133,"smiles":null,"spectrum_id":"CCMSLIB00017270977","spectrum_index":30763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 759.5849 Da; putative annotation: N/A; putative formula: C47H77N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.645,"smiles":null,"spectrum_id":"CCMSLIB00017270978","spectrum_index":30764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 130.1076 Da; putative annotation: N/A; putative formula: C2H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.298,"smiles":null,"spectrum_id":"CCMSLIB00017270981","spectrum_index":30765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000066 Salsolinol (delta mass: 125.1436 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.246,"smiles":null,"spectrum_id":"CCMSLIB00017270984","spectrum_index":30766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 299.2042 Da; putative annotation: N/A; putative formula: C23H25NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.306,"smiles":null,"spectrum_id":"CCMSLIB00017270985","spectrum_index":30767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 169.0857 Da; putative annotation: N/A; putative formula: C7H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.152,"smiles":null,"spectrum_id":"CCMSLIB00017270988","spectrum_index":30768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 100.0317 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.17,"smiles":null,"spectrum_id":"CCMSLIB00017270989","spectrum_index":30769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 16.1516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.285,"smiles":null,"spectrum_id":"CCMSLIB00017270992","spectrum_index":30770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 178.0696 Da; putative annotation: N/A; putative formula: C6H15N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.128,"smiles":null,"spectrum_id":"CCMSLIB00017270995","spectrum_index":30771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 84.0208 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.154,"smiles":null,"spectrum_id":"CCMSLIB00017270997","spectrum_index":30772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 45.9711 Da; putative annotation: N/A; putative formula: H-2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.036,"smiles":null,"spectrum_id":"CCMSLIB00017271000","spectrum_index":30773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 44.9927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.032,"smiles":null,"spectrum_id":"CCMSLIB00017271003","spectrum_index":30774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 419.314 Da; putative annotation: N/A; putative formula: C24H41N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.437,"smiles":null,"spectrum_id":"CCMSLIB00017271005","spectrum_index":30775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 181.1102 Da; putative annotation: N/A; putative formula: C10H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.206,"smiles":null,"spectrum_id":"CCMSLIB00017271008","spectrum_index":30776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 198.1247 Da; putative annotation: N/A; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.212,"smiles":null,"spectrum_id":"CCMSLIB00017271010","spectrum_index":30777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 152.1538 Da; putative annotation: N/A; putative formula: C11H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.251,"smiles":null,"spectrum_id":"CCMSLIB00017271013","spectrum_index":30778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 216.0787 Da; putative annotation: N/A; putative formula: C13H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.154,"smiles":null,"spectrum_id":"CCMSLIB00017271016","spectrum_index":30779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 244.0898 Da; putative annotation: N/A; putative formula: C11H12N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.181,"smiles":null,"spectrum_id":"CCMSLIB00017271018","spectrum_index":30780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 144.0479 Da; putative annotation: N/A; putative formula: C4H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.187,"smiles":null,"spectrum_id":"CCMSLIB00017271021","spectrum_index":30781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 137.0918 Da; putative annotation: N/A; putative formula: C7H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.203,"smiles":null,"spectrum_id":"CCMSLIB00017271023","spectrum_index":30782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 69.0214 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.092,"smiles":null,"spectrum_id":"CCMSLIB00017271026","spectrum_index":30783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 103.0093 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.133,"smiles":null,"spectrum_id":"CCMSLIB00017271028","spectrum_index":30784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-(3,4-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 123.0691 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.192,"smiles":null,"spectrum_id":"CCMSLIB00017271031","spectrum_index":30785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 72.0381 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.14,"smiles":null,"spectrum_id":"CCMSLIB00017271033","spectrum_index":30786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 67.0784 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.321,"smiles":null,"spectrum_id":"CCMSLIB00017271036","spectrum_index":30787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 114.0314 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.127,"smiles":null,"spectrum_id":"CCMSLIB00017271039","spectrum_index":30788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1169.4091 Da; putative annotation: N/A; putative formula: C86H51N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1332.47,"smiles":null,"spectrum_id":"CCMSLIB00017271041","spectrum_index":30789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 221.213 Da; putative annotation: N/A; putative formula: C15H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.284,"smiles":null,"spectrum_id":"CCMSLIB00017271043","spectrum_index":30790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 114.0421 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.124,"smiles":null,"spectrum_id":"CCMSLIB00017271046","spectrum_index":30791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 127.0637 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.103,"smiles":null,"spectrum_id":"CCMSLIB00017271048","spectrum_index":30792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 57.0216 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.155,"smiles":null,"spectrum_id":"CCMSLIB00017271050","spectrum_index":30793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 17.807 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.946,"smiles":null,"spectrum_id":"CCMSLIB00017271053","spectrum_index":30794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 42.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017271054","spectrum_index":30795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Gln (delta mass: 109.0169 Da; putative annotation: N/A; putative formula: C5H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.152,"smiles":null,"spectrum_id":"CCMSLIB00017271057","spectrum_index":30796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 44.9042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.001,"smiles":null,"spectrum_id":"CCMSLIB00017271060","spectrum_index":30797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 96.0552 Da; putative annotation: N/A; putative formula: C2H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.136,"smiles":null,"spectrum_id":"CCMSLIB00017271062","spectrum_index":30798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 128.0622 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.216,"smiles":null,"spectrum_id":"CCMSLIB00017271064","spectrum_index":30799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 405.3522 Da; putative annotation: N/A; putative formula: C28H43N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.423,"smiles":null,"spectrum_id":"CCMSLIB00017271067","spectrum_index":30800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 84.0574 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.169,"smiles":null,"spectrum_id":"CCMSLIB00017271070","spectrum_index":30801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 252.2551 Da; putative annotation: N/A; putative formula: C16H32N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.331,"smiles":null,"spectrum_id":"CCMSLIB00017271072","spectrum_index":30802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 224.2139 Da; putative annotation: N/A; putative formula: C15H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.267,"smiles":null,"spectrum_id":"CCMSLIB00017271074","spectrum_index":30803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 7.8764 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.958,"smiles":null,"spectrum_id":"CCMSLIB00017271077","spectrum_index":30804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 117.0871 Da; putative annotation: N/A; putative formula: H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.189,"smiles":null,"spectrum_id":"CCMSLIB00017271079","spectrum_index":30805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 168.0425 Da; putative annotation: N/A; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.076,"smiles":null,"spectrum_id":"CCMSLIB00017271082","spectrum_index":30806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 76.0318 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.102,"smiles":null,"spectrum_id":"CCMSLIB00017271084","spectrum_index":30807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 372.1238 Da; putative annotation: N/A; putative formula: C19H21N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.22,"smiles":null,"spectrum_id":"CCMSLIB00017271087","spectrum_index":30808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 102.0543 Da; putative annotation: N/A; putative formula: C2H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.173,"smiles":null,"spectrum_id":"CCMSLIB00017271089","spectrum_index":30809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 333.2509 Da; putative annotation: N/A; putative formula: C17H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.322,"smiles":null,"spectrum_id":"CCMSLIB00017271092","spectrum_index":30810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 55.0058 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.072,"smiles":null,"spectrum_id":"CCMSLIB00017271095","spectrum_index":30811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 413.2774 Da; putative annotation: N/A; putative formula: C22H39NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.348,"smiles":null,"spectrum_id":"CCMSLIB00017271098","spectrum_index":30812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 112.9728 Da; putative annotation: N/A; putative formula: C3H-1NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.038,"smiles":null,"spectrum_id":"CCMSLIB00017271099","spectrum_index":30813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-mannosamine - 40.0 eV (delta mass: 705.3663 Da; putative annotation: N/A; putative formula: C44H51NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":927.464,"smiles":null,"spectrum_id":"CCMSLIB00017271102","spectrum_index":30814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 169.1143 Da; putative annotation: N/A; putative formula: C8H16N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.163,"smiles":null,"spectrum_id":"CCMSLIB00017271104","spectrum_index":30815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citromycetin (delta mass: 9.9853 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.035,"smiles":null,"spectrum_id":"CCMSLIB00017271106","spectrum_index":30816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 102.1063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.154,"smiles":null,"spectrum_id":"CCMSLIB00017271109","spectrum_index":30817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 186.0531 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.124,"smiles":null,"spectrum_id":"CCMSLIB00017271112","spectrum_index":30818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 282.1933 Da; putative annotation: N/A; putative formula: C17H31O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.28,"smiles":null,"spectrum_id":"CCMSLIB00017271114","spectrum_index":30819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 96.0386 Da; putative annotation: N/A; putative formula: C6H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017271116","spectrum_index":30820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 26.932 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.013,"smiles":null,"spectrum_id":"CCMSLIB00017271119","spectrum_index":30821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 87.129 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.184,"smiles":null,"spectrum_id":"CCMSLIB00017271121","spectrum_index":30822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 105.0826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.185,"smiles":null,"spectrum_id":"CCMSLIB00017271123","spectrum_index":30823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 196.2394 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.31,"smiles":null,"spectrum_id":"CCMSLIB00017271126","spectrum_index":30824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 150.0205 Da; putative annotation: N/A; putative formula: C4H3N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.159,"smiles":null,"spectrum_id":"CCMSLIB00017271128","spectrum_index":30825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 83.0374 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017271130","spectrum_index":30826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 299.1882 Da; putative annotation: N/A; putative formula: C19H25NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.253,"smiles":null,"spectrum_id":"CCMSLIB00017271133","spectrum_index":30827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 225.048 Da; putative annotation: N/A; putative formula: C6H11NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.088,"smiles":null,"spectrum_id":"CCMSLIB00017271135","spectrum_index":30828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.253,"smiles":null,"spectrum_id":"CCMSLIB00017271137","spectrum_index":30829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 148.0412 Da; putative annotation: N/A; putative formula: C3H8N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017271140","spectrum_index":30830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-nitro-1H-indole-2-carboxylate (delta mass: 129.0478 Da; putative annotation: N/A; putative formula: C3H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.119,"smiles":null,"spectrum_id":"CCMSLIB00017271142","spectrum_index":30831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 363.1559 Da; putative annotation: N/A; putative formula: C14H26N3O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.32,"smiles":null,"spectrum_id":"CCMSLIB00017271144","spectrum_index":30832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 116.9739 Da; putative annotation: N/A; putative formula: H-1N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.055,"smiles":null,"spectrum_id":"CCMSLIB00017271147","spectrum_index":30833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 147.9475 Da; putative annotation: N/A; putative formula: C4H4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.034,"smiles":null,"spectrum_id":"CCMSLIB00017271150","spectrum_index":30834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 40.9461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.048,"smiles":null,"spectrum_id":"CCMSLIB00017271151","spectrum_index":30835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 530.4673 Da; putative annotation: N/A; putative formula: C31H58N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.559,"smiles":null,"spectrum_id":"CCMSLIB00017271154","spectrum_index":30836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510507 Tyramine|4-(2-aminoethyl)phenol (delta mass: 328.0947 Da; putative annotation: N/A; putative formula: C18H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.186,"smiles":null,"spectrum_id":"CCMSLIB00017271155","spectrum_index":30837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 129.1043 Da; putative annotation: N/A; putative formula: C4H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017271158","spectrum_index":30838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 264.0431 Da; putative annotation: N/A; putative formula: C17H12O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.114,"smiles":null,"spectrum_id":"CCMSLIB00017271161","spectrum_index":30839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 60.1337 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.22,"smiles":null,"spectrum_id":"CCMSLIB00017271162","spectrum_index":30840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(?)-ampicillin - 40.0 eV (delta mass: 381.1353 Da; putative annotation: N/A; putative formula: C19H20N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.252,"smiles":null,"spectrum_id":"CCMSLIB00017271165","spectrum_index":30841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 100.0522 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017271168","spectrum_index":30842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 325.1385 Da; putative annotation: N/A; putative formula: C23H20NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.219,"smiles":null,"spectrum_id":"CCMSLIB00017271170","spectrum_index":30843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 348.0633 Da; putative annotation: N/A; putative formula: C20H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.123,"smiles":null,"spectrum_id":"CCMSLIB00017271172","spectrum_index":30844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 176.0463 Da; putative annotation: N/A; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.096,"smiles":null,"spectrum_id":"CCMSLIB00017271175","spectrum_index":30845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Cystine (delta mass: 266.261 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.292,"smiles":null,"spectrum_id":"CCMSLIB00017271178","spectrum_index":30846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 17.0617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017271179","spectrum_index":30847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Val (delta mass: 99.0686 Da; putative annotation: Isovaline; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.197,"smiles":null,"spectrum_id":"CCMSLIB00017271182","spectrum_index":30848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-O-Caffeoyl-4-O-sinapoylquinic acid (delta mass: 162.032 Da; putative annotation: Caffeic acid; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.192,"smiles":null,"spectrum_id":"CCMSLIB00017271185","spectrum_index":30849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS001049068-01!2-amino-3-(1H-indol-3-yl)-N-phenylpropanamide (delta mass: 140.0751 Da; putative annotation: 1,8-Diaminonaphthalene; putative formula: C10H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.22,"smiles":null,"spectrum_id":"CCMSLIB00017271186","spectrum_index":30850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Threonine methyl ester (delta mass: 101.0482 Da; putative annotation: L-Homoserine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.129,"smiles":null,"spectrum_id":"CCMSLIB00017271189","spectrum_index":30851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 115.0632 Da; putative annotation: N-Methyl-L-threonine; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.14,"smiles":null,"spectrum_id":"CCMSLIB00017271192","spectrum_index":30852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 176.121 Da; putative annotation: 3-Methyl-1-adamantanecarboxylic acid; putative formula: C12H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.207,"smiles":null,"spectrum_id":"CCMSLIB00017271194","spectrum_index":30853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 910.4935 Da; putative annotation: [3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 1-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-(3,4,5-trihydroxyoxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate; putative formula: C47H74O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1091.56,"smiles":null,"spectrum_id":"CCMSLIB00017271196","spectrum_index":30854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 270.074 Da; putative annotation: Dianthoside; putative formula: C12H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.134,"smiles":null,"spectrum_id":"CCMSLIB00017271199","spectrum_index":30855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 99.0691 Da; putative annotation: 4-Amino-2-methylbutanoic acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.14,"smiles":null,"spectrum_id":"CCMSLIB00017271201","spectrum_index":30856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 149.0136 Da; putative annotation: Dipicolinic acid; putative formula: C7H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.1,"smiles":null,"spectrum_id":"CCMSLIB00017271204","spectrum_index":30857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 301.2626 Da; putative annotation: N/A; putative formula: C18H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.359,"smiles":null,"spectrum_id":"CCMSLIB00017271207","spectrum_index":30858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 368.1607 Da; putative annotation: N/A; putative formula: C16H33O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.242,"smiles":null,"spectrum_id":"CCMSLIB00017271209","spectrum_index":30859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 1.9793 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.039,"smiles":null,"spectrum_id":"CCMSLIB00017271212","spectrum_index":30860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 410.2401 Da; putative annotation: N/A; putative formula: C18H34N8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.353,"smiles":null,"spectrum_id":"CCMSLIB00017271214","spectrum_index":30861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 55.0061 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.066,"smiles":null,"spectrum_id":"CCMSLIB00017271217","spectrum_index":30862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 395.0301 Da; putative annotation: N/A; putative formula: C21H9N5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.101,"smiles":null,"spectrum_id":"CCMSLIB00017271220","spectrum_index":30863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380682-01_C13H18O8_ (delta mass: 108.0183 Da; putative annotation: N/A; putative formula: C2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.126,"smiles":null,"spectrum_id":"CCMSLIB00017271222","spectrum_index":30864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 135.0897 Da; putative annotation: N/A; putative formula: C6H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017271225","spectrum_index":30865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Trp (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.124,"smiles":null,"spectrum_id":"CCMSLIB00017271227","spectrum_index":30866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 227.0782 Da; putative annotation: N/A; putative formula: C7H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.117,"smiles":null,"spectrum_id":"CCMSLIB00017271230","spectrum_index":30867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 375.8923 Da; putative annotation: N/A; putative formula: C6H8N4O3S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.02,"smiles":null,"spectrum_id":"CCMSLIB00017271232","spectrum_index":30868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 65.0272 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.082,"smiles":null,"spectrum_id":"CCMSLIB00017271234","spectrum_index":30869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 199.0844 Da; putative annotation: N/A; putative formula: C9H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.186,"smiles":null,"spectrum_id":"CCMSLIB00017271237","spectrum_index":30870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00178646-02!2,4-dihydroxyheptadecyl acetate [IIN-based: Match] (delta mass: 68.0632 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.348,"smiles":null,"spectrum_id":"CCMSLIB00017271239","spectrum_index":30871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 214.0864 Da; putative annotation: N/A; putative formula: C4H10N10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.194,"smiles":null,"spectrum_id":"CCMSLIB00017271242","spectrum_index":30872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 316.1257 Da; putative annotation: N/A; putative formula: C10H12N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.23,"smiles":null,"spectrum_id":"CCMSLIB00017271244","spectrum_index":30873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 147.1048 Da; putative annotation: N/A; putative formula: C10H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.186,"smiles":null,"spectrum_id":"CCMSLIB00017271247","spectrum_index":30874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 367.2484 Da; putative annotation: N/A; putative formula: C20H29N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.398,"smiles":null,"spectrum_id":"CCMSLIB00017271250","spectrum_index":30875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 108.0212 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017271252","spectrum_index":30876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 282.2311 Da; putative annotation: N/A; putative formula: C16H30N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.301,"smiles":null,"spectrum_id":"CCMSLIB00017271254","spectrum_index":30877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 555.105 Da; putative annotation: N/A; putative formula: C18H22N9O8PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.166,"smiles":null,"spectrum_id":"CCMSLIB00017271257","spectrum_index":30878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 134.0787 Da; putative annotation: N/A; putative formula: C3H10N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.143,"smiles":null,"spectrum_id":"CCMSLIB00017271259","spectrum_index":30879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 130.0678 Da; putative annotation: N/A; putative formula: C4H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.17,"smiles":null,"spectrum_id":"CCMSLIB00017271261","spectrum_index":30880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101903 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017271264","spectrum_index":30881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 17.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017271265","spectrum_index":30882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 72.0426 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.181,"smiles":null,"spectrum_id":"CCMSLIB00017271268","spectrum_index":30883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of stepharine (delta mass: 173.3562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.5,"smiles":null,"spectrum_id":"CCMSLIB00017271270","spectrum_index":30884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-(4-Chlorophenyl)ethyl](methyl)amine (delta mass: 38.0135 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.087,"smiles":null,"spectrum_id":"CCMSLIB00017271273","spectrum_index":30885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 32.0283 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.133,"smiles":null,"spectrum_id":"CCMSLIB00017271276","spectrum_index":30886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 131.0273 Da; putative annotation: N/A; putative formula: C2H5N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.07,"smiles":null,"spectrum_id":"CCMSLIB00017271278","spectrum_index":30887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 363.2623 Da; putative annotation: N/A; putative formula: C18H37NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.322,"smiles":null,"spectrum_id":"CCMSLIB00017271281","spectrum_index":30888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 16.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.113,"smiles":null,"spectrum_id":"CCMSLIB00017271283","spectrum_index":30889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 77.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.17,"smiles":null,"spectrum_id":"CCMSLIB00017271286","spectrum_index":30890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 375.4299 Da; putative annotation: N/A; putative formula: C27H53NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.471,"smiles":null,"spectrum_id":"CCMSLIB00017271288","spectrum_index":30891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 61.9888 Da; putative annotation: N/A; putative formula: C3H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.101,"smiles":null,"spectrum_id":"CCMSLIB00017271291","spectrum_index":30892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 14.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.144,"smiles":null,"spectrum_id":"CCMSLIB00017271293","spectrum_index":30893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 132.0412 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.175,"smiles":null,"spectrum_id":"CCMSLIB00017271296","spectrum_index":30894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 125.1773 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.253,"smiles":null,"spectrum_id":"CCMSLIB00017271299","spectrum_index":30895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 18.4352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017271302","spectrum_index":30896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine; AIF; CE0; MS2Dec (delta mass: 165.1163 Da; putative annotation: N/A; putative formula: C10H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.212,"smiles":null,"spectrum_id":"CCMSLIB00017271303","spectrum_index":30897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 312.1063 Da; putative annotation: N/A; putative formula: C12H24O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.271,"smiles":null,"spectrum_id":"CCMSLIB00017271306","spectrum_index":30898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 17.022 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.171,"smiles":null,"spectrum_id":"CCMSLIB00017271309","spectrum_index":30899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 74.0364 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.107,"smiles":null,"spectrum_id":"CCMSLIB00017271310","spectrum_index":30900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 257.0729 Da; putative annotation: N/A; putative formula: C12H19NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.153,"smiles":null,"spectrum_id":"CCMSLIB00017271313","spectrum_index":30901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 64.068 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.242,"smiles":null,"spectrum_id":"CCMSLIB00017271316","spectrum_index":30902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 8.9896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.097,"smiles":null,"spectrum_id":"CCMSLIB00017271317","spectrum_index":30903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 197.5734 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.66,"smiles":null,"spectrum_id":"CCMSLIB00017271320","spectrum_index":30904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 414.226 Da; putative annotation: N/A; putative formula: C24H35N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.33,"smiles":null,"spectrum_id":"CCMSLIB00017271321","spectrum_index":30905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 83.0373 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017271324","spectrum_index":30906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 16.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.149,"smiles":null,"spectrum_id":"CCMSLIB00017271327","spectrum_index":30907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 54.0564 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.352,"smiles":null,"spectrum_id":"CCMSLIB00017271328","spectrum_index":30908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxylic acid CollisionEnergy:205060 (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.081,"smiles":null,"spectrum_id":"CCMSLIB00017271331","spectrum_index":30909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 72.0318 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.092,"smiles":null,"spectrum_id":"CCMSLIB00017271334","spectrum_index":30910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 102.0683 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.17,"smiles":null,"spectrum_id":"CCMSLIB00017271335","spectrum_index":30911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 288.2091 Da; putative annotation: N/A; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.333,"smiles":null,"spectrum_id":"CCMSLIB00017271338","spectrum_index":30912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 94.0231 Da; putative annotation: N/A; putative formula: C6H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.134,"smiles":null,"spectrum_id":"CCMSLIB00017271341","spectrum_index":30913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 54.0109 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.071,"smiles":null,"spectrum_id":"CCMSLIB00017271342","spectrum_index":30914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 225.1213 Da; putative annotation: N/A; putative formula: C12H21NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.176,"smiles":null,"spectrum_id":"CCMSLIB00017271345","spectrum_index":30915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 489.3672 Da; putative annotation: N/A; putative formula: C27H47N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.438,"smiles":null,"spectrum_id":"CCMSLIB00017271348","spectrum_index":30916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 207.1201 Da; putative annotation: N/A; putative formula: C11H17N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.202,"smiles":null,"spectrum_id":"CCMSLIB00017271349","spectrum_index":30917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 207.1614 Da; putative annotation: N/A; putative formula: C13H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.242,"smiles":null,"spectrum_id":"CCMSLIB00017271352","spectrum_index":30918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin Pr-LL (delta mass: 56.038 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.356,"smiles":null,"spectrum_id":"CCMSLIB00017271355","spectrum_index":30919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 183.1829 Da; putative annotation: N/A; putative formula: C9H21N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.263,"smiles":null,"spectrum_id":"CCMSLIB00017271357","spectrum_index":30920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 218.1267 Da; putative annotation: N/A; putative formula: C9H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.213,"smiles":null,"spectrum_id":"CCMSLIB00017271359","spectrum_index":30921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 7-fluoro-3-methyl-1H-indole-2-carboxylate (delta mass: 162.0446 Da; putative annotation: N/A; putative formula: C6H11O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.121,"smiles":null,"spectrum_id":"CCMSLIB00017271362","spectrum_index":30922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-3-iodo-2-pyridone (delta mass: 446.1808 Da; putative annotation: N/A; putative formula: C22H30N4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.083,"smiles":null,"spectrum_id":"CCMSLIB00017271365","spectrum_index":30923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 149.0679 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017271366","spectrum_index":30924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-1-(4-phenoxyphenyl)methanamine (delta mass: 112.0375 Da; putative annotation: N/A; putative formula: C3H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.16,"smiles":null,"spectrum_id":"CCMSLIB00017271369","spectrum_index":30925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 268.175 Da; putative annotation: N/A; putative formula: C19H25O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.303,"smiles":null,"spectrum_id":"CCMSLIB00017271372","spectrum_index":30926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epinephrine (delta mass: 194.1096 Da; putative annotation: N/A; putative formula: C15H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.206,"smiles":null,"spectrum_id":"CCMSLIB00017271373","spectrum_index":30927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one (delta mass: 93.0462 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.123,"smiles":null,"spectrum_id":"CCMSLIB00017271376","spectrum_index":30928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 37.9551 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.026,"smiles":null,"spectrum_id":"CCMSLIB00017271379","spectrum_index":30929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 145.0201 Da; putative annotation: N/A; putative formula: C5H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.122,"smiles":null,"spectrum_id":"CCMSLIB00017271380","spectrum_index":30930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 60.0214 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.082,"smiles":null,"spectrum_id":"CCMSLIB00017271383","spectrum_index":30931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carbonitrile (delta mass: 53.027 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.087,"smiles":null,"spectrum_id":"CCMSLIB00017271384","spectrum_index":30932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 74.0727 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017271387","spectrum_index":30933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 443.2303 Da; putative annotation: N/A; putative formula: C25H33NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.301,"smiles":null,"spectrum_id":"CCMSLIB00017271390","spectrum_index":30934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amoxicillin (delta mass: 18.0782 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.19,"smiles":null,"spectrum_id":"CCMSLIB00017271391","spectrum_index":30935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gly-Leu (delta mass: 354.0934 Da; putative annotation: N/A; putative formula: C21H22O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.301,"smiles":null,"spectrum_id":"CCMSLIB00017271394","spectrum_index":30936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mannitol (delta mass: 227.1214 Da; putative annotation: N/A; putative formula: C9H17N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.208,"smiles":null,"spectrum_id":"CCMSLIB00017271397","spectrum_index":30937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 12.0037 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.079,"smiles":null,"spectrum_id":"CCMSLIB00017271398","spectrum_index":30938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 216.0935 Da; putative annotation: N/A; putative formula: C9H16N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.141,"smiles":null,"spectrum_id":"CCMSLIB00017271401","spectrum_index":30939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 150.0135 Da; putative annotation: N/A; putative formula: C8H6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.074,"smiles":null,"spectrum_id":"CCMSLIB00017271404","spectrum_index":30940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 226.0847 Da; putative annotation: N/A; putative formula: C4H14N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.134,"smiles":null,"spectrum_id":"CCMSLIB00017271405","spectrum_index":30941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 963.4907 Da; putative annotation: N/A; putative formula: C57H61N11O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1144.56,"smiles":null,"spectrum_id":"CCMSLIB00017271408","spectrum_index":30942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 513.2243 Da; putative annotation: N/A; putative formula: C21H39NO11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":842.493,"smiles":null,"spectrum_id":"CCMSLIB00017271411","spectrum_index":30943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 132.0766 Da; putative annotation: N/A; putative formula: C2H8N6O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.147,"smiles":null,"spectrum_id":"CCMSLIB00017271412","spectrum_index":30944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 257.146 Da; putative annotation: N/A; putative formula: C6H15N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.205,"smiles":null,"spectrum_id":"CCMSLIB00017271415","spectrum_index":30945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP016701 Caffeic acid|(E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid (delta mass: 290.0624 Da; putative annotation: N/A; putative formula: C8H6N10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.112,"smiles":null,"spectrum_id":"CCMSLIB00017271418","spectrum_index":30946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 232.1306 Da; putative annotation: N/A; putative formula: C11H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.196,"smiles":null,"spectrum_id":"CCMSLIB00017271420","spectrum_index":30947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 154.0559 Da; putative annotation: N/A; putative formula: C7H10N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.091,"smiles":null,"spectrum_id":"CCMSLIB00017271422","spectrum_index":30948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 226.1068 Da; putative annotation: N/A; putative formula: C14H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.26,"smiles":null,"spectrum_id":"CCMSLIB00017271425","spectrum_index":30949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 212.1522 Da; putative annotation: N/A; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.249,"smiles":null,"spectrum_id":"CCMSLIB00017271428","spectrum_index":30950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 353.2568 Da; putative annotation: N/A; putative formula: C20H35NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.328,"smiles":null,"spectrum_id":"CCMSLIB00017271431","spectrum_index":30951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 146.0574 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017271432","spectrum_index":30952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 144.1359 Da; putative annotation: N/A; putative formula: C6H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.221,"smiles":null,"spectrum_id":"CCMSLIB00017271435","spectrum_index":30953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 43.9899 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.05,"smiles":null,"spectrum_id":"CCMSLIB00017271437","spectrum_index":30954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.138,"smiles":null,"spectrum_id":"CCMSLIB00017271439","spectrum_index":30955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.201,"smiles":null,"spectrum_id":"CCMSLIB00017271442","spectrum_index":30956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 320.2726 Da; putative annotation: N/A; putative formula: C21H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.343,"smiles":null,"spectrum_id":"CCMSLIB00017271445","spectrum_index":30957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 198.2548 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.45,"smiles":null,"spectrum_id":"CCMSLIB00017271447","spectrum_index":30958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 545.1955 Da; putative annotation: N/A; putative formula: C18H23N15O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.266,"smiles":null,"spectrum_id":"CCMSLIB00017271449","spectrum_index":30959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 598.3873 Da; putative annotation: N/A; putative formula: C31H51N8O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.458,"smiles":null,"spectrum_id":"CCMSLIB00017271452","spectrum_index":30960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Thienyl)-1H-imidazole (delta mass: 46.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.08,"smiles":null,"spectrum_id":"CCMSLIB00017271454","spectrum_index":30961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-tyrosine (delta mass: 73.052 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.144,"smiles":null,"spectrum_id":"CCMSLIB00017271456","spectrum_index":30962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 433.2162 Da; putative annotation: N/A; putative formula: C22H27N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.286,"smiles":null,"spectrum_id":"CCMSLIB00017271459","spectrum_index":30963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 81.0427 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017271462","spectrum_index":30964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 71.0374 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.161,"smiles":null,"spectrum_id":"CCMSLIB00017271463","spectrum_index":30965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrexone (delta mass: 72.1502 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.32,"smiles":null,"spectrum_id":"CCMSLIB00017271466","spectrum_index":30966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 74.052 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.138,"smiles":null,"spectrum_id":"CCMSLIB00017271469","spectrum_index":30967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5S,6R)-2-[(3R)-1,7-bis(3,4-dihydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 108.0175 Da; putative annotation: N/A; putative formula: CH4N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.24,"smiles":null,"spectrum_id":"CCMSLIB00017271471","spectrum_index":30968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 18.0286 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.04,"smiles":null,"spectrum_id":"CCMSLIB00017271473","spectrum_index":30969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 386.266 Da; putative annotation: N/A; putative formula: C25H40O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.337,"smiles":null,"spectrum_id":"CCMSLIB00017271476","spectrum_index":30970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 71.036 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.133,"smiles":null,"spectrum_id":"CCMSLIB00017271479","spectrum_index":30971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 57.0582 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.155,"smiles":null,"spectrum_id":"CCMSLIB00017271481","spectrum_index":30972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 66.0197 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.086,"smiles":null,"spectrum_id":"CCMSLIB00017271484","spectrum_index":30973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 280.0636 Da; putative annotation: N/A; putative formula: C19H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.146,"smiles":null,"spectrum_id":"CCMSLIB00017271486","spectrum_index":30974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 503.1817 Da; putative annotation: N/A; putative formula: C27H21N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1008.36,"smiles":null,"spectrum_id":"CCMSLIB00017271489","spectrum_index":30975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 158.022 Da; putative annotation: N/A; putative formula: C7H10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.077,"smiles":null,"spectrum_id":"CCMSLIB00017271492","spectrum_index":30976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 90.0318 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.092,"smiles":null,"spectrum_id":"CCMSLIB00017271494","spectrum_index":30977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Pyrimidinylmethanol (delta mass: 10.0097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":121.065,"smiles":null,"spectrum_id":"CCMSLIB00017271497","spectrum_index":30978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 421.1743 Da; putative annotation: N/A; putative formula: C24H28N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.234,"smiles":null,"spectrum_id":"CCMSLIB00017271499","spectrum_index":30979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 401.1535 Da; putative annotation: N/A; putative formula: C20H19N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.234,"smiles":null,"spectrum_id":"CCMSLIB00017271502","spectrum_index":30980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydro-10-phenophosphazinol 10-oxide (delta mass: 102.9993 Da; putative annotation: N/A; putative formula: C3H6NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.052,"smiles":null,"spectrum_id":"CCMSLIB00017271504","spectrum_index":30981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 131.0381 Da; putative annotation: N/A; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.105,"smiles":null,"spectrum_id":"CCMSLIB00017271506","spectrum_index":30982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 118.0487 Da; putative annotation: N/A; putative formula: C2H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.098,"smiles":null,"spectrum_id":"CCMSLIB00017271509","spectrum_index":30983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 168.0265 Da; putative annotation: N/A; putative formula: C4H8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.043,"smiles":null,"spectrum_id":"CCMSLIB00017271511","spectrum_index":30984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 312.1062 Da; putative annotation: N/A; putative formula: C14H21N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.203,"smiles":null,"spectrum_id":"CCMSLIB00017271513","spectrum_index":30985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 647.226 Da; putative annotation: N/A; putative formula: C29H37N5O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.297,"smiles":null,"spectrum_id":"CCMSLIB00017271516","spectrum_index":30986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 146.0648 Da; putative annotation: N/A; putative formula: C10H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.142,"smiles":null,"spectrum_id":"CCMSLIB00017271518","spectrum_index":30987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP022902 D-Sorbitol|Sorbo|(3S,4S,5R)-hexane-1,2,3,4,5,6-hexol (delta mass: 228.2241 Da; putative annotation: N/A; putative formula: C18H28O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.31,"smiles":null,"spectrum_id":"CCMSLIB00017271520","spectrum_index":30988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 45.0554 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.179,"smiles":null,"spectrum_id":"CCMSLIB00017271523","spectrum_index":30989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 371.0557 Da; putative annotation: N/A; putative formula: C18H14NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.206,"smiles":null,"spectrum_id":"CCMSLIB00017271525","spectrum_index":30990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 319.2718 Da; putative annotation: N/A; putative formula: C12H34N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.342,"smiles":null,"spectrum_id":"CCMSLIB00017271527","spectrum_index":30991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 66.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.149,"smiles":null,"spectrum_id":"CCMSLIB00017271530","spectrum_index":30992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 778.45 Da; putative annotation: N/A; putative formula: C40H62N10O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":941.51,"smiles":null,"spectrum_id":"CCMSLIB00017271532","spectrum_index":30993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 218.1099 Da; putative annotation: N/A; putative formula: C9H20N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.222,"smiles":null,"spectrum_id":"CCMSLIB00017271535","spectrum_index":30994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 24.0395 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.128,"smiles":null,"spectrum_id":"CCMSLIB00017271537","spectrum_index":30995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 26.0267 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.124,"smiles":null,"spectrum_id":"CCMSLIB00017271540","spectrum_index":30996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 74.0362 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.195,"smiles":null,"spectrum_id":"CCMSLIB00017271542","spectrum_index":30997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 27.0511 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.2,"smiles":null,"spectrum_id":"CCMSLIB00017271545","spectrum_index":30998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300219 Kopsinine (delta mass: 59.1176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.324,"smiles":null,"spectrum_id":"CCMSLIB00017271547","spectrum_index":30999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 188.193 Da; putative annotation: N/A; putative formula: C15H24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.274,"smiles":null,"spectrum_id":"CCMSLIB00017271549","spectrum_index":31000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zinterol (delta mass: 108.183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.352,"smiles":null,"spectrum_id":"CCMSLIB00017271552","spectrum_index":31001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 70.0098 Da; putative annotation: N/A; putative formula: C2H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.133,"smiles":null,"spectrum_id":"CCMSLIB00017271554","spectrum_index":31002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 182.0415 Da; putative annotation: N/A; putative formula: C9H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.165,"smiles":null,"spectrum_id":"CCMSLIB00017271556","spectrum_index":31003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.17,"smiles":null,"spectrum_id":"CCMSLIB00017271559","spectrum_index":31004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1001.7623 Da; putative annotation: N/A; putative formula: C54H99N9O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1223.86,"smiles":null,"spectrum_id":"CCMSLIB00017271560","spectrum_index":31005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 711.2415 Da; putative annotation: N/A; putative formula: C32H46N3O9PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1055.43,"smiles":null,"spectrum_id":"CCMSLIB00017271563","spectrum_index":31006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 22.075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.097,"smiles":null,"spectrum_id":"CCMSLIB00017271566","spectrum_index":31007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 38.0349 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.115,"smiles":null,"spectrum_id":"CCMSLIB00017271567","spectrum_index":31008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 122.0844 Da; putative annotation: N/A; putative formula: C7H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.171,"smiles":null,"spectrum_id":"CCMSLIB00017271570","spectrum_index":31009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.227,"smiles":null,"spectrum_id":"CCMSLIB00017271572","spectrum_index":31010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 58.0525 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.117,"smiles":null,"spectrum_id":"CCMSLIB00017271574","spectrum_index":31011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 44.0215 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.119,"smiles":null,"spectrum_id":"CCMSLIB00017271577","spectrum_index":31012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 138.0209 Da; putative annotation: N/A; putative formula: CH6N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.16,"smiles":null,"spectrum_id":"CCMSLIB00017271580","spectrum_index":31013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Ethyl-4-piperidinecarboxamide (delta mass: 27.034 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.167,"smiles":null,"spectrum_id":"CCMSLIB00017271582","spectrum_index":31014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084606 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 88.035 Da; putative annotation: N/A; putative formula: C4H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.09,"smiles":null,"spectrum_id":"CCMSLIB00017271585","spectrum_index":31015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C4:0 (delta mass: 28.0304 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.159,"smiles":null,"spectrum_id":"CCMSLIB00017271588","spectrum_index":31016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 117.1718 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.237,"smiles":null,"spectrum_id":"CCMSLIB00017271590","spectrum_index":31017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole-3-acetic acid CollisionEnergy:102040 (delta mass: 68.0622 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.128,"smiles":null,"spectrum_id":"CCMSLIB00017271593","spectrum_index":31018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 147.9569 Da; putative annotation: N/A; putative formula: C4H5PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.064,"smiles":null,"spectrum_id":"CCMSLIB00017271596","spectrum_index":31019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 614.3893 Da; putative annotation: N/A; putative formula: C30H54N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.46,"smiles":null,"spectrum_id":"CCMSLIB00017271598","spectrum_index":31020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2,5-Dihydroxyhexyl)oxolan-2-one (delta mass: 119.094 Da; putative annotation: N/A; putative formula: CH9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.222,"smiles":null,"spectrum_id":"CCMSLIB00017271601","spectrum_index":31021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 25.9309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.101,"smiles":null,"spectrum_id":"CCMSLIB00017271604","spectrum_index":31022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 181.0369 Da; putative annotation: N/A; putative formula: C2H8N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.134,"smiles":null,"spectrum_id":"CCMSLIB00017271607","spectrum_index":31023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1,N1-dimethyl-N2-phenyl-1,2-ethanediamine (delta mass: 71.0738 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.212,"smiles":null,"spectrum_id":"CCMSLIB00017271609","spectrum_index":31024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 67.0785 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017271612","spectrum_index":31025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 280.24 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.364,"smiles":null,"spectrum_id":"CCMSLIB00017271615","spectrum_index":31026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 112.0924 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.2,"smiles":null,"spectrum_id":"CCMSLIB00017271618","spectrum_index":31027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 136.0586 Da; putative annotation: N/A; putative formula: C2H8N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.134,"smiles":null,"spectrum_id":"CCMSLIB00017271620","spectrum_index":31028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 58.1572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.173,"smiles":null,"spectrum_id":"CCMSLIB00017271622","spectrum_index":31029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ328101 Nordeprenyl|Desmethylselegiline|1-phenyl-N-prop-2-ynylpropan-2-amine (delta mass: 321.1019 Da; putative annotation: N/A; putative formula: C20H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.23,"smiles":null,"spectrum_id":"CCMSLIB00017271625","spectrum_index":31030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 81.0431 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.145,"smiles":null,"spectrum_id":"CCMSLIB00017271628","spectrum_index":31031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 211.1208 Da; putative annotation: N/A; putative formula: C11H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.201,"smiles":null,"spectrum_id":"CCMSLIB00017271630","spectrum_index":31032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 113.0843 Da; putative annotation: Massbank:PR311150 Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017271633","spectrum_index":31033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine - 40.0 eV (delta mass: 182.1051 Da; putative annotation: 1-[(Dimethylamino)carbonyl]-3-piperidinecarboxylic acid; putative formula: C9H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.191,"smiles":null,"spectrum_id":"CCMSLIB00017271635","spectrum_index":31034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 395.32 Da; putative annotation: Solasodin; putative formula: C27H41NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1062.55,"smiles":null,"spectrum_id":"CCMSLIB00017271638","spectrum_index":31035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01043 Hexahydrocurcumin (delta mass: 118.0421 Da; putative annotation: 2-Hydroxyacetophenone; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.222,"smiles":null,"spectrum_id":"CCMSLIB00017271640","spectrum_index":31036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 180.0788 Da; putative annotation: Floverine; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.223,"smiles":null,"spectrum_id":"CCMSLIB00017271643","spectrum_index":31037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 83.0372 Da; putative annotation: L-Homoserine lactone; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.113,"smiles":null,"spectrum_id":"CCMSLIB00017271646","spectrum_index":31038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile-Lys (delta mass: 200.1168 Da; putative annotation: Thr-Val; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.346,"smiles":null,"spectrum_id":"CCMSLIB00017271647","spectrum_index":31039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 178.0991 Da; putative annotation: Loliolide; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.18,"smiles":null,"spectrum_id":"CCMSLIB00017271650","spectrum_index":31040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 118.0422 Da; putative annotation: PHENYLACETIC ACID; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.129,"smiles":null,"spectrum_id":"CCMSLIB00017271653","spectrum_index":31041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 270.1004 Da; putative annotation: N/A; putative formula: C15H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.176,"smiles":null,"spectrum_id":"CCMSLIB00017271656","spectrum_index":31042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorobenzyl)-1H-pyrrole-2-carboxamide (delta mass: 86.0189 Da; putative annotation: N/A; putative formula: C4H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.082,"smiles":null,"spectrum_id":"CCMSLIB00017271657","spectrum_index":31043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 92.0253 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017271660","spectrum_index":31044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 936.4506 Da; putative annotation: N/A; putative formula: C49H64N10O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1117.52,"smiles":null,"spectrum_id":"CCMSLIB00017271663","spectrum_index":31045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 45.0063 Da; putative annotation: N/A; putative formula: CH3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.139,"smiles":null,"spectrum_id":"CCMSLIB00017271664","spectrum_index":31046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alline (delta mass: 247.0415 Da; putative annotation: N/A; putative formula: C11H9N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.159,"smiles":null,"spectrum_id":"CCMSLIB00017271667","spectrum_index":31047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 318.2898 Da; putative annotation: N/A; putative formula: C18H34N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.355,"smiles":null,"spectrum_id":"CCMSLIB00017271670","spectrum_index":31048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 66.0105 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.066,"smiles":null,"spectrum_id":"CCMSLIB00017271672","spectrum_index":31049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Nitro-20(S)-camptothecin (delta mass: 18.0166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.12,"smiles":null,"spectrum_id":"CCMSLIB00017271675","spectrum_index":31050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 132.0191 Da; putative annotation: N/A; putative formula: C4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.09,"smiles":null,"spectrum_id":"CCMSLIB00017271677","spectrum_index":31051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 255.2557 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.326,"smiles":null,"spectrum_id":"CCMSLIB00017271680","spectrum_index":31052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 146.1053 Da; putative annotation: N/A; putative formula: C6H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.181,"smiles":null,"spectrum_id":"CCMSLIB00017271682","spectrum_index":31053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 254.1271 Da; putative annotation: N/A; putative formula: C13H22N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.203,"smiles":null,"spectrum_id":"CCMSLIB00017271684","spectrum_index":31054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 18.0031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.083,"smiles":null,"spectrum_id":"CCMSLIB00017271687","spectrum_index":31055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdesmethoxycurcumin (delta mass: 91.0494 Da; putative annotation: N/A; putative formula: H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.161,"smiles":null,"spectrum_id":"CCMSLIB00017271690","spectrum_index":31056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 676.5914 Da; putative annotation: N/A; putative formula: C45H76N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.662,"smiles":null,"spectrum_id":"CCMSLIB00017271693","spectrum_index":31057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 14.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.138,"smiles":null,"spectrum_id":"CCMSLIB00017271694","spectrum_index":31058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 12.0134 Da; putative annotation: N/A; putative formula: N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017271697","spectrum_index":31059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 52.0386 Da; putative annotation: N/A; putative formula: C3H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.172,"smiles":null,"spectrum_id":"CCMSLIB00017271700","spectrum_index":31060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 114.0676 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.148,"smiles":null,"spectrum_id":"CCMSLIB00017271702","spectrum_index":31061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 222.1608 Da; putative annotation: N/A; putative formula: C14H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.242,"smiles":null,"spectrum_id":"CCMSLIB00017271704","spectrum_index":31062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 132.0572 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017271707","spectrum_index":31063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 79.9643 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.028,"smiles":null,"spectrum_id":"CCMSLIB00017271709","spectrum_index":31064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 6.0647 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017271712","spectrum_index":31065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of penicillin g CollisionEnergy:102040 (delta mass: 74.0739 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.18,"smiles":null,"spectrum_id":"CCMSLIB00017271715","spectrum_index":31066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 79.0377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.097,"smiles":null,"spectrum_id":"CCMSLIB00017271717","spectrum_index":31067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 68.0733 Da; putative annotation: N/A; putative formula: C4H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.16,"smiles":null,"spectrum_id":"CCMSLIB00017271719","spectrum_index":31068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C10:0 (delta mass: 70.0781 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.321,"smiles":null,"spectrum_id":"CCMSLIB00017271722","spectrum_index":31069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 209.1254 Da; putative annotation: N/A; putative formula: C5H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.185,"smiles":null,"spectrum_id":"CCMSLIB00017271725","spectrum_index":31070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 131.0936 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.198,"smiles":null,"spectrum_id":"CCMSLIB00017271726","spectrum_index":31071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 48.0144 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.119,"smiles":null,"spectrum_id":"CCMSLIB00017271729","spectrum_index":31072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 46.0046 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.107,"smiles":null,"spectrum_id":"CCMSLIB00017271732","spectrum_index":31073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 305.2559 Da; putative annotation: N/A; putative formula: C20H35NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.327,"smiles":null,"spectrum_id":"CCMSLIB00017271735","spectrum_index":31074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 41.9991 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017271736","spectrum_index":31075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 714.5417 Da; putative annotation: N/A; putative formula: C40H70N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.612,"smiles":null,"spectrum_id":"CCMSLIB00017271739","spectrum_index":31076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxyvarenicline (delta mass: 503.1859 Da; putative annotation: N/A; putative formula: C32H21N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.299,"smiles":null,"spectrum_id":"CCMSLIB00017271742","spectrum_index":31077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 67.0782 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.159,"smiles":null,"spectrum_id":"CCMSLIB00017271743","spectrum_index":31078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 166.0386 Da; putative annotation: N/A; putative formula: C8H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.13,"smiles":null,"spectrum_id":"CCMSLIB00017271746","spectrum_index":31079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 105.0786 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.243,"smiles":null,"spectrum_id":"CCMSLIB00017271749","spectrum_index":31080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 239.0796 Da; putative annotation: N/A; putative formula: C6H10N9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.155,"smiles":null,"spectrum_id":"CCMSLIB00017271750","spectrum_index":31081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 112.0359 Da; putative annotation: N/A; putative formula: C6H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.116,"smiles":null,"spectrum_id":"CCMSLIB00017271753","spectrum_index":31082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 74.035 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.122,"smiles":null,"spectrum_id":"CCMSLIB00017271756","spectrum_index":31083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 42.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.18,"smiles":null,"spectrum_id":"CCMSLIB00017271758","spectrum_index":31084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 240.2446 Da; putative annotation: N/A; putative formula: C16H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.342,"smiles":null,"spectrum_id":"CCMSLIB00017271760","spectrum_index":31085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Ergothioneine (delta mass: 106.0414 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.137,"smiles":null,"spectrum_id":"CCMSLIB00017271763","spectrum_index":31086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Glycolylneuraminic acid (delta mass: 165.0788 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.187,"smiles":null,"spectrum_id":"CCMSLIB00017271765","spectrum_index":31087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 355.1337 Da; putative annotation: N/A; putative formula: C20H22NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.192,"smiles":null,"spectrum_id":"CCMSLIB00017271768","spectrum_index":31088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 656.233 Da; putative annotation: N/A; putative formula: C31H36N4O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1323.46,"smiles":null,"spectrum_id":"CCMSLIB00017271770","spectrum_index":31089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU022001 Labetalol|2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide (delta mass: 41.1816 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.368,"smiles":null,"spectrum_id":"CCMSLIB00017271772","spectrum_index":31090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 524.2451 Da; putative annotation: N/A; putative formula: C20H40N6O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.317,"smiles":null,"spectrum_id":"CCMSLIB00017271775","spectrum_index":31091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 161.1055 Da; putative annotation: N/A; putative formula: C7H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.176,"smiles":null,"spectrum_id":"CCMSLIB00017271776","spectrum_index":31092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 211.2382 Da; putative annotation: N/A; putative formula: C13H29N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.305,"smiles":null,"spectrum_id":"CCMSLIB00017271779","spectrum_index":31093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 156.042 Da; putative annotation: N/A; putative formula: C7H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.102,"smiles":null,"spectrum_id":"CCMSLIB00017271782","spectrum_index":31094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 162.0447 Da; putative annotation: N/A; putative formula: C6H11O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.178,"smiles":null,"spectrum_id":"CCMSLIB00017271784","spectrum_index":31095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 106.0372 Da; putative annotation: N/A; putative formula: C2H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.119,"smiles":null,"spectrum_id":"CCMSLIB00017271786","spectrum_index":31096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Furyl)-4-quinolinecarboxylic acid (delta mass: 77.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.113,"smiles":null,"spectrum_id":"CCMSLIB00017271789","spectrum_index":31097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 188.0804 Da; putative annotation: N/A; putative formula: C12H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.14,"smiles":null,"spectrum_id":"CCMSLIB00017271792","spectrum_index":31098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 336.2679 Da; putative annotation: N/A; putative formula: C22H32N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.354,"smiles":null,"spectrum_id":"CCMSLIB00017271793","spectrum_index":31099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 147.088 Da; putative annotation: N/A; putative formula: C2H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.187,"smiles":null,"spectrum_id":"CCMSLIB00017271796","spectrum_index":31100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 15.8958 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.973,"smiles":null,"spectrum_id":"CCMSLIB00017271799","spectrum_index":31101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 109.0444 Da; putative annotation: N/A; putative formula: C6H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.125,"smiles":null,"spectrum_id":"CCMSLIB00017271802","spectrum_index":31102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Glu (delta mass: 43.006 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.093,"smiles":null,"spectrum_id":"CCMSLIB00017271803","spectrum_index":31103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 152.0588 Da; putative annotation: N/A; putative formula: C7H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.098,"smiles":null,"spectrum_id":"CCMSLIB00017271806","spectrum_index":31104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 254.1031 Da; putative annotation: N/A; putative formula: C8H19N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.19,"smiles":null,"spectrum_id":"CCMSLIB00017271809","spectrum_index":31105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 73.054 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.089,"smiles":null,"spectrum_id":"CCMSLIB00017271811","spectrum_index":31106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1039.6657 Da; putative annotation: N/A; putative formula: C50H85N15O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1261.76,"smiles":null,"spectrum_id":"CCMSLIB00017271813","spectrum_index":31107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 209.0533 Da; putative annotation: N/A; putative formula: C6H11NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.15,"smiles":null,"spectrum_id":"CCMSLIB00017271816","spectrum_index":31108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 158.0365 Da; putative annotation: N/A; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.16,"smiles":null,"spectrum_id":"CCMSLIB00017271819","spectrum_index":31109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 31.0828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.18,"smiles":null,"spectrum_id":"CCMSLIB00017271822","spectrum_index":31110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 375.2295 Da; putative annotation: N/A; putative formula: C17H34N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.3,"smiles":null,"spectrum_id":"CCMSLIB00017271825","spectrum_index":31111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 18.0088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.114,"smiles":null,"spectrum_id":"CCMSLIB00017271827","spectrum_index":31112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 290.8661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.0,"smiles":null,"spectrum_id":"CCMSLIB00017271829","spectrum_index":31113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 102.0317 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.154,"smiles":null,"spectrum_id":"CCMSLIB00017271832","spectrum_index":31114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 22.9903 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.086,"smiles":null,"spectrum_id":"CCMSLIB00017271835","spectrum_index":31115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 236.1056 Da; putative annotation: N/A; putative formula: C6H16N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.202,"smiles":null,"spectrum_id":"CCMSLIB00017271836","spectrum_index":31116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 254.1256 Da; putative annotation: N/A; putative formula: C14H23PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.212,"smiles":null,"spectrum_id":"CCMSLIB00017271839","spectrum_index":31117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 197.0894 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.264,"smiles":null,"spectrum_id":"CCMSLIB00017271842","spectrum_index":31118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 319.1282 Da; putative annotation: N/A; putative formula: C14H17N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.24,"smiles":null,"spectrum_id":"CCMSLIB00017271844","spectrum_index":31119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 219.1792 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.24,"smiles":null,"spectrum_id":"CCMSLIB00017271846","spectrum_index":31120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 50.0336 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.076,"smiles":null,"spectrum_id":"CCMSLIB00017271849","spectrum_index":31121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 186.1002 Da; putative annotation: N/A; putative formula: C8H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.16,"smiles":null,"spectrum_id":"CCMSLIB00017271852","spectrum_index":31122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 470.2875 Da; putative annotation: N/A; putative formula: C25H42O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.374,"smiles":null,"spectrum_id":"CCMSLIB00017271855","spectrum_index":31123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxobenzo[cd]indol-1(2H)-yl)acetic acid (delta mass: 263.1299 Da; putative annotation: N/A; putative formula: C12H18N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.195,"smiles":null,"spectrum_id":"CCMSLIB00017271856","spectrum_index":31124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 374.338 Da; putative annotation: N/A; putative formula: C26H46O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.424,"smiles":null,"spectrum_id":"CCMSLIB00017271859","spectrum_index":31125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 584.2844 Da; putative annotation: N/A; putative formula: C40H41O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":877.434,"smiles":null,"spectrum_id":"CCMSLIB00017271862","spectrum_index":31126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.055,"smiles":null,"spectrum_id":"CCMSLIB00017271863","spectrum_index":31127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-propanoic acid (delta mass: 27.9953 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.082,"smiles":null,"spectrum_id":"CCMSLIB00017271866","spectrum_index":31128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 281.3079 Da; putative annotation: N/A; putative formula: C19H39N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.379,"smiles":null,"spectrum_id":"CCMSLIB00017271869","spectrum_index":31129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclopiazonic acid (delta mass: 122.0395 Da; putative annotation: N/A; putative formula: C6H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.194,"smiles":null,"spectrum_id":"CCMSLIB00017271872","spectrum_index":31130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(1H-Indol-3-yl)ethyl]-N-(4-nitrobenzyl)amine (delta mass: 177.0815 Da; putative annotation: N/A; putative formula: C9H12N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.221,"smiles":null,"spectrum_id":"CCMSLIB00017271875","spectrum_index":31131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 773.7699 Da; putative annotation: N/A; putative formula: C46H95N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1441.0,"smiles":null,"spectrum_id":"CCMSLIB00017271876","spectrum_index":31132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 243.2006 Da; putative annotation: N/A; putative formula: C14H29NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.261,"smiles":null,"spectrum_id":"CCMSLIB00017271879","spectrum_index":31133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 136.0019 Da; putative annotation: N/A; putative formula: C4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.062,"smiles":null,"spectrum_id":"CCMSLIB00017271882","spectrum_index":31134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ac-Asp-Glu (delta mass: 115.027 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.125,"smiles":null,"spectrum_id":"CCMSLIB00017271885","spectrum_index":31135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 267.111 Da; putative annotation: N/A; putative formula: C13H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.213,"smiles":null,"spectrum_id":"CCMSLIB00017271886","spectrum_index":31136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-acetyl-4-hydroxy-1-(2-imidazol-4-ylethyl)-2-(3-methoxyphenyl)-5-oxo-3-pyrrol ine CollisionEnergy:102040 (delta mass: 72.0102 Da; putative annotation: N/A; putative formula: C5N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.155,"smiles":null,"spectrum_id":"CCMSLIB00017271889","spectrum_index":31137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017271892","spectrum_index":31138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 232.106 Da; putative annotation: N/A; putative formula: C9H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.239,"smiles":null,"spectrum_id":"CCMSLIB00017271893","spectrum_index":31139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 295.1232 Da; putative annotation: N/A; putative formula: C4H9N17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.225,"smiles":null,"spectrum_id":"CCMSLIB00017271896","spectrum_index":31140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 502.1839 Da; putative annotation: N/A; putative formula: C26H30O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.338,"smiles":null,"spectrum_id":"CCMSLIB00017271899","spectrum_index":31141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 255.2557 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.316,"smiles":null,"spectrum_id":"CCMSLIB00017271901","spectrum_index":31142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 60.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017271903","spectrum_index":31143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalorphine (delta mass: 44.0287 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.188,"smiles":null,"spectrum_id":"CCMSLIB00017271906","spectrum_index":31144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 72.0218 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.103,"smiles":null,"spectrum_id":"CCMSLIB00017271909","spectrum_index":31145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 139.9502 Da; putative annotation: N/A; putative formula: C4N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.057,"smiles":null,"spectrum_id":"CCMSLIB00017271912","spectrum_index":31146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 28.0273 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.166,"smiles":null,"spectrum_id":"CCMSLIB00017271914","spectrum_index":31147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 225.1217 Da; putative annotation: N/A; putative formula: C9H15N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.203,"smiles":null,"spectrum_id":"CCMSLIB00017271916","spectrum_index":31148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 125.0881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.232,"smiles":null,"spectrum_id":"CCMSLIB00017271919","spectrum_index":31149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 348.1404 Da; putative annotation: N/A; putative formula: C20H28O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.179,"smiles":null,"spectrum_id":"CCMSLIB00017271922","spectrum_index":31150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 72.0356 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.185,"smiles":null,"spectrum_id":"CCMSLIB00017271924","spectrum_index":31151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 744.6394 Da; putative annotation: N/A; putative formula: C47H80N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":966.737,"smiles":null,"spectrum_id":"CCMSLIB00017271926","spectrum_index":31152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 710.8601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":932.957,"smiles":null,"spectrum_id":"CCMSLIB00017271929","spectrum_index":31153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 140.084 Da; putative annotation: N/A; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.149,"smiles":null,"spectrum_id":"CCMSLIB00017271932","spectrum_index":31154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 342.8709 Da; putative annotation: N/A; putative formula: C2H5N3O7S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.973,"smiles":null,"spectrum_id":"CCMSLIB00017271935","spectrum_index":31155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 119.1279 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.187,"smiles":null,"spectrum_id":"CCMSLIB00017271936","spectrum_index":31156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 14.0135 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.089,"smiles":null,"spectrum_id":"CCMSLIB00017271939","spectrum_index":31157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl .beta.-carboline-3-carboxylate (delta mass: 17.1091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.206,"smiles":null,"spectrum_id":"CCMSLIB00017271942","spectrum_index":31158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-glucooctanoic .gamma.-lactone (delta mass: 17.0274 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.103,"smiles":null,"spectrum_id":"CCMSLIB00017271944","spectrum_index":31159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corydine (delta mass: 41.0002 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.17,"smiles":null,"spectrum_id":"CCMSLIB00017271946","spectrum_index":31160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Propanediol (delta mass: 39.083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":116.143,"smiles":null,"spectrum_id":"CCMSLIB00017271949","spectrum_index":31161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 166.0465 Da; putative annotation: N/A; putative formula: C9H12O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.086,"smiles":null,"spectrum_id":"CCMSLIB00017271952","spectrum_index":31162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 54.0463 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.195,"smiles":null,"spectrum_id":"CCMSLIB00017271954","spectrum_index":31163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 112.0556 Da; putative annotation: N/A; putative formula: C5H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.189,"smiles":null,"spectrum_id":"CCMSLIB00017271957","spectrum_index":31164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 39.047 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.086,"smiles":null,"spectrum_id":"CCMSLIB00017271960","spectrum_index":31165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 88.0889 Da; putative annotation: N/A; putative formula: CH8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017271962","spectrum_index":31166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 45.076 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.23,"smiles":null,"spectrum_id":"CCMSLIB00017271964","spectrum_index":31167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 88.0522 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.149,"smiles":null,"spectrum_id":"CCMSLIB00017271967","spectrum_index":31168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 150.0517 Da; putative annotation: N/A; putative formula: C2H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.221,"smiles":null,"spectrum_id":"CCMSLIB00017271970","spectrum_index":31169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 41.0367 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017271971","spectrum_index":31170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 14.4334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017271974","spectrum_index":31171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 326.3547 Da; putative annotation: N/A; putative formula: C18H42N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.394,"smiles":null,"spectrum_id":"CCMSLIB00017271977","spectrum_index":31172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nitro-2,4-quinolinediol (delta mass: 111.2613 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.301,"smiles":null,"spectrum_id":"CCMSLIB00017271979","spectrum_index":31173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 69.0468 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.118,"smiles":null,"spectrum_id":"CCMSLIB00017271981","spectrum_index":31174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 25.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.18,"smiles":null,"spectrum_id":"CCMSLIB00017271984","spectrum_index":31175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-5-methoxybenzaldehyde (delta mass: 157.0521 Da; putative annotation: N/A; putative formula: C10H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.107,"smiles":null,"spectrum_id":"CCMSLIB00017271987","spectrum_index":31176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-uridine (delta mass: 20.501 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.578,"smiles":null,"spectrum_id":"CCMSLIB00017271990","spectrum_index":31177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 146.0577 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.17,"smiles":null,"spectrum_id":"CCMSLIB00017271991","spectrum_index":31178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-7-methoxy-9H-pyrido[3,4-b]indol-8-yl)-2-methyl- (delta mass: 158.071 Da; putative annotation: N/A; putative formula: C7H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.167,"smiles":null,"spectrum_id":"CCMSLIB00017271994","spectrum_index":31179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 84.0643 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017271997","spectrum_index":31180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 86.0557 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.168,"smiles":null,"spectrum_id":"CCMSLIB00017271999","spectrum_index":31181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT106523 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole|2-(4-methyl-1,3-thiazol-5-yl)ethanol (delta mass: 12.0026 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.05,"smiles":null,"spectrum_id":"CCMSLIB00017272001","spectrum_index":31182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 78.9774 Da; putative annotation: N/A; putative formula: H3NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017272004","spectrum_index":31183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-hydroxy-1H-pyrimidin-4-one (delta mass: 105.0443 Da; putative annotation: N/A; putative formula: C4H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.09,"smiles":null,"spectrum_id":"CCMSLIB00017272007","spectrum_index":31184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 341.314 Da; putative annotation: N/A; putative formula: C14H35N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.379,"smiles":null,"spectrum_id":"CCMSLIB00017272009","spectrum_index":31185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 305.0016 Da; putative annotation: N/A; putative formula: C9H7NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.052,"smiles":null,"spectrum_id":"CCMSLIB00017272011","spectrum_index":31186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 74.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.106,"smiles":null,"spectrum_id":"CCMSLIB00017272014","spectrum_index":31187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Gln (delta mass: 111.0324 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.177,"smiles":null,"spectrum_id":"CCMSLIB00017272016","spectrum_index":31188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 169.0741 Da; putative annotation: Hexanoic acid, 5-(acetylamino)-4-oxo-; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.187,"smiles":null,"spectrum_id":"CCMSLIB00017272018","spectrum_index":31189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 176.1043 Da; putative annotation: Tetraethylene glycol; putative formula: C8H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.191,"smiles":null,"spectrum_id":"CCMSLIB00017272021","spectrum_index":31190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 100.0156 Da; putative annotation: METHYLMALONIC ACID; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.096,"smiles":null,"spectrum_id":"CCMSLIB00017272024","spectrum_index":31191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 216.1149 Da; putative annotation: Massbank:NA001274 Pterosin G|(S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-1H-inden-1-one|(2S)-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-2,3-dihydroinden-1-one; putative formula: C14H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.169,"smiles":null,"spectrum_id":"CCMSLIB00017272025","spectrum_index":31192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of 2-Acetyl-5-hydroxy-3-methylphenyl .beta.-D-glucopyranoside (delta mass: 164.0837 Da; putative annotation: \"\"(1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid CollisionEnergy:102040\"\"; putative formula: C10H12O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.207,"smiles":null,"spectrum_id":"CCMSLIB00017272028","spectrum_index":31193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 143.0948 Da; putative annotation: ReSpect:PT102693 L-Carnitine hydrochloride|Vitamin BT|(-)-beta-Hydroxy-gamma-(trimethylammonio)butyrate|Levocarnitine|L-gamma-Trimethyl-beta-hydroxybutyrobetaine|(3R)-3-hydroxy-4-trimethylazaniumylbutanoate; putative formula: C7H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.134,"smiles":null,"spectrum_id":"CCMSLIB00017272031","spectrum_index":31194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 194.0759 Da; putative annotation: N/A; putative formula: C3H10N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.14,"smiles":null,"spectrum_id":"CCMSLIB00017272033","spectrum_index":31195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 68.9437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.03,"smiles":null,"spectrum_id":"CCMSLIB00017272035","spectrum_index":31196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 174.0798 Da; putative annotation: N/A; putative formula: C3H10N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.151,"smiles":null,"spectrum_id":"CCMSLIB00017272038","spectrum_index":31197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 326.1933 Da; putative annotation: N/A; putative formula: C19H26N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.248,"smiles":null,"spectrum_id":"CCMSLIB00017272041","spectrum_index":31198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 53.0266 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.108,"smiles":null,"spectrum_id":"CCMSLIB00017272044","spectrum_index":31199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 88.0889 Da; putative annotation: N/A; putative formula: CH8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.18,"smiles":null,"spectrum_id":"CCMSLIB00017272046","spectrum_index":31200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 153.0096 Da; putative annotation: N/A; putative formula: C3H7NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.101,"smiles":null,"spectrum_id":"CCMSLIB00017272049","spectrum_index":31201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 386.2588 Da; putative annotation: N/A; putative formula: C21H39O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.356,"smiles":null,"spectrum_id":"CCMSLIB00017272051","spectrum_index":31202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 72.0583 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.139,"smiles":null,"spectrum_id":"CCMSLIB00017272054","spectrum_index":31203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 94.0534 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.171,"smiles":null,"spectrum_id":"CCMSLIB00017272057","spectrum_index":31204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 153.0732 Da; putative annotation: N/A; putative formula: C7H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.185,"smiles":null,"spectrum_id":"CCMSLIB00017272059","spectrum_index":31205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4,8-Dimethoxyfuro[2,3-b]quinolin-7-yl)oxy]-3-methylbutane-2,3-diol (delta mass: 18.9658 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.11,"smiles":null,"spectrum_id":"CCMSLIB00017272062","spectrum_index":31206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310796 Aminobutyl benzamide (delta mass: 56.0374 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.171,"smiles":null,"spectrum_id":"CCMSLIB00017272065","spectrum_index":31207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 94.0137 Da; putative annotation: N/A; putative formula: H-2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.061,"smiles":null,"spectrum_id":"CCMSLIB00017272067","spectrum_index":31208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.129,"smiles":null,"spectrum_id":"CCMSLIB00017272070","spectrum_index":31209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Ergothioneine (delta mass: 175.0635 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.159,"smiles":null,"spectrum_id":"CCMSLIB00017272072","spectrum_index":31210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 10.957 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.023,"smiles":null,"spectrum_id":"CCMSLIB00017272075","spectrum_index":31211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 67.0734 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.155,"smiles":null,"spectrum_id":"CCMSLIB00017272077","spectrum_index":31212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 357.1685 Da; putative annotation: N/A; putative formula: C19H23N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.234,"smiles":null,"spectrum_id":"CCMSLIB00017272079","spectrum_index":31213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 464.3308 Da; putative annotation: N/A; putative formula: C32H40N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.436,"smiles":null,"spectrum_id":"CCMSLIB00017272082","spectrum_index":31214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 39.9948 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.097,"smiles":null,"spectrum_id":"CCMSLIB00017272085","spectrum_index":31215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-His (delta mass: 226.1686 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.267,"smiles":null,"spectrum_id":"CCMSLIB00017272087","spectrum_index":31216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 158.032 Da; putative annotation: N/A; putative formula: C7H11PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.171,"smiles":null,"spectrum_id":"CCMSLIB00017272089","spectrum_index":31217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 83.0486 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.12,"smiles":null,"spectrum_id":"CCMSLIB00017272092","spectrum_index":31218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 401.1689 Da; putative annotation: N/A; putative formula: C21H28N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.229,"smiles":null,"spectrum_id":"CCMSLIB00017272094","spectrum_index":31219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 58.0512 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.118,"smiles":null,"spectrum_id":"CCMSLIB00017272097","spectrum_index":31220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 107.0709 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.168,"smiles":null,"spectrum_id":"CCMSLIB00017272100","spectrum_index":31221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 42.045 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017272101","spectrum_index":31222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 318.1829 Da; putative annotation: N/A; putative formula: C19H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.352,"smiles":null,"spectrum_id":"CCMSLIB00017272104","spectrum_index":31223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 106.0467 Da; putative annotation: N/A; putative formula: CH6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.175,"smiles":null,"spectrum_id":"CCMSLIB00017272107","spectrum_index":31224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 121.0183 Da; putative annotation: N/A; putative formula: C5H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.198,"smiles":null,"spectrum_id":"CCMSLIB00017272110","spectrum_index":31225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 29.0239 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.147,"smiles":null,"spectrum_id":"CCMSLIB00017272111","spectrum_index":31226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-6-methoxy-2-methylspiro[3,4-dihydroisoquinoline-1,7'-6H-cyclopenta[g][1,3]benzodioxole]-8'-one (delta mass: 56.0664 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.2,"smiles":null,"spectrum_id":"CCMSLIB00017272114","spectrum_index":31227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 216.1128 Da; putative annotation: N/A; putative formula: C10H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.246,"smiles":null,"spectrum_id":"CCMSLIB00017272117","spectrum_index":31228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine - 40.0 eV (delta mass: 79.3981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.5,"smiles":null,"spectrum_id":"CCMSLIB00017272119","spectrum_index":31229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 293.1474 Da; putative annotation: N/A; putative formula: C12H23NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.202,"smiles":null,"spectrum_id":"CCMSLIB00017272121","spectrum_index":31230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 130.0289 Da; putative annotation: N/A; putative formula: C4H7N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.105,"smiles":null,"spectrum_id":"CCMSLIB00017272124","spectrum_index":31231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 156.0901 Da; putative annotation: N/A; putative formula: C7H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.287,"smiles":null,"spectrum_id":"CCMSLIB00017272127","spectrum_index":31232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Leu-Lys (delta mass: 228.1132 Da; putative annotation: N/A; putative formula: C15H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.337,"smiles":null,"spectrum_id":"CCMSLIB00017272130","spectrum_index":31233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine - 40.0 eV (delta mass: 40.0194 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.07,"smiles":null,"spectrum_id":"CCMSLIB00017272133","spectrum_index":31234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 628.2366 Da; putative annotation: N/A; putative formula: C29H40O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.318,"smiles":null,"spectrum_id":"CCMSLIB00017272134","spectrum_index":31235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 307.7207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.791,"smiles":null,"spectrum_id":"CCMSLIB00017272137","spectrum_index":31236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 84.0417 Da; putative annotation: N/A; putative formula: C2H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.206,"smiles":null,"spectrum_id":"CCMSLIB00017272140","spectrum_index":31237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 123.0085 Da; putative annotation: N/A; putative formula: C2H6NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.262,"smiles":null,"spectrum_id":"CCMSLIB00017272142","spectrum_index":31238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imazaquin (delta mass: 446.3457 Da; putative annotation: N/A; putative formula: C19H38N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.48,"smiles":null,"spectrum_id":"CCMSLIB00017272145","spectrum_index":31239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 303.2618 Da; putative annotation: N/A; putative formula: C14H33N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.359,"smiles":null,"spectrum_id":"CCMSLIB00017272147","spectrum_index":31240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 102.0843 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.359,"smiles":null,"spectrum_id":"CCMSLIB00017272150","spectrum_index":31241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Methoxybenzyl)(2-nitrophenyl)methanamine (delta mass: 22.9466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.07,"smiles":null,"spectrum_id":"CCMSLIB00017272152","spectrum_index":31242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 52.0333 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.114,"smiles":null,"spectrum_id":"CCMSLIB00017272155","spectrum_index":31243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 131.0809 Da; putative annotation: N/A; putative formula: C3H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.183,"smiles":null,"spectrum_id":"CCMSLIB00017272157","spectrum_index":31244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 228.0771 Da; putative annotation: N/A; putative formula: C8H13N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.21,"smiles":null,"spectrum_id":"CCMSLIB00017272160","spectrum_index":31245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 84.0573 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.232,"smiles":null,"spectrum_id":"CCMSLIB00017272162","spectrum_index":31246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 133.0369 Da; putative annotation: N/A; putative formula: C4H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.092,"smiles":null,"spectrum_id":"CCMSLIB00017272165","spectrum_index":31247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 172.0882 Da; putative annotation: N/A; putative formula: C6H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.143,"smiles":null,"spectrum_id":"CCMSLIB00017272167","spectrum_index":31248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 16.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017272170","spectrum_index":31249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 160.0894 Da; putative annotation: N/A; putative formula: C4H12N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.144,"smiles":null,"spectrum_id":"CCMSLIB00017272172","spectrum_index":31250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 418.217 Da; putative annotation: N/A; putative formula: C26H31N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.319,"smiles":null,"spectrum_id":"CCMSLIB00017272175","spectrum_index":31251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 89.0476 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.171,"smiles":null,"spectrum_id":"CCMSLIB00017272177","spectrum_index":31252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 57.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.15,"smiles":null,"spectrum_id":"CCMSLIB00017272180","spectrum_index":31253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 216.1485 Da; putative annotation: N/A; putative formula: C15H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.271,"smiles":null,"spectrum_id":"CCMSLIB00017272182","spectrum_index":31254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 42.0087 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.1,"smiles":null,"spectrum_id":"CCMSLIB00017272185","spectrum_index":31255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE10; MS2Dec (delta mass: 56.0508 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017272187","spectrum_index":31256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 366.0899 Da; putative annotation: N/A; putative formula: C17H14N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.224,"smiles":null,"spectrum_id":"CCMSLIB00017272189","spectrum_index":31257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 43.9792 Da; putative annotation: N/A; putative formula: CHP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.06,"smiles":null,"spectrum_id":"CCMSLIB00017272192","spectrum_index":31258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 35.0402 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.144,"smiles":null,"spectrum_id":"CCMSLIB00017272195","spectrum_index":31259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3S,7E,8R)-7-ethylidene-5-methyl-5,12-diazatetracyclo[9.7.0.0,?.0,?]octadeca-1(11),13,15,17-tetraen-10-one (delta mass: 183.1115 Da; putative annotation: N/A; putative formula: C7H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.292,"smiles":null,"spectrum_id":"CCMSLIB00017272197","spectrum_index":31260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1-octanamine (delta mass: 356.325 Da; putative annotation: N/A; putative formula: C18H40N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.547,"smiles":null,"spectrum_id":"CCMSLIB00017272199","spectrum_index":31261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 122.0583 Da; putative annotation: N/A; putative formula: C5H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.13,"smiles":null,"spectrum_id":"CCMSLIB00017272202","spectrum_index":31262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 64.0311 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.154,"smiles":null,"spectrum_id":"CCMSLIB00017272205","spectrum_index":31263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 18.0085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.157,"smiles":null,"spectrum_id":"CCMSLIB00017272206","spectrum_index":31264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 45.0545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.1,"smiles":null,"spectrum_id":"CCMSLIB00017272209","spectrum_index":31265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 523.3637 Da; putative annotation: N/A; putative formula: C26H54NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.434,"smiles":null,"spectrum_id":"CCMSLIB00017272212","spectrum_index":31266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 59.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017272215","spectrum_index":31267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 43.0423 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.118,"smiles":null,"spectrum_id":"CCMSLIB00017272217","spectrum_index":31268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 144.0401 Da; putative annotation: N/A; putative formula: C10H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.144,"smiles":null,"spectrum_id":"CCMSLIB00017272219","spectrum_index":31269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1137.3958 Da; putative annotation: N/A; putative formula: C45H71NO32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1300.46,"smiles":null,"spectrum_id":"CCMSLIB00017272222","spectrum_index":31270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 63.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.144,"smiles":null,"spectrum_id":"CCMSLIB00017272225","spectrum_index":31271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 656.3577 Da; putative annotation: N/A; putative formula: C31H48N10O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":935.459,"smiles":null,"spectrum_id":"CCMSLIB00017272227","spectrum_index":31272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381340-01!(5E)-heptadeca-5,16-diene-1,2,4-triol (delta mass: 62.0455 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.288,"smiles":null,"spectrum_id":"CCMSLIB00017272229","spectrum_index":31273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017272232","spectrum_index":31274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxyvarenicline, N-trifluoroacetyl- (delta mass: 18.0019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.097,"smiles":null,"spectrum_id":"CCMSLIB00017272235","spectrum_index":31275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 303.3231 Da; putative annotation: N/A; putative formula: C22H41NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.425,"smiles":null,"spectrum_id":"CCMSLIB00017272236","spectrum_index":31276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 159.0386 Da; putative annotation: N/A; putative formula: C5H10N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.125,"smiles":null,"spectrum_id":"CCMSLIB00017272239","spectrum_index":31277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381092-01_C15H20O8_2-Acetyl-5-hydroxy-3-methylphenyl beta-D-glucopyranoside (delta mass: 148.0507 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.174,"smiles":null,"spectrum_id":"CCMSLIB00017272242","spectrum_index":31278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine hydrochloride (delta mass: 45.0548 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.134,"smiles":null,"spectrum_id":"CCMSLIB00017272243","spectrum_index":31279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 150.2336 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.32,"smiles":null,"spectrum_id":"CCMSLIB00017272246","spectrum_index":31280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 9.0228 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.12,"smiles":null,"spectrum_id":"CCMSLIB00017272249","spectrum_index":31281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 55.0688 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.15,"smiles":null,"spectrum_id":"CCMSLIB00017272250","spectrum_index":31282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 364.7027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.763,"smiles":null,"spectrum_id":"CCMSLIB00017272253","spectrum_index":31283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 17.0032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.061,"smiles":null,"spectrum_id":"CCMSLIB00017272256","spectrum_index":31284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 34.0209 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.097,"smiles":null,"spectrum_id":"CCMSLIB00017272257","spectrum_index":31285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fenoterol (delta mass: 144.0426 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.197,"smiles":null,"spectrum_id":"CCMSLIB00017272260","spectrum_index":31286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 337.1533 Da; putative annotation: N/A; putative formula: C18H27NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.224,"smiles":null,"spectrum_id":"CCMSLIB00017272263","spectrum_index":31287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 378.1322 Da; putative annotation: N/A; putative formula: C12H22N6O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.229,"smiles":null,"spectrum_id":"CCMSLIB00017272264","spectrum_index":31288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 46.0122 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.985,"smiles":null,"spectrum_id":"CCMSLIB00017272267","spectrum_index":31289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 51.0099 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.097,"smiles":null,"spectrum_id":"CCMSLIB00017272270","spectrum_index":31290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 135.0354 Da; putative annotation: N/A; putative formula: C4H9NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.168,"smiles":null,"spectrum_id":"CCMSLIB00017272271","spectrum_index":31291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 110.0732 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.248,"smiles":null,"spectrum_id":"CCMSLIB00017272274","spectrum_index":31292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 300.1314 Da; putative annotation: N/A; putative formula: C15H25O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.265,"smiles":null,"spectrum_id":"CCMSLIB00017272277","spectrum_index":31293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 95.0722 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.174,"smiles":null,"spectrum_id":"CCMSLIB00017272278","spectrum_index":31294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 70.062 Da; putative annotation: N/A; putative formula: C2H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.159,"smiles":null,"spectrum_id":"CCMSLIB00017272281","spectrum_index":31295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 228.1475 Da; putative annotation: N/A; putative formula: C11H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.302,"smiles":null,"spectrum_id":"CCMSLIB00017272284","spectrum_index":31296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 181.0723 Da; putative annotation: N/A; putative formula: C5H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.159,"smiles":null,"spectrum_id":"CCMSLIB00017272286","spectrum_index":31297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 63.9948 Da; putative annotation: N/A; putative formula: C4O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.06,"smiles":null,"spectrum_id":"CCMSLIB00017272288","spectrum_index":31298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 38.039 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.119,"smiles":null,"spectrum_id":"CCMSLIB00017272291","spectrum_index":31299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 647.7314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1314.96,"smiles":null,"spectrum_id":"CCMSLIB00017272294","spectrum_index":31300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sialyl Lewis X (delta mass: 78.1966 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.5,"smiles":null,"spectrum_id":"CCMSLIB00017272295","spectrum_index":31301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 41.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.16,"smiles":null,"spectrum_id":"CCMSLIB00017272298","spectrum_index":31302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 16.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017272301","spectrum_index":31303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 248.0533 Da; putative annotation: N/A; putative formula: C9H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.223,"smiles":null,"spectrum_id":"CCMSLIB00017272302","spectrum_index":31304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 158.1094 Da; putative annotation: N/A; putative formula: C12H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.196,"smiles":null,"spectrum_id":"CCMSLIB00017272305","spectrum_index":31305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 66.0104 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017272308","spectrum_index":31306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 28.9995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.086,"smiles":null,"spectrum_id":"CCMSLIB00017272309","spectrum_index":31307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 76.0249 Da; putative annotation: N/A; putative formula: CH4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.2,"smiles":null,"spectrum_id":"CCMSLIB00017272312","spectrum_index":31308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 628.5613 Da; putative annotation: N/A; putative formula: C42H76OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.633,"smiles":null,"spectrum_id":"CCMSLIB00017272315","spectrum_index":31309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 648.5276 Da; putative annotation: N/A; putative formula: C47H68O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.599,"smiles":null,"spectrum_id":"CCMSLIB00017272318","spectrum_index":31310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Coumaric acid (delta mass: 94.0465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.101,"smiles":null,"spectrum_id":"CCMSLIB00017272320","spectrum_index":31311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 304.0845 Da; putative annotation: N/A; putative formula: C18H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.136,"smiles":null,"spectrum_id":"CCMSLIB00017272323","spectrum_index":31312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 43.0535 Da; putative annotation: N/A; putative formula: CH5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.113,"smiles":null,"spectrum_id":"CCMSLIB00017272325","spectrum_index":31313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 468.3085 Da; putative annotation: N/A; putative formula: C26H44O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.4,"smiles":null,"spectrum_id":"CCMSLIB00017272327","spectrum_index":31314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 491.2087 Da; putative annotation: N/A; putative formula: C26H30N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.311,"smiles":null,"spectrum_id":"CCMSLIB00017272330","spectrum_index":31315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.081,"smiles":null,"spectrum_id":"CCMSLIB00017272333","spectrum_index":31316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 193.095 Da; putative annotation: N/A; putative formula: C7H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.219,"smiles":null,"spectrum_id":"CCMSLIB00017272335","spectrum_index":31317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 230.1272 Da; putative annotation: N/A; putative formula: C11H22N2O-1S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.214,"smiles":null,"spectrum_id":"CCMSLIB00017272337","spectrum_index":31318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 18.3667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.5,"smiles":null,"spectrum_id":"CCMSLIB00017272340","spectrum_index":31319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 167.0779 Da; putative annotation: N/A; putative formula: C2H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.117,"smiles":null,"spectrum_id":"CCMSLIB00017272341","spectrum_index":31320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 8.0033 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.152,"smiles":null,"spectrum_id":"CCMSLIB00017272344","spectrum_index":31321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-(1H-Imidazol-4-yl)propyl]-N'-methylthiourea (delta mass: 215.1457 Da; putative annotation: N/A; putative formula: C10H21N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.247,"smiles":null,"spectrum_id":"CCMSLIB00017272346","spectrum_index":31322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 91.042 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.165,"smiles":null,"spectrum_id":"CCMSLIB00017272349","spectrum_index":31323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytidine (delta mass: 278.1859 Da; putative annotation: N/A; putative formula: C13H22N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.279,"smiles":null,"spectrum_id":"CCMSLIB00017272350","spectrum_index":31324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 215.017 Da; putative annotation: N/A; putative formula: C8H10NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.088,"smiles":null,"spectrum_id":"CCMSLIB00017272353","spectrum_index":31325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 271.8189 Da; putative annotation: N/A; putative formula: C3H-2O5P2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.932,"smiles":null,"spectrum_id":"CCMSLIB00017272355","spectrum_index":31326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 11.002 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.093,"smiles":null,"spectrum_id":"CCMSLIB00017272357","spectrum_index":31327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 60.0108 Da; putative annotation: N/A; putative formula: C4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.103,"smiles":null,"spectrum_id":"CCMSLIB00017272359","spectrum_index":31328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 118.0837 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.132,"smiles":null,"spectrum_id":"CCMSLIB00017272362","spectrum_index":31329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 877.6069 Da; putative annotation: N/A; putative formula: C53H83NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1169.71,"smiles":null,"spectrum_id":"CCMSLIB00017272364","spectrum_index":31330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 104.024 Da; putative annotation: N/A; putative formula: C3N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.089,"smiles":null,"spectrum_id":"CCMSLIB00017272367","spectrum_index":31331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 60.0254 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.097,"smiles":null,"spectrum_id":"CCMSLIB00017272369","spectrum_index":31332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 138.0644 Da; putative annotation: N/A; putative formula: C4H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.155,"smiles":null,"spectrum_id":"CCMSLIB00017272371","spectrum_index":31333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU229303 2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP)|2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine|1-methyl-6-phenylimidazo[4,5-b]pyridin-2-amine (delta mass: 92.986 Da; putative annotation: N/A; putative formula: C4H-1NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.099,"smiles":null,"spectrum_id":"CCMSLIB00017272374","spectrum_index":31334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 134.0368 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.128,"smiles":null,"spectrum_id":"CCMSLIB00017272375","spectrum_index":31335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 206.1031 Da; putative annotation: N/A; putative formula: C7H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.144,"smiles":null,"spectrum_id":"CCMSLIB00017272378","spectrum_index":31336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 164.087 Da; putative annotation: N/A; putative formula: C9H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.23,"smiles":null,"spectrum_id":"CCMSLIB00017272380","spectrum_index":31337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[1-(Aminomethyl)cyclopentyl]acetic acid (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017272383","spectrum_index":31338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of lysergol (delta mass: 119.1044 Da; putative annotation: N/A; putative formula: H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.254,"smiles":null,"spectrum_id":"CCMSLIB00017272384","spectrum_index":31339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 162.0683 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.222,"smiles":null,"spectrum_id":"CCMSLIB00017272387","spectrum_index":31340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 313.1167 Da; putative annotation: N/A; putative formula: C17H20N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.187,"smiles":null,"spectrum_id":"CCMSLIB00017272388","spectrum_index":31341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 628.1847 Da; putative annotation: N/A; putative formula: C22H32N10O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.26,"smiles":null,"spectrum_id":"CCMSLIB00017272391","spectrum_index":31342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 138.0637 Da; putative annotation: N/A; putative formula: C4H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.159,"smiles":null,"spectrum_id":"CCMSLIB00017272393","spectrum_index":31343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 92.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.159,"smiles":null,"spectrum_id":"CCMSLIB00017272396","spectrum_index":31344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 337.2003 Da; putative annotation: N/A; putative formula: C17H27N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.35,"smiles":null,"spectrum_id":"CCMSLIB00017272398","spectrum_index":31345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 23.0147 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.086,"smiles":null,"spectrum_id":"CCMSLIB00017272401","spectrum_index":31346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Venalstonine (delta mass: 72.0458 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.237,"smiles":null,"spectrum_id":"CCMSLIB00017272404","spectrum_index":31347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [3-(Acetylamino)phenoxy]acetic acid (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017272405","spectrum_index":31348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 476.4384 Da; putative annotation: N/A; putative formula: C35H56)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1085.71,"smiles":null,"spectrum_id":"CCMSLIB00017272408","spectrum_index":31349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyltapentadol (delta mass: 46.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.211,"smiles":null,"spectrum_id":"CCMSLIB00017272411","spectrum_index":31350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 26.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.102,"smiles":null,"spectrum_id":"CCMSLIB00017272413","spectrum_index":31351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 10.0193 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.121,"smiles":null,"spectrum_id":"CCMSLIB00017272415","spectrum_index":31352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 316.1526 Da; putative annotation: N/A; putative formula: C15H24O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.219,"smiles":null,"spectrum_id":"CCMSLIB00017272418","spectrum_index":31353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 29.0258 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.139,"smiles":null,"spectrum_id":"CCMSLIB00017272421","spectrum_index":31354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E,4E)-5-Phenyl-2,4-pentadienoic acid (delta mass: 89.0841 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.159,"smiles":null,"spectrum_id":"CCMSLIB00017272422","spectrum_index":31355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 170.0004 Da; putative annotation: N/A; putative formula: C10H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.124,"smiles":null,"spectrum_id":"CCMSLIB00017272425","spectrum_index":31356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 38.0168 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.056,"smiles":null,"spectrum_id":"CCMSLIB00017272428","spectrum_index":31357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PYRROLE-2-CARBOXYLIC ACID CollisionEnergy:205060 (delta mass: 39.0283 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.068,"smiles":null,"spectrum_id":"CCMSLIB00017272430","spectrum_index":31358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-3-(4-piperidinyl)-1H-indole (delta mass: 35.0457 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.175,"smiles":null,"spectrum_id":"CCMSLIB00017272432","spectrum_index":31359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 281.2458 Da; putative annotation: N/A; putative formula: C16H31N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.327,"smiles":null,"spectrum_id":"CCMSLIB00017272435","spectrum_index":31360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 231.14 Da; putative annotation: N/A; putative formula: C10H21N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.263,"smiles":null,"spectrum_id":"CCMSLIB00017272438","spectrum_index":31361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 306.1833 Da; putative annotation: N/A; putative formula: C18H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.254,"smiles":null,"spectrum_id":"CCMSLIB00017272440","spectrum_index":31362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 124.0162 Da; putative annotation: 5-Hydroxymethyl-2-furancarboxylic acid; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.055,"smiles":null,"spectrum_id":"CCMSLIB00017272442","spectrum_index":31363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 810.2697 Da; putative annotation: Spectral Match to Maltopentaose from NIST14; putative formula: C30H50O25)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1315.45,"smiles":null,"spectrum_id":"CCMSLIB00017272445","spectrum_index":31364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 92.0109 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017272448","spectrum_index":31365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 101.0479 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.14,"smiles":null,"spectrum_id":"CCMSLIB00017272450","spectrum_index":31366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 18.0147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.064,"smiles":null,"spectrum_id":"CCMSLIB00017272452","spectrum_index":31367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 110.0516 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.175,"smiles":null,"spectrum_id":"CCMSLIB00017272455","spectrum_index":31368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 54.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.066,"smiles":null,"spectrum_id":"CCMSLIB00017272457","spectrum_index":31369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 88.0658 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.334,"smiles":null,"spectrum_id":"CCMSLIB00017272460","spectrum_index":31370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 346.0876 Da; putative annotation: N/A; putative formula: C18H18O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.148,"smiles":null,"spectrum_id":"CCMSLIB00017272462","spectrum_index":31371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 40.0311 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.079,"smiles":null,"spectrum_id":"CCMSLIB00017272465","spectrum_index":31372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 201.121 Da; putative annotation: N/A; putative formula: C10H21NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.27,"smiles":null,"spectrum_id":"CCMSLIB00017272467","spectrum_index":31373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 31.0423 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.107,"smiles":null,"spectrum_id":"CCMSLIB00017272470","spectrum_index":31374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 122.9745 Da; putative annotation: N/A; putative formula: HN3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.071,"smiles":null,"spectrum_id":"CCMSLIB00017272472","spectrum_index":31375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 88.0517 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.201,"smiles":null,"spectrum_id":"CCMSLIB00017272475","spectrum_index":31376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 43.0136 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.069,"smiles":null,"spectrum_id":"CCMSLIB00017272478","spectrum_index":31377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Saccharic acid 1,4-lactone (delta mass: 88.0676 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017272480","spectrum_index":31378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 309.1683 Da; putative annotation: N/A; putative formula: C17H28NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.27,"smiles":null,"spectrum_id":"CCMSLIB00017272482","spectrum_index":31379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 17.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.181,"smiles":null,"spectrum_id":"CCMSLIB00017272485","spectrum_index":31380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 351.2188 Da; putative annotation: N/A; putative formula: C15H33N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.331,"smiles":null,"spectrum_id":"CCMSLIB00017272488","spectrum_index":31381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017272490","spectrum_index":31382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 166.0419 Da; putative annotation: N/A; putative formula: C12H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.102,"smiles":null,"spectrum_id":"CCMSLIB00017272493","spectrum_index":31383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 140.1539 Da; putative annotation: N/A; putative formula: C10H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.241,"smiles":null,"spectrum_id":"CCMSLIB00017272495","spectrum_index":31384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-6-carboxaldehyde (delta mass: 59.04 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017272497","spectrum_index":31385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 114.0501 Da; putative annotation: N/A; putative formula: C6H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.138,"smiles":null,"spectrum_id":"CCMSLIB00017272500","spectrum_index":31386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 200.157 Da; putative annotation: N/A; putative formula: C15H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.222,"smiles":null,"spectrum_id":"CCMSLIB00017272503","spectrum_index":31387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 146.0578 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.144,"smiles":null,"spectrum_id":"CCMSLIB00017272504","spectrum_index":31388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 70.0611 Da; putative annotation: N/A; putative formula: C2H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.126,"smiles":null,"spectrum_id":"CCMSLIB00017272507","spectrum_index":31389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 481.1956 Da; putative annotation: N/A; putative formula: C24H35NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.276,"smiles":null,"spectrum_id":"CCMSLIB00017272510","spectrum_index":31390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 210.1996 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.385,"smiles":null,"spectrum_id":"CCMSLIB00017272512","spectrum_index":31391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU249103 2-Hydroxyquinoline|1H-quinolin-2-one (delta mass: 90.0522 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.112,"smiles":null,"spectrum_id":"CCMSLIB00017272514","spectrum_index":31392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 407.2157 Da; putative annotation: N/A; putative formula: C18H33NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.286,"smiles":null,"spectrum_id":"CCMSLIB00017272517","spectrum_index":31393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311040 Threonylleucine (isomer of 809, 926) (delta mass: 353.1566 Da; putative annotation: N/A; putative formula: C28H19NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.306,"smiles":null,"spectrum_id":"CCMSLIB00017272519","spectrum_index":31394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 161.9916 Da; putative annotation: N/A; putative formula: C5H9P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.057,"smiles":null,"spectrum_id":"CCMSLIB00017272521","spectrum_index":31395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C6:0 (delta mass: 54.0464 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.206,"smiles":null,"spectrum_id":"CCMSLIB00017272524","spectrum_index":31396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 550.1159 Da; putative annotation: N/A; putative formula: C26H22N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.187,"smiles":null,"spectrum_id":"CCMSLIB00017272527","spectrum_index":31397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 66.0455 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.178,"smiles":null,"spectrum_id":"CCMSLIB00017272529","spectrum_index":31398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 178.1178 Da; putative annotation: N/A; putative formula: C12H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.261,"smiles":null,"spectrum_id":"CCMSLIB00017272531","spectrum_index":31399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.086,"smiles":null,"spectrum_id":"CCMSLIB00017272534","spectrum_index":31400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00918 Demethoxycurcumin (delta mass: 228.0999 Da; putative annotation: N/A; putative formula: C11H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.223,"smiles":null,"spectrum_id":"CCMSLIB00017272537","spectrum_index":31401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 469.1437 Da; putative annotation: N/A; putative formula: C20H28N3O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.204,"smiles":null,"spectrum_id":"CCMSLIB00017272538","spectrum_index":31402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 473.0418 Da; putative annotation: N/A; putative formula: C22H19NO5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.128,"smiles":null,"spectrum_id":"CCMSLIB00017272541","spectrum_index":31403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 96.0424 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017272544","spectrum_index":31404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 18.0013 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.151,"smiles":null,"spectrum_id":"CCMSLIB00017272546","spectrum_index":31405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.037,"smiles":null,"spectrum_id":"CCMSLIB00017272548","spectrum_index":31406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imazaquin (delta mass: 412.2057 Da; putative annotation: N/A; putative formula: C16H32N2O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.34,"smiles":null,"spectrum_id":"CCMSLIB00017272551","spectrum_index":31407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 44.0107 Da; putative annotation: N/A; putative formula: C2H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.05,"smiles":null,"spectrum_id":"CCMSLIB00017272553","spectrum_index":31408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 232.0939 Da; putative annotation: N/A; putative formula: C14H18O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.196,"smiles":null,"spectrum_id":"CCMSLIB00017272556","spectrum_index":31409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 89.0651 Da; putative annotation: N/A; putative formula: C7H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.141,"smiles":null,"spectrum_id":"CCMSLIB00017272558","spectrum_index":31410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 164.0944 Da; putative annotation: N/A; putative formula: C3H13N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.181,"smiles":null,"spectrum_id":"CCMSLIB00017272561","spectrum_index":31411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 7.894 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.981,"smiles":null,"spectrum_id":"CCMSLIB00017272564","spectrum_index":31412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 156.1203 Da; putative annotation: N/A; putative formula: C8H17N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.201,"smiles":null,"spectrum_id":"CCMSLIB00017272566","spectrum_index":31413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 348.1328 Da; putative annotation: N/A; putative formula: C10H20N8O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.266,"smiles":null,"spectrum_id":"CCMSLIB00017272569","spectrum_index":31414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 841.6508 Da; putative annotation: N/A; putative formula: C45H87N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1030.8,"smiles":null,"spectrum_id":"CCMSLIB00017272571","spectrum_index":31415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 88.0423 Da; putative annotation: N/A; putative formula: C6H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.196,"smiles":null,"spectrum_id":"CCMSLIB00017272574","spectrum_index":31416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-3-yl)propanenitrile (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.102,"smiles":null,"spectrum_id":"CCMSLIB00017272577","spectrum_index":31417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 62.0524 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.128,"smiles":null,"spectrum_id":"CCMSLIB00017272579","spectrum_index":31418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Pyridine-3-yl)aniline (delta mass: 27.0208 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.113,"smiles":null,"spectrum_id":"CCMSLIB00017272582","spectrum_index":31419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 646.2994 Da; putative annotation: N/A; putative formula: C29H43N8O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":827.37,"smiles":null,"spectrum_id":"CCMSLIB00017272585","spectrum_index":31420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.143,"smiles":null,"spectrum_id":"CCMSLIB00017272587","spectrum_index":31421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 18.0018 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.151,"smiles":null,"spectrum_id":"CCMSLIB00017272589","spectrum_index":31422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[(3,4-dimethoxyphenyl)methyl](4-oxo(3-hydrophthalazinyl))carboxamide CollisionEnergy:205060\"\" (delta mass: 155.0302 Da; putative annotation: N/A; putative formula: CHN9O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.159,"smiles":null,"spectrum_id":"CCMSLIB00017272592","spectrum_index":31423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 29.0363 Da; putative annotation: N/A; putative formula: H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.123,"smiles":null,"spectrum_id":"CCMSLIB00017272593","spectrum_index":31424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dehydro-16-epi-vincamine (delta mass: 18.002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.188,"smiles":null,"spectrum_id":"CCMSLIB00017272596","spectrum_index":31425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,2,3,4-Tetrahydro-9H-carbazol-9-yl)propanohydrazide (delta mass: 165.0023 Da; putative annotation: N/A; putative formula: C2H3N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.162,"smiles":null,"spectrum_id":"CCMSLIB00017272599","spectrum_index":31426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 64.0681 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.144,"smiles":null,"spectrum_id":"CCMSLIB00017272602","spectrum_index":31427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 129.017 Da; putative annotation: N/A; putative formula: C3H3N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.094,"smiles":null,"spectrum_id":"CCMSLIB00017272604","spectrum_index":31428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 79.0385 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.192,"smiles":null,"spectrum_id":"CCMSLIB00017272607","spectrum_index":31429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 84.1948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.27,"smiles":null,"spectrum_id":"CCMSLIB00017272609","spectrum_index":31430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 334.2513 Da; putative annotation: N/A; putative formula: C21H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.375,"smiles":null,"spectrum_id":"CCMSLIB00017272612","spectrum_index":31431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 102.0307 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.111,"smiles":null,"spectrum_id":"CCMSLIB00017272615","spectrum_index":31432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin///(-)-citrinin CollisionEnergy:205060 (delta mass: 379.3288 Da; putative annotation: N/A; putative formula: C17H37N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.42,"smiles":null,"spectrum_id":"CCMSLIB00017272617","spectrum_index":31433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 81.0577 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.16,"smiles":null,"spectrum_id":"CCMSLIB00017272619","spectrum_index":31434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 47.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.122,"smiles":null,"spectrum_id":"CCMSLIB00017272622","spectrum_index":31435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 123.1638 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.266,"smiles":null,"spectrum_id":"CCMSLIB00017272625","spectrum_index":31436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 288.1361 Da; putative annotation: N/A; putative formula: C17H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.191,"smiles":null,"spectrum_id":"CCMSLIB00017272626","spectrum_index":31437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.076,"smiles":null,"spectrum_id":"CCMSLIB00017272629","spectrum_index":31438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(5-fluoropentyl)- (delta mass: 114.0375 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.161,"smiles":null,"spectrum_id":"CCMSLIB00017272632","spectrum_index":31439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 60.0697 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.187,"smiles":null,"spectrum_id":"CCMSLIB00017272634","spectrum_index":31440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 15.9946 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.128,"smiles":null,"spectrum_id":"CCMSLIB00017272636","spectrum_index":31441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 51.0328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.124,"smiles":null,"spectrum_id":"CCMSLIB00017272639","spectrum_index":31442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 45.0214 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.144,"smiles":null,"spectrum_id":"CCMSLIB00017272642","spectrum_index":31443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 229.1941 Da; putative annotation: N/A; putative formula: C15H23N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.271,"smiles":null,"spectrum_id":"CCMSLIB00017272643","spectrum_index":31444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 188.0298 Da; putative annotation: N/A; putative formula: C11H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.168,"smiles":null,"spectrum_id":"CCMSLIB00017272646","spectrum_index":31445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-(1H-Imidazol-4-yl)propyl]-N'-methylthiourea (delta mass: 15.0426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017272649","spectrum_index":31446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 236.1782 Da; putative annotation: N/A; putative formula: C15H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.215,"smiles":null,"spectrum_id":"CCMSLIB00017272651","spectrum_index":31447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCURONOLACTONE (delta mass: 23.9945 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.044,"smiles":null,"spectrum_id":"CCMSLIB00017272653","spectrum_index":31448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 73.0531 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.128,"smiles":null,"spectrum_id":"CCMSLIB00017272656","spectrum_index":31449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 255.1328 Da; putative annotation: N/A; putative formula: C10H17N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.318,"smiles":null,"spectrum_id":"CCMSLIB00017272659","spectrum_index":31450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 118.0641 Da; putative annotation: N/A; putative formula: C6H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.091,"smiles":null,"spectrum_id":"CCMSLIB00017272660","spectrum_index":31451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 63.0105 Da; putative annotation: N/A; putative formula: C4HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017272663","spectrum_index":31452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-2-[(dimethylamino)methyl]phenol (delta mass: 81.0329 Da; putative annotation: N/A; putative formula: C3H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.101,"smiles":null,"spectrum_id":"CCMSLIB00017272666","spectrum_index":31453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 602.3419 Da; putative annotation: N/A; putative formula: C31H57O5P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.446,"smiles":null,"spectrum_id":"CCMSLIB00017272668","spectrum_index":31454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 266.1764 Da; putative annotation: N/A; putative formula: C12H23N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.315,"smiles":null,"spectrum_id":"CCMSLIB00017272671","spectrum_index":31455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 41.0291 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017272673","spectrum_index":31456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 60.0245 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.079,"smiles":null,"spectrum_id":"CCMSLIB00017272676","spectrum_index":31457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 459.2408 Da; putative annotation: N/A; putative formula: C29H33NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.338,"smiles":null,"spectrum_id":"CCMSLIB00017272678","spectrum_index":31458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 172.1256 Da; putative annotation: N/A; putative formula: C13H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.302,"smiles":null,"spectrum_id":"CCMSLIB00017272681","spectrum_index":31459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 356.2218 Da; putative annotation: N/A; putative formula: C20H38O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.292,"smiles":null,"spectrum_id":"CCMSLIB00017272682","spectrum_index":31460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 582.3922 Da; putative annotation: N/A; putative formula: C36H54O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.452,"smiles":null,"spectrum_id":"CCMSLIB00017272685","spectrum_index":31461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Cysteine (delta mass: 72.0208 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.048,"smiles":null,"spectrum_id":"CCMSLIB00017272688","spectrum_index":31462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 212.1741 Da; putative annotation: N/A; putative formula: C9H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.239,"smiles":null,"spectrum_id":"CCMSLIB00017272689","spectrum_index":31463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fluvastatin (delta mass: 125.0805 Da; putative annotation: N/A; putative formula: C3H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.272,"smiles":null,"spectrum_id":"CCMSLIB00017272692","spectrum_index":31464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 38.0157 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017272695","spectrum_index":31465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 176.035 Da; putative annotation: N/A; putative formula: C5H9N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.121,"smiles":null,"spectrum_id":"CCMSLIB00017272697","spectrum_index":31466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 120.094 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.217,"smiles":null,"spectrum_id":"CCMSLIB00017272699","spectrum_index":31467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazole (delta mass: 17.0186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":86.0633,"smiles":null,"spectrum_id":"CCMSLIB00017272702","spectrum_index":31468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 62.0467 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.145,"smiles":null,"spectrum_id":"CCMSLIB00017272705","spectrum_index":31469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 435.0584 Da; putative annotation: N/A; putative formula: C16H14N5O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.085,"smiles":null,"spectrum_id":"CCMSLIB00017272707","spectrum_index":31470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-N-methyl-N-isopropyltryptamine (delta mass: 175.0473 Da; putative annotation: N/A; putative formula: C3HN11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.212,"smiles":null,"spectrum_id":"CCMSLIB00017272710","spectrum_index":31471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 37.9794 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.029,"smiles":null,"spectrum_id":"CCMSLIB00017272712","spectrum_index":31472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 374.1882 Da; putative annotation: N/A; putative formula: C25H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.306,"smiles":null,"spectrum_id":"CCMSLIB00017272715","spectrum_index":31473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 227.9792 Da; putative annotation: N/A; putative formula: C12H5OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.018,"smiles":null,"spectrum_id":"CCMSLIB00017272718","spectrum_index":31474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 236.0678 Da; putative annotation: N/A; putative formula: C6H13N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.138,"smiles":null,"spectrum_id":"CCMSLIB00017272720","spectrum_index":31475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-((7S,7'S)-(hexane-1,6-diylbis(azanediyl))bis(1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalene-10,7-diyl))diacetamide (delta mass: 3.0774 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.5,"smiles":null,"spectrum_id":"CCMSLIB00017272722","spectrum_index":31476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 9.9799 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.033,"smiles":null,"spectrum_id":"CCMSLIB00017272725","spectrum_index":31477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 88.0344 Da; putative annotation: N/A; putative formula: C4H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.121,"smiles":null,"spectrum_id":"CCMSLIB00017272727","spectrum_index":31478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 111.0672 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.154,"smiles":null,"spectrum_id":"CCMSLIB00017272729","spectrum_index":31479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 125.0 Da; putative annotation: N/A; putative formula: CN7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.139,"smiles":null,"spectrum_id":"CCMSLIB00017272732","spectrum_index":31480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 224.178 Da; putative annotation: N/A; putative formula: C14H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.275,"smiles":null,"spectrum_id":"CCMSLIB00017272735","spectrum_index":31481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 325.1009 Da; putative annotation: N/A; putative formula: C11H19NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.198,"smiles":null,"spectrum_id":"CCMSLIB00017272737","spectrum_index":31482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 368.1841 Da; putative annotation: N/A; putative formula: C22H29N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.255,"smiles":null,"spectrum_id":"CCMSLIB00017272739","spectrum_index":31483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1H-Benzimidazol-2-ylsulfanyl)furan--2-carbaldehyde (delta mass: 32.0328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.071,"smiles":null,"spectrum_id":"CCMSLIB00017272742","spectrum_index":31484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 503.2583 Da; putative annotation: N/A; putative formula: C26H33N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.329,"smiles":null,"spectrum_id":"CCMSLIB00017272744","spectrum_index":31485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 146.043 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.102,"smiles":null,"spectrum_id":"CCMSLIB00017272747","spectrum_index":31486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 13.0867 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.22,"smiles":null,"spectrum_id":"CCMSLIB00017272750","spectrum_index":31487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 104.0601 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.146,"smiles":null,"spectrum_id":"CCMSLIB00017272752","spectrum_index":31488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 102.0465 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017272755","spectrum_index":31489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 231.9704 Da; putative annotation: N/A; putative formula: C3H4O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.052,"smiles":null,"spectrum_id":"CCMSLIB00017272757","spectrum_index":31490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 696.3446 Da; putative annotation: N/A; putative formula: C42H56N2O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":851.415,"smiles":null,"spectrum_id":"CCMSLIB00017272759","spectrum_index":31491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 132.0943 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.218,"smiles":null,"spectrum_id":"CCMSLIB00017272762","spectrum_index":31492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 14.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.17,"smiles":null,"spectrum_id":"CCMSLIB00017272765","spectrum_index":31493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 129.0423 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.166,"smiles":null,"spectrum_id":"CCMSLIB00017272767","spectrum_index":31494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 16.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.129,"smiles":null,"spectrum_id":"CCMSLIB00017272769","spectrum_index":31495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 119.0657 Da; putative annotation: N/A; putative formula: C3H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.141,"smiles":null,"spectrum_id":"CCMSLIB00017272772","spectrum_index":31496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 232.1679 Da; putative annotation: N/A; putative formula: C12H24O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.291,"smiles":null,"spectrum_id":"CCMSLIB00017272774","spectrum_index":31497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 149.0689 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.129,"smiles":null,"spectrum_id":"CCMSLIB00017272777","spectrum_index":31498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 171.0468 Da; putative annotation: N/A; putative formula: C6H9N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.122,"smiles":null,"spectrum_id":"CCMSLIB00017272779","spectrum_index":31499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 186.0528 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.118,"smiles":null,"spectrum_id":"CCMSLIB00017272782","spectrum_index":31500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 165.1223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.25,"smiles":null,"spectrum_id":"CCMSLIB00017272785","spectrum_index":31501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 68.0627 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.201,"smiles":null,"spectrum_id":"CCMSLIB00017272787","spectrum_index":31502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 140.059 Da; putative annotation: N/A; putative formula: C6H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.14,"smiles":null,"spectrum_id":"CCMSLIB00017272789","spectrum_index":31503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Formoterol (delta mass: 268.1644 Da; putative annotation: N/A; putative formula: C11H20N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.345,"smiles":null,"spectrum_id":"CCMSLIB00017272792","spectrum_index":31504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 217.0869 Da; putative annotation: N/A; putative formula: C9H16NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.282,"smiles":null,"spectrum_id":"CCMSLIB00017272795","spectrum_index":31505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 128.0624 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.149,"smiles":null,"spectrum_id":"CCMSLIB00017272796","spectrum_index":31506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 635.6397 Da; putative annotation: N/A; putative formula: C35H77N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.737,"smiles":null,"spectrum_id":"CCMSLIB00017272799","spectrum_index":31507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 766.4506 Da; putative annotation: N/A; putative formula: C41H66O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":929.511,"smiles":null,"spectrum_id":"CCMSLIB00017272802","spectrum_index":31508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 150.0945 Da; putative annotation: N/A; putative formula: C10H15O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.213,"smiles":null,"spectrum_id":"CCMSLIB00017272803","spectrum_index":31509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 82.0627 Da; putative annotation: N/A; putative formula: C3H6N4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.133,"smiles":null,"spectrum_id":"CCMSLIB00017272806","spectrum_index":31510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 169.1098 Da; putative annotation: N/A; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.222,"smiles":null,"spectrum_id":"CCMSLIB00017272809","spectrum_index":31511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 115.0641 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.208,"smiles":null,"spectrum_id":"CCMSLIB00017272810","spectrum_index":31512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.16,"smiles":null,"spectrum_id":"CCMSLIB00017272813","spectrum_index":31513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.18,"smiles":null,"spectrum_id":"CCMSLIB00017272816","spectrum_index":31514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 84.048 Da; putative annotation: N/A; putative formula: C5H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.124,"smiles":null,"spectrum_id":"CCMSLIB00017272818","spectrum_index":31515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 106.0418 Da; putative annotation: N/A; putative formula: C7H6O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017272820","spectrum_index":31516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine C (delta mass: 72.0314 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.212,"smiles":null,"spectrum_id":"CCMSLIB00017272823","spectrum_index":31517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 111.053 Da; putative annotation: N/A; putative formula: C3H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.16,"smiles":null,"spectrum_id":"CCMSLIB00017272826","spectrum_index":31518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 548.2818 Da; putative annotation: N/A; putative formula: C23H36N10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":836.405,"smiles":null,"spectrum_id":"CCMSLIB00017272828","spectrum_index":31519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 61.9993 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.09,"smiles":null,"spectrum_id":"CCMSLIB00017272830","spectrum_index":31520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 108.094 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017272833","spectrum_index":31521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 77.0841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.124,"smiles":null,"spectrum_id":"CCMSLIB00017272836","spectrum_index":31522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 239.9825 Da; putative annotation: N/A; putative formula: C9H5O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.05,"smiles":null,"spectrum_id":"CCMSLIB00017272839","spectrum_index":31523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 221.1626 Da; putative annotation: N/A; putative formula: C11H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.353,"smiles":null,"spectrum_id":"CCMSLIB00017272841","spectrum_index":31524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caramboxin (delta mass: 24.0078 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.089,"smiles":null,"spectrum_id":"CCMSLIB00017272844","spectrum_index":31525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 279.2996 Da; putative annotation: N/A; putative formula: C18H37N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.57,"smiles":null,"spectrum_id":"CCMSLIB00017272846","spectrum_index":31526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 188.1199 Da; putative annotation: N/A; putative formula: C13H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.243,"smiles":null,"spectrum_id":"CCMSLIB00017272849","spectrum_index":31527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 256.1884 Da; putative annotation: N/A; putative formula: C12H24N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.312,"smiles":null,"spectrum_id":"CCMSLIB00017272851","spectrum_index":31528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 80.0617 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.231,"smiles":null,"spectrum_id":"CCMSLIB00017272854","spectrum_index":31529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 229.1685 Da; putative annotation: N/A; putative formula: C13H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.255,"smiles":null,"spectrum_id":"CCMSLIB00017272856","spectrum_index":31530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 117.0254 Da; putative annotation: N/A; putative formula: C4H7NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.047,"smiles":null,"spectrum_id":"CCMSLIB00017272859","spectrum_index":31531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 38.0157 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017272861","spectrum_index":31532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 96.9837 Da; putative annotation: N/A; putative formula: C2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.065,"smiles":null,"spectrum_id":"CCMSLIB00017272864","spectrum_index":31533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 200.034 Da; putative annotation: N/A; putative formula: C9H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.14,"smiles":null,"spectrum_id":"CCMSLIB00017272866","spectrum_index":31534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3S)-3-Hydroxyleucine (delta mass: 40.0312 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017272868","spectrum_index":31535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 76.1099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.186,"smiles":null,"spectrum_id":"CCMSLIB00017272871","spectrum_index":31536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 57.0218 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.081,"smiles":null,"spectrum_id":"CCMSLIB00017272874","spectrum_index":31537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 62.0243 Da; putative annotation: N/A; putative formula: C4H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.074,"smiles":null,"spectrum_id":"CCMSLIB00017272875","spectrum_index":31538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 45.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017272878","spectrum_index":31539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 57.0211 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.145,"smiles":null,"spectrum_id":"CCMSLIB00017272881","spectrum_index":31540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 60.0365 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017272884","spectrum_index":31541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 301.2963 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.414,"smiles":null,"spectrum_id":"CCMSLIB00017272885","spectrum_index":31542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 289.1738 Da; putative annotation: N/A; putative formula: C13H28N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.213,"smiles":null,"spectrum_id":"CCMSLIB00017272888","spectrum_index":31543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 94.039 Da; putative annotation: N/A; putative formula: C2H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.214,"smiles":null,"spectrum_id":"CCMSLIB00017272891","spectrum_index":31544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Pyridinyl)ethanol (delta mass: 105.0578 Da; putative annotation: 2-Amino-4-methylphenol; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.133,"smiles":null,"spectrum_id":"CCMSLIB00017272892","spectrum_index":31545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 165.0793 Da; putative annotation: adrenaline - 30.0 eV; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.176,"smiles":null,"spectrum_id":"CCMSLIB00017272895","spectrum_index":31546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 96.0579 Da; putative annotation: 3-Methyl-4-pentenoic acid; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.129,"smiles":null,"spectrum_id":"CCMSLIB00017272898","spectrum_index":31547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 306.0741 Da; putative annotation: Skimmin; putative formula: C15H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.134,"smiles":null,"spectrum_id":"CCMSLIB00017272901","spectrum_index":31548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 224.1162 Da; putative annotation: 3-[5-(2-Methylpropyl)-3,6-dioxopiperazin-2-yl]propanoic acid; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.203,"smiles":null,"spectrum_id":"CCMSLIB00017272904","spectrum_index":31549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 121.0527 Da; putative annotation: 3-Amino-2,3-dihydrobenzoic acid; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017272905","spectrum_index":31550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 172.0937 Da; putative annotation: L-Hydroxyarginine; putative formula: C6H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.19,"smiles":null,"spectrum_id":"CCMSLIB00017272908","spectrum_index":31551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 17.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.216,"smiles":null,"spectrum_id":"CCMSLIB00017272911","spectrum_index":31552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 200.2724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017272912","spectrum_index":31553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 170.0781 Da; putative annotation: N/A; putative formula: C9H16O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.274,"smiles":null,"spectrum_id":"CCMSLIB00017272915","spectrum_index":31554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 209.0682 Da; putative annotation: N/A; putative formula: C4H12N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.207,"smiles":null,"spectrum_id":"CCMSLIB00017272918","spectrum_index":31555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 76.0541 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.223,"smiles":null,"spectrum_id":"CCMSLIB00017272921","spectrum_index":31556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 443.2414 Da; putative annotation: N/A; putative formula: C26H38NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.328,"smiles":null,"spectrum_id":"CCMSLIB00017272922","spectrum_index":31557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 148.9314 Da; putative annotation: N/A; putative formula: CH-1N3O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.013,"smiles":null,"spectrum_id":"CCMSLIB00017272925","spectrum_index":31558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 144.0785 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.186,"smiles":null,"spectrum_id":"CCMSLIB00017272928","spectrum_index":31559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 331.1362 Da; putative annotation: N/A; putative formula: C25H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.234,"smiles":null,"spectrum_id":"CCMSLIB00017272931","spectrum_index":31560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 14.0409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.107,"smiles":null,"spectrum_id":"CCMSLIB00017272932","spectrum_index":31561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 121.0525 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.123,"smiles":null,"spectrum_id":"CCMSLIB00017272935","spectrum_index":31562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 77.0836 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.175,"smiles":null,"spectrum_id":"CCMSLIB00017272938","spectrum_index":31563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1135.8766 Da; putative annotation: N/A; putative formula: C26H63O3P23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1357.97,"smiles":null,"spectrum_id":"CCMSLIB00017272941","spectrum_index":31564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 180.0633 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.175,"smiles":null,"spectrum_id":"CCMSLIB00017272942","spectrum_index":31565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 157.2992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.358,"smiles":null,"spectrum_id":"CCMSLIB00017272945","spectrum_index":31566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 60.0392 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.106,"smiles":null,"spectrum_id":"CCMSLIB00017272948","spectrum_index":31567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylbutanoic acid (delta mass: 72.0568 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.143,"smiles":null,"spectrum_id":"CCMSLIB00017272950","spectrum_index":31568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 584.2261 Da; putative annotation: N/A; putative formula: C24H44N2O8S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.307,"smiles":null,"spectrum_id":"CCMSLIB00017272952","spectrum_index":31569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 282.0789 Da; putative annotation: N/A; putative formula: C11H14N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.16,"smiles":null,"spectrum_id":"CCMSLIB00017272955","spectrum_index":31570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 22-deoxyminiolutelide B (delta mass: 430.194 Da; putative annotation: N/A; putative formula: C24H26N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":919.406,"smiles":null,"spectrum_id":"CCMSLIB00017272958","spectrum_index":31571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 172.1391 Da; putative annotation: N/A; putative formula: C9H20N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.234,"smiles":null,"spectrum_id":"CCMSLIB00017272959","spectrum_index":31572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 118.0742 Da; putative annotation: N/A; putative formula: C4H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.243,"smiles":null,"spectrum_id":"CCMSLIB00017272962","spectrum_index":31573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 339.1796 Da; putative annotation: N/A; putative formula: C16H25N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.255,"smiles":null,"spectrum_id":"CCMSLIB00017272965","spectrum_index":31574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 206.2033 Da; putative annotation: N/A; putative formula: C15H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.295,"smiles":null,"spectrum_id":"CCMSLIB00017272966","spectrum_index":31575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.149,"smiles":null,"spectrum_id":"CCMSLIB00017272969","spectrum_index":31576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 87.0325 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.166,"smiles":null,"spectrum_id":"CCMSLIB00017272972","spectrum_index":31577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 428.2577 Da; putative annotation: N/A; putative formula: C27H32N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.349,"smiles":null,"spectrum_id":"CCMSLIB00017272975","spectrum_index":31578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Channaine (delta mass: 57.9597 Da; putative annotation: N/A; putative formula: CH-1OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.24,"smiles":null,"spectrum_id":"CCMSLIB00017272976","spectrum_index":31579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 336.242 Da; putative annotation: N/A; putative formula: C20H28N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.323,"smiles":null,"spectrum_id":"CCMSLIB00017272979","spectrum_index":31580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 96.1728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.21,"smiles":null,"spectrum_id":"CCMSLIB00017272982","spectrum_index":31581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 220.0953 Da; putative annotation: N/A; putative formula: C10H20OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.182,"smiles":null,"spectrum_id":"CCMSLIB00017272985","spectrum_index":31582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Aminocamptothecin (delta mass: 179.0823 Da; putative annotation: N/A; putative formula: C5H14N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.211,"smiles":null,"spectrum_id":"CCMSLIB00017272988","spectrum_index":31583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 278.2131 Da; putative annotation: N/A; putative formula: C20H26N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":871.489,"smiles":null,"spectrum_id":"CCMSLIB00017272989","spectrum_index":31584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 513.2064 Da; putative annotation: N/A; putative formula: C23H36N3O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.266,"smiles":null,"spectrum_id":"CCMSLIB00017272992","spectrum_index":31585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 260.2162 Da; putative annotation: N/A; putative formula: C11H28N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.402,"smiles":null,"spectrum_id":"CCMSLIB00017272995","spectrum_index":31586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 182.1699 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.356,"smiles":null,"spectrum_id":"CCMSLIB00017272996","spectrum_index":31587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 264.2494 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.435,"smiles":null,"spectrum_id":"CCMSLIB00017272999","spectrum_index":31588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 262.231 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.417,"smiles":null,"spectrum_id":"CCMSLIB00017273002","spectrum_index":31589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 85.1107 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.16,"smiles":null,"spectrum_id":"CCMSLIB00017273003","spectrum_index":31590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 647.4027 Da; putative annotation: N/A; putative formula: C41H53N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.531,"smiles":null,"spectrum_id":"CCMSLIB00017273006","spectrum_index":31591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-C4:0 (delta mass: 140.0838 Da; putative annotation: N/A; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.223,"smiles":null,"spectrum_id":"CCMSLIB00017273009","spectrum_index":31592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 17.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.128,"smiles":null,"spectrum_id":"CCMSLIB00017273010","spectrum_index":31593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 99.0687 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.198,"smiles":null,"spectrum_id":"CCMSLIB00017273013","spectrum_index":31594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 138.1836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.279,"smiles":null,"spectrum_id":"CCMSLIB00017273016","spectrum_index":31595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 135.0795 Da; putative annotation: N/A; putative formula: C7H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.14,"smiles":null,"spectrum_id":"CCMSLIB00017273019","spectrum_index":31596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 179.0775 Da; putative annotation: N/A; putative formula: C3H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.138,"smiles":null,"spectrum_id":"CCMSLIB00017273022","spectrum_index":31597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 347.1484 Da; putative annotation: N/A; putative formula: C17H21N3O5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.235,"smiles":null,"spectrum_id":"CCMSLIB00017273023","spectrum_index":31598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 159.0604 Da; putative annotation: N/A; putative formula: C10H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.116,"smiles":null,"spectrum_id":"CCMSLIB00017273026","spectrum_index":31599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285102 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 183.0564 Da; putative annotation: N/A; putative formula: C7H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.216,"smiles":null,"spectrum_id":"CCMSLIB00017273029","spectrum_index":31600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 298.1557 Da; putative annotation: N/A; putative formula: C19H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.299,"smiles":null,"spectrum_id":"CCMSLIB00017273031","spectrum_index":31601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 92.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.201,"smiles":null,"spectrum_id":"CCMSLIB00017273033","spectrum_index":31602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 184.11 Da; putative annotation: N/A; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.175,"smiles":null,"spectrum_id":"CCMSLIB00017273036","spectrum_index":31603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(4-Ethyl-1-piperazinyl)carbonyl]-1H-indole (delta mass: 115.0724 Da; putative annotation: N/A; putative formula: H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.233,"smiles":null,"spectrum_id":"CCMSLIB00017273039","spectrum_index":31604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1218.5486 Da; putative annotation: N/A; putative formula: C48H82N16O17S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1381.61,"smiles":null,"spectrum_id":"CCMSLIB00017273042","spectrum_index":31605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reticuline (delta mass: 579.2471 Da; putative annotation: N/A; putative formula: C32H37NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":909.417,"smiles":null,"spectrum_id":"CCMSLIB00017273044","spectrum_index":31606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 50.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017273046","spectrum_index":31607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 656.2683 Da; putative annotation: N/A; putative formula: C26H41N8O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":862.349,"smiles":null,"spectrum_id":"CCMSLIB00017273049","spectrum_index":31608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 164.1183 Da; putative annotation: N/A; putative formula: C7H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.177,"smiles":null,"spectrum_id":"CCMSLIB00017273052","spectrum_index":31609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PLATYPHYLLENONE (delta mass: 108.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.212,"smiles":null,"spectrum_id":"CCMSLIB00017273055","spectrum_index":31610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 120.0576 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017273058","spectrum_index":31611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 1283.5906 Da; putative annotation: N/A; putative formula: C87H81NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1464.66,"smiles":null,"spectrum_id":"CCMSLIB00017273061","spectrum_index":31612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 168.0769 Da; putative annotation: N/A; putative formula: C5H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.157,"smiles":null,"spectrum_id":"CCMSLIB00017273062","spectrum_index":31613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 72.0281 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.154,"smiles":null,"spectrum_id":"CCMSLIB00017273065","spectrum_index":31614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Thr (delta mass: 268.2406 Da; putative annotation: N/A; putative formula: C17H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.328,"smiles":null,"spectrum_id":"CCMSLIB00017273068","spectrum_index":31615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 234.1867 Da; putative annotation: N/A; putative formula: C13H22N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.326,"smiles":null,"spectrum_id":"CCMSLIB00017273071","spectrum_index":31616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 148.1161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.223,"smiles":null,"spectrum_id":"CCMSLIB00017273073","spectrum_index":31617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 173.0237 Da; putative annotation: N/A; putative formula: CH3N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.084,"smiles":null,"spectrum_id":"CCMSLIB00017273075","spectrum_index":31618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 501.1505 Da; putative annotation: N/A; putative formula: C23H27N5O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.216,"smiles":null,"spectrum_id":"CCMSLIB00017273078","spectrum_index":31619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 128.0627 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.128,"smiles":null,"spectrum_id":"CCMSLIB00017273081","spectrum_index":31620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 201.1727 Da; putative annotation: N/A; putative formula: C11H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.238,"smiles":null,"spectrum_id":"CCMSLIB00017273083","spectrum_index":31621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis,cis-9,12-Octadecadien-1-ol from NIST14 (delta mass: 92.0473 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.315,"smiles":null,"spectrum_id":"CCMSLIB00017273086","spectrum_index":31622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 140.1022 Da; putative annotation: N/A; putative formula: C9H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.174,"smiles":null,"spectrum_id":"CCMSLIB00017273089","spectrum_index":31623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 42.0217 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.165,"smiles":null,"spectrum_id":"CCMSLIB00017273092","spectrum_index":31624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Fluorophenyl)-N-(4-methoxybenzyl)methanamine (delta mass: 143.0462 Da; putative annotation: N/A; putative formula: C3H5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.175,"smiles":null,"spectrum_id":"CCMSLIB00017273094","spectrum_index":31625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074902 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017273097","spectrum_index":31626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 193.0738 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.171,"smiles":null,"spectrum_id":"CCMSLIB00017273100","spectrum_index":31627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 137.0477 Da; putative annotation: N/A; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.118,"smiles":null,"spectrum_id":"CCMSLIB00017273102","spectrum_index":31628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN - 40.0 eV (delta mass: 81.0182 Da; putative annotation: N/A; putative formula: H-1N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.114,"smiles":null,"spectrum_id":"CCMSLIB00017273104","spectrum_index":31629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 23.0467 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.154,"smiles":null,"spectrum_id":"CCMSLIB00017273107","spectrum_index":31630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrexone (delta mass: 36.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.196,"smiles":null,"spectrum_id":"CCMSLIB00017273110","spectrum_index":31631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 50.0 eV (delta mass: 112.0518 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.154,"smiles":null,"spectrum_id":"CCMSLIB00017273111","spectrum_index":31632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 58.0398 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.199,"smiles":null,"spectrum_id":"CCMSLIB00017273114","spectrum_index":31633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PYRROLE-2-CARBOXYLIC ACID CollisionEnergy:102040 (delta mass: 126.0793 Da; putative annotation: N/A; putative formula: C6H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.119,"smiles":null,"spectrum_id":"CCMSLIB00017273117","spectrum_index":31634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 51.0101 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.102,"smiles":null,"spectrum_id":"CCMSLIB00017273120","spectrum_index":31635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 201.1156 Da; putative annotation: N/A; putative formula: C13H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.265,"smiles":null,"spectrum_id":"CCMSLIB00017273122","spectrum_index":31636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 170.0737 Da; putative annotation: N/A; putative formula: C5H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.16,"smiles":null,"spectrum_id":"CCMSLIB00017273124","spectrum_index":31637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 266.0913 Da; putative annotation: N/A; putative formula: C13H18N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.157,"smiles":null,"spectrum_id":"CCMSLIB00017273127","spectrum_index":31638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 274.0324 Da; putative annotation: N/A; putative formula: C10H10O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.119,"smiles":null,"spectrum_id":"CCMSLIB00017273129","spectrum_index":31639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 603.1996 Da; putative annotation: N/A; putative formula: C37H34NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.27,"smiles":null,"spectrum_id":"CCMSLIB00017273131","spectrum_index":31640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-pyruvic acid (delta mass: 48.9899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.055,"smiles":null,"spectrum_id":"CCMSLIB00017273134","spectrum_index":31641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 1016.5093 Da; putative annotation: N/A; putative formula: C67H75N2OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1345.78,"smiles":null,"spectrum_id":"CCMSLIB00017273137","spectrum_index":31642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.248,"smiles":null,"spectrum_id":"CCMSLIB00017273139","spectrum_index":31643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 827.2842 Da; putative annotation: N/A; putative formula: C48H29N17O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1008.35,"smiles":null,"spectrum_id":"CCMSLIB00017273141","spectrum_index":31644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 131.1014 Da; putative annotation: N/A; putative formula: CH9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.276,"smiles":null,"spectrum_id":"CCMSLIB00017273144","spectrum_index":31645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CLE_291.1026_12.2 (delta mass: 18.0058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.108,"smiles":null,"spectrum_id":"CCMSLIB00017273147","spectrum_index":31646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE (delta mass: 21.9843 Da; putative annotation: N/A; putative formula: C2H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.081,"smiles":null,"spectrum_id":"CCMSLIB00017273148","spectrum_index":31647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 493.3176 Da; putative annotation: N/A; putative formula: C25H52NO2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.388,"smiles":null,"spectrum_id":"CCMSLIB00017273151","spectrum_index":31648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017273154","spectrum_index":31649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 208.0683 Da; putative annotation: N/A; putative formula: C10H14N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.192,"smiles":null,"spectrum_id":"CCMSLIB00017273155","spectrum_index":31650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 65.0618 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.185,"smiles":null,"spectrum_id":"CCMSLIB00017273158","spectrum_index":31651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 65.0631 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.187,"smiles":null,"spectrum_id":"CCMSLIB00017273161","spectrum_index":31652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Difluoromethoxy)-1H-indole-2-carboxylic acid (delta mass: 142.2134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.26,"smiles":null,"spectrum_id":"CCMSLIB00017273164","spectrum_index":31653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 73.0895 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.197,"smiles":null,"spectrum_id":"CCMSLIB00017273166","spectrum_index":31654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 247.1322 Da; putative annotation: N/A; putative formula: C13H17N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.208,"smiles":null,"spectrum_id":"CCMSLIB00017273168","spectrum_index":31655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 98.0004 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.103,"smiles":null,"spectrum_id":"CCMSLIB00017273171","spectrum_index":31656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 736.2734 Da; putative annotation: N/A; putative formula: C34H41N8O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.333,"smiles":null,"spectrum_id":"CCMSLIB00017273174","spectrum_index":31657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 18.0724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.17,"smiles":null,"spectrum_id":"CCMSLIB00017273175","spectrum_index":31658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 44.0258 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.195,"smiles":null,"spectrum_id":"CCMSLIB00017273178","spectrum_index":31659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5S,6R)-2-[(3R)-1,7-bis(3,4-dihydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 80.0565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.279,"smiles":null,"spectrum_id":"CCMSLIB00017273181","spectrum_index":31660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 757.6427 Da; putative annotation: N/A; putative formula: C45H83N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":920.703,"smiles":null,"spectrum_id":"CCMSLIB00017273184","spectrum_index":31661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 7.9687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.044,"smiles":null,"spectrum_id":"CCMSLIB00017273187","spectrum_index":31662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 454.1683 Da; putative annotation: N/A; putative formula: C24H30N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.207,"smiles":null,"spectrum_id":"CCMSLIB00017273188","spectrum_index":31663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 81.0793 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.16,"smiles":null,"spectrum_id":"CCMSLIB00017273191","spectrum_index":31664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 78.0182 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.095,"smiles":null,"spectrum_id":"CCMSLIB00017273194","spectrum_index":31665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 45.0161 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.096,"smiles":null,"spectrum_id":"CCMSLIB00017273195","spectrum_index":31666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 76.0342 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.079,"smiles":null,"spectrum_id":"CCMSLIB00017273198","spectrum_index":31667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 98.0845 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.208,"smiles":null,"spectrum_id":"CCMSLIB00017273201","spectrum_index":31668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 176.1059 Da; putative annotation: N/A; putative formula: C9H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.193,"smiles":null,"spectrum_id":"CCMSLIB00017273204","spectrum_index":31669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 27.0009 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.08,"smiles":null,"spectrum_id":"CCMSLIB00017273207","spectrum_index":31670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 485.1697 Da; putative annotation: N/A; putative formula: C36H24NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1152.4,"smiles":null,"spectrum_id":"CCMSLIB00017273208","spectrum_index":31671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 413.1546 Da; putative annotation: N/A; putative formula: C16H23N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1242.44,"smiles":null,"spectrum_id":"CCMSLIB00017273211","spectrum_index":31672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 74.0731 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.18,"smiles":null,"spectrum_id":"CCMSLIB00017273214","spectrum_index":31673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 625.3455 Da; putative annotation: N/A; putative formula: C45H43N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":952.599,"smiles":null,"spectrum_id":"CCMSLIB00017273216","spectrum_index":31674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 223.0695 Da; putative annotation: N/A; putative formula: C10H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.203,"smiles":null,"spectrum_id":"CCMSLIB00017273219","spectrum_index":31675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 56.0258 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.117,"smiles":null,"spectrum_id":"CCMSLIB00017273222","spectrum_index":31676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spermine (delta mass: 146.037 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.26,"smiles":null,"spectrum_id":"CCMSLIB00017273224","spectrum_index":31677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 27.0477 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.149,"smiles":null,"spectrum_id":"CCMSLIB00017273227","spectrum_index":31678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 12.0359 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.143,"smiles":null,"spectrum_id":"CCMSLIB00017273230","spectrum_index":31679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087703 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 512.5113 Da; putative annotation: N/A; putative formula: C35H64N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.576,"smiles":null,"spectrum_id":"CCMSLIB00017273231","spectrum_index":31680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371605 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 48.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.091,"smiles":null,"spectrum_id":"CCMSLIB00017273234","spectrum_index":31681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 47.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.107,"smiles":null,"spectrum_id":"CCMSLIB00017273237","spectrum_index":31682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 5.0117 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.082,"smiles":null,"spectrum_id":"CCMSLIB00017273240","spectrum_index":31683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paprotrain (delta mass: 32.0359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.138,"smiles":null,"spectrum_id":"CCMSLIB00017273241","spectrum_index":31684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-3,4-dimethyl- (delta mass: 74.045 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.251,"smiles":null,"spectrum_id":"CCMSLIB00017273244","spectrum_index":31685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 75.0478 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.134,"smiles":null,"spectrum_id":"CCMSLIB00017273247","spectrum_index":31686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 49.9757 Da; putative annotation: N/A; putative formula: C3H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.109,"smiles":null,"spectrum_id":"CCMSLIB00017273248","spectrum_index":31687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 627.911 Da; putative annotation: N/A; putative formula: C31H16O-1S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.971,"smiles":null,"spectrum_id":"CCMSLIB00017273251","spectrum_index":31688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 277.6267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.903,"smiles":null,"spectrum_id":"CCMSLIB00017273254","spectrum_index":31689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sterigmatocystin (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.097,"smiles":null,"spectrum_id":"CCMSLIB00017273257","spectrum_index":31690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 79.9766 Da; putative annotation: N/A; putative formula: O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.12,"smiles":null,"spectrum_id":"CCMSLIB00017273258","spectrum_index":31691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-9H-pyrido[2,3-b]indole (AalphaC) (delta mass: 79.0056 Da; putative annotation: N/A; putative formula: C4HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.092,"smiles":null,"spectrum_id":"CCMSLIB00017273261","spectrum_index":31692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 83.0866 Da; putative annotation: N/A; putative formula: C4H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.141,"smiles":null,"spectrum_id":"CCMSLIB00017273264","spectrum_index":31693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 101.9462 Da; putative annotation: N/A; putative formula: H-2N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.07,"smiles":null,"spectrum_id":"CCMSLIB00017273267","spectrum_index":31694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110001 Salbutamol|Albuterol|4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol (delta mass: 192.1212 Da; putative annotation: N/A; putative formula: C6H16N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.281,"smiles":null,"spectrum_id":"CCMSLIB00017273268","spectrum_index":31695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 361.2801 Da; putative annotation: N/A; putative formula: C23H39NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.351,"smiles":null,"spectrum_id":"CCMSLIB00017273271","spectrum_index":31696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 353.2047 Da; putative annotation: N/A; putative formula: C15H31NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.265,"smiles":null,"spectrum_id":"CCMSLIB00017273274","spectrum_index":31697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 700.0593 Da; putative annotation: N/A; putative formula: C34H28N4OS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.156,"smiles":null,"spectrum_id":"CCMSLIB00017273278","spectrum_index":31698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 102.0962 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.152,"smiles":null,"spectrum_id":"CCMSLIB00017273280","spectrum_index":31699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 87.0134 Da; putative annotation: N/A; putative formula: C3H5NS)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.068,"smiles":null,"spectrum_id":"CCMSLIB00017273283","spectrum_index":31700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 5.0098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.05,"smiles":null,"spectrum_id":"CCMSLIB00017273286","spectrum_index":31701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-His (delta mass: 285.1329 Da; putative annotation: N/A; putative formula: C12H19N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.231,"smiles":null,"spectrum_id":"CCMSLIB00017273289","spectrum_index":31702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 210.1989 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017273291","spectrum_index":31703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 45.0215 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.092,"smiles":null,"spectrum_id":"CCMSLIB00017273294","spectrum_index":31704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 88.0157 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017273297","spectrum_index":31705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-yl)-N-(4-methoxyphenyl)acetamide (delta mass: 280.1276 Da; putative annotation: N/A; putative formula: C13H21N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.256,"smiles":null,"spectrum_id":"CCMSLIB00017273300","spectrum_index":31706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 583.3425 Da; putative annotation: N/A; putative formula: C37H41N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.444,"smiles":null,"spectrum_id":"CCMSLIB00017273302","spectrum_index":31707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 194.1664 Da; putative annotation: N/A; putative formula: C13H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.263,"smiles":null,"spectrum_id":"CCMSLIB00017273306","spectrum_index":31708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 336.246 Da; putative annotation: N/A; putative formula: C17H32N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.311,"smiles":null,"spectrum_id":"CCMSLIB00017273309","spectrum_index":31709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 30.0104 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017273312","spectrum_index":31710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 200.1773 Da; putative annotation: N/A; putative formula: C12H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.237,"smiles":null,"spectrum_id":"CCMSLIB00017273315","spectrum_index":31711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 220.0327 Da; putative annotation: N/A; putative formula: C8H13O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.073,"smiles":null,"spectrum_id":"CCMSLIB00017273318","spectrum_index":31712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 166.0474 Da; putative annotation: N/A; putative formula: C5H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.128,"smiles":null,"spectrum_id":"CCMSLIB00017273321","spectrum_index":31713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017273324","spectrum_index":31714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 154.0994 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.201,"smiles":null,"spectrum_id":"CCMSLIB00017273327","spectrum_index":31715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 503.1907 Da; putative annotation: N/A; putative formula: C24H29N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1332.47,"smiles":null,"spectrum_id":"CCMSLIB00017273329","spectrum_index":31716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 70.0413 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017273331","spectrum_index":31717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 52.0677 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.201,"smiles":null,"spectrum_id":"CCMSLIB00017273334","spectrum_index":31718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 221.0983 Da; putative annotation: N/A; putative formula: C11H15N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.17,"smiles":null,"spectrum_id":"CCMSLIB00017273337","spectrum_index":31719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:205060\"\" (delta mass: 189.0986 Da; putative annotation: N/A; putative formula: C12H15NO-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.19,"smiles":null,"spectrum_id":"CCMSLIB00017273340","spectrum_index":31720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam A (delta mass: 14.0176 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.099,"smiles":null,"spectrum_id":"CCMSLIB00017273345","spectrum_index":31721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 482.4852 Da; putative annotation: N/A; putative formula: C35H62)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.545,"smiles":null,"spectrum_id":"CCMSLIB00017273348","spectrum_index":31722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 15.0353 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.107,"smiles":null,"spectrum_id":"CCMSLIB00017273351","spectrum_index":31723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 41.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017273354","spectrum_index":31724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 296.0522 Da; putative annotation: N/A; putative formula: C18H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.112,"smiles":null,"spectrum_id":"CCMSLIB00017273358","spectrum_index":31725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 116.0423 Da; putative annotation: N/A; putative formula: C4H8N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.118,"smiles":null,"spectrum_id":"CCMSLIB00017273361","spectrum_index":31726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 65.0274 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.093,"smiles":null,"spectrum_id":"CCMSLIB00017273363","spectrum_index":31727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 52.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.092,"smiles":null,"spectrum_id":"CCMSLIB00017273366","spectrum_index":31728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 115.0502 Da; putative annotation: N/A; putative formula: C2H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.137,"smiles":null,"spectrum_id":"CCMSLIB00017273369","spectrum_index":31729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 19.014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.074,"smiles":null,"spectrum_id":"CCMSLIB00017273371","spectrum_index":31730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 227.1514 Da; putative annotation: N/A; putative formula: C12H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.248,"smiles":null,"spectrum_id":"CCMSLIB00017273374","spectrum_index":31731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 82.0052 Da; putative annotation: 2,4(3H,5H)-Furandione; putative formula: C4H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.065,"smiles":null,"spectrum_id":"CCMSLIB00017273377","spectrum_index":31732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 113.0837 Da; putative annotation: Massbank:RP002203 L-Norleucine|(2S)-2-azaniumylhexanoate; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017273380","spectrum_index":31733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 97.0525 Da; putative annotation: Pyrrolidine-3-carboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.176,"smiles":null,"spectrum_id":"CCMSLIB00017273382","spectrum_index":31734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 446.0853 Da; putative annotation: Myricitrin; putative formula: C21H18O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.161,"smiles":null,"spectrum_id":"CCMSLIB00017273385","spectrum_index":31735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 236.1058 Da; putative annotation: Phomalone; putative formula: C13H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.218,"smiles":null,"spectrum_id":"CCMSLIB00017273388","spectrum_index":31736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxy-2-[(4-methyl-1-piperazinyl)carbonyl]-1H-indole (delta mass: 100.0409 Da; putative annotation: Massbank:LU134803 Benzimidazole|1H-benzimidazole; putative formula: C7H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.196,"smiles":null,"spectrum_id":"CCMSLIB00017273390","spectrum_index":31737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 122.0516 Da; putative annotation: 2-Fluorophenethyl alcohol; putative formula: C8H7F)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.117,"smiles":null,"spectrum_id":"CCMSLIB00017273393","spectrum_index":31738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 130.0646 Da; putative annotation: 1-Methyl-1H-pyrazolo[3,4-b]pyridin-3-ylamine; putative formula: C7H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.146,"smiles":null,"spectrum_id":"CCMSLIB00017273396","spectrum_index":31739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 289.1529 Da; putative annotation: 2-Quinoxalinecarboxamide, N-tricyclo[3.3.1.1(3,7)]dec-1-yl-; putative formula: C19H19N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.213,"smiles":null,"spectrum_id":"CCMSLIB00017273399","spectrum_index":31740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 85.934 Da; putative annotation: N/A; putative formula: C2H-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.994,"smiles":null,"spectrum_id":"CCMSLIB00017273401","spectrum_index":31741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-Isopropoxy-5-(trifluoromethyl)phenyl]amine (delta mass: 59.0506 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.145,"smiles":null,"spectrum_id":"CCMSLIB00017273404","spectrum_index":31742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 200.0935 Da; putative annotation: N/A; putative formula: C6H13N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.269,"smiles":null,"spectrum_id":"CCMSLIB00017273407","spectrum_index":31743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 218.0944 Da; putative annotation: N/A; putative formula: C13H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.181,"smiles":null,"spectrum_id":"CCMSLIB00017273409","spectrum_index":31744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 522.2655 Da; putative annotation: N/A; putative formula: C28H42O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.388,"smiles":null,"spectrum_id":"CCMSLIB00017273413","spectrum_index":31745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 116.0504 Da; putative annotation: N/A; putative formula: C4H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.126,"smiles":null,"spectrum_id":"CCMSLIB00017273416","spectrum_index":31746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 72.0228 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.109,"smiles":null,"spectrum_id":"CCMSLIB00017273419","spectrum_index":31747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 131.0931 Da; putative annotation: N/A; putative formula: C2H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.163,"smiles":null,"spectrum_id":"CCMSLIB00017273422","spectrum_index":31748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 174.0167 Da; putative annotation: N/A; putative formula: C6H6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.051,"smiles":null,"spectrum_id":"CCMSLIB00017273424","spectrum_index":31749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 116.0255 Da; putative annotation: N/A; putative formula: C2H5N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.117,"smiles":null,"spectrum_id":"CCMSLIB00017273427","spectrum_index":31750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 302.1884 Da; putative annotation: N/A; putative formula: C19H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.312,"smiles":null,"spectrum_id":"CCMSLIB00017273430","spectrum_index":31751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 927.4828 Da; putative annotation: N/A; putative formula: C46H73NO18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1108.55,"smiles":null,"spectrum_id":"CCMSLIB00017273433","spectrum_index":31752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 737.3987 Da; putative annotation: N/A; putative formula: C38H59NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.485,"smiles":null,"spectrum_id":"CCMSLIB00017273436","spectrum_index":31753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Peniprequinolone (delta mass: 14.0194 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.2,"smiles":null,"spectrum_id":"CCMSLIB00017273440","spectrum_index":31754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-aminovaleric acid betaine (delta mass: 81.968 Da; putative annotation: N/A; putative formula: C3H-2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.101,"smiles":null,"spectrum_id":"CCMSLIB00017273443","spectrum_index":31755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 238.0608 Da; putative annotation: N/A; putative formula: C8H15O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.148,"smiles":null,"spectrum_id":"CCMSLIB00017273446","spectrum_index":31756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 147.1624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.27,"smiles":null,"spectrum_id":"CCMSLIB00017273447","spectrum_index":31757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 12.8824 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017273450","spectrum_index":31758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 306.0951 Da; putative annotation: N/A; putative formula: C12H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.219,"smiles":null,"spectrum_id":"CCMSLIB00017273453","spectrum_index":31759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyanomethyl)-1H-indole-2-carboxylic acid (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.076,"smiles":null,"spectrum_id":"CCMSLIB00017273456","spectrum_index":31760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 114.8274 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.93,"smiles":null,"spectrum_id":"CCMSLIB00017273457","spectrum_index":31761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 17.1222 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.159,"smiles":null,"spectrum_id":"CCMSLIB00017273461","spectrum_index":31762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Chloro-1H-indole-2-carbaldehyde (delta mass: 74.0353 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.056,"smiles":null,"spectrum_id":"CCMSLIB00017273463","spectrum_index":31763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 263.1155 Da; putative annotation: N/A; putative formula: C14H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.395,"smiles":null,"spectrum_id":"CCMSLIB00017273466","spectrum_index":31764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 322.1022 Da; putative annotation: N/A; putative formula: C12H22N2O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.214,"smiles":null,"spectrum_id":"CCMSLIB00017273470","spectrum_index":31765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 200.1124 Da; putative annotation: N/A; putative formula: C14H17O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.271,"smiles":null,"spectrum_id":"CCMSLIB00017273473","spectrum_index":31766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 154.1108 Da; putative annotation: N/A; putative formula: C8H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.223,"smiles":null,"spectrum_id":"CCMSLIB00017273476","spectrum_index":31767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 549.2611 Da; putative annotation: N/A; putative formula: C25H43NO10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.358,"smiles":null,"spectrum_id":"CCMSLIB00017273480","spectrum_index":31768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 354.2771 Da; putative annotation: N/A; putative formula: C21H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.337,"smiles":null,"spectrum_id":"CCMSLIB00017273483","spectrum_index":31769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Iodo-L-tyrosine (delta mass: 42.0112 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.989,"smiles":null,"spectrum_id":"CCMSLIB00017273486","spectrum_index":31770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 41.0269 Da; putative annotation: N/A; putative formula: C2H3N)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.082,"smiles":null,"spectrum_id":"CCMSLIB00017273488","spectrum_index":31771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 50.0522 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017273491","spectrum_index":31772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 40.033 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.088,"smiles":null,"spectrum_id":"CCMSLIB00017273495","spectrum_index":31773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 105.0515 Da; putative annotation: N/A; putative formula: C2H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.17,"smiles":null,"spectrum_id":"CCMSLIB00017273498","spectrum_index":31774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimifugin (delta mass: 306.1083 Da; putative annotation: N/A; putative formula: C13H18N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.226,"smiles":null,"spectrum_id":"CCMSLIB00017273501","spectrum_index":31775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 392.2565 Da; putative annotation: N/A; putative formula: C23H36O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.317,"smiles":null,"spectrum_id":"CCMSLIB00017273504","spectrum_index":31776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 18.0066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.15,"smiles":null,"spectrum_id":"CCMSLIB00017273506","spectrum_index":31777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 42.0831 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017273509","spectrum_index":31778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 158.0209 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.128,"smiles":null,"spectrum_id":"CCMSLIB00017273513","spectrum_index":31779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 335.1191 Da; putative annotation: N/A; putative formula: C17H21NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.179,"smiles":null,"spectrum_id":"CCMSLIB00017273516","spectrum_index":31780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 226.4828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.596,"smiles":null,"spectrum_id":"CCMSLIB00017273519","spectrum_index":31781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 876.4353 Da; putative annotation: N/A; putative formula: C40H56N14O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1057.51,"smiles":null,"spectrum_id":"CCMSLIB00017273521","spectrum_index":31782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyomeprazole sulfide (delta mass: 74.0376 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.149,"smiles":null,"spectrum_id":"CCMSLIB00017273524","spectrum_index":31783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 407.1442 Da; putative annotation: N/A; putative formula: C17H21N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.215,"smiles":null,"spectrum_id":"CCMSLIB00017273527","spectrum_index":31784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 603.3979 Da; putative annotation: N/A; putative formula: C44H49N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.469,"smiles":null,"spectrum_id":"CCMSLIB00017273531","spectrum_index":31785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 171.0533 Da; putative annotation: N/A; putative formula: C7H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.25,"smiles":null,"spectrum_id":"CCMSLIB00017273534","spectrum_index":31786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 159.0891 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.191,"smiles":null,"spectrum_id":"CCMSLIB00017273537","spectrum_index":31787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 732.3007 Da; putative annotation: N/A; putative formula: C38H44N4O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":938.382,"smiles":null,"spectrum_id":"CCMSLIB00017273541","spectrum_index":31788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 55.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.15,"smiles":null,"spectrum_id":"CCMSLIB00017273544","spectrum_index":31789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 583.4161 Da; putative annotation: N/A; putative formula: C36H58NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":743.432,"smiles":null,"spectrum_id":"CCMSLIB00017273546","spectrum_index":31790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 74.0519 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.102,"smiles":null,"spectrum_id":"CCMSLIB00017273550","spectrum_index":31791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 18.0093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.081,"smiles":null,"spectrum_id":"CCMSLIB00017273553","spectrum_index":31792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 885.6776 Da; putative annotation: N/A; putative formula: C48H95N5O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1074.83,"smiles":null,"spectrum_id":"CCMSLIB00017273556","spectrum_index":31793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 71.9683 Da; putative annotation: N/A; putative formula: C2H2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.05,"smiles":null,"spectrum_id":"CCMSLIB00017273560","spectrum_index":31794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Phe from NIST14 (delta mass: 148.0706 Da; putative annotation: N/A; putative formula: C2H8N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.189,"smiles":null,"spectrum_id":"CCMSLIB00017273563","spectrum_index":31795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 31.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017273567","spectrum_index":31796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00009 9-methoxy-2,2-dimethyl-6-hydro-2H-pyrano[5,6-c]quinolin-5-one (delta mass: 180.0637 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.176,"smiles":null,"spectrum_id":"CCMSLIB00017273569","spectrum_index":31797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 349.3093 Da; putative annotation: N/A; putative formula: C21H39N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.38,"smiles":null,"spectrum_id":"CCMSLIB00017273572","spectrum_index":31798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 119.0371 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.113,"smiles":null,"spectrum_id":"CCMSLIB00017273576","spectrum_index":31799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 41.015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017273579","spectrum_index":31800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE10; MS2Dec (delta mass: 34.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.15,"smiles":null,"spectrum_id":"CCMSLIB00017273582","spectrum_index":31801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-9H-pyrido[2,3-b]indole (AalphaC) (delta mass: 345.1299 Da; putative annotation: N/A; putative formula: C13H15N9O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.217,"smiles":null,"spectrum_id":"CCMSLIB00017273584","spectrum_index":31802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 292.1161 Da; putative annotation: N/A; putative formula: C7H17N8O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.224,"smiles":null,"spectrum_id":"CCMSLIB00017273588","spectrum_index":31803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 210.1979 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.367,"smiles":null,"spectrum_id":"CCMSLIB00017273591","spectrum_index":31804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 159.0311 Da; putative annotation: N/A; putative formula: C9H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.123,"smiles":null,"spectrum_id":"CCMSLIB00017273594","spectrum_index":31805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(?)-ampicillin - 40.0 eV (delta mass: 192.0896 Da; putative annotation: N/A; putative formula: C10H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.206,"smiles":null,"spectrum_id":"CCMSLIB00017273597","spectrum_index":31806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 29.9994 Da; putative annotation: N/A; putative formula: CH3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.107,"smiles":null,"spectrum_id":"CCMSLIB00017273601","spectrum_index":31807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 47.9192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017273604","spectrum_index":31808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine 6-phosphate (delta mass: 295.1759 Da; putative annotation: N/A; putative formula: C20H25NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.229,"smiles":null,"spectrum_id":"CCMSLIB00017273606","spectrum_index":31809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 107.0754 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.118,"smiles":null,"spectrum_id":"CCMSLIB00017273609","spectrum_index":31810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 104.062 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.106,"smiles":null,"spectrum_id":"CCMSLIB00017273612","spectrum_index":31811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 17.9685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.039,"smiles":null,"spectrum_id":"CCMSLIB00017273615","spectrum_index":31812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 256.1778 Da; putative annotation: N/A; putative formula: C15H29O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.212,"smiles":null,"spectrum_id":"CCMSLIB00017273619","spectrum_index":31813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1071.7284 Da; putative annotation: N/A; putative formula: C60H105N5O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1234.79,"smiles":null,"spectrum_id":"CCMSLIB00017273621","spectrum_index":31814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 299.2047 Da; putative annotation: N/A; putative formula: C23H25NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.281,"smiles":null,"spectrum_id":"CCMSLIB00017273624","spectrum_index":31815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 92.0474 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.253,"smiles":null,"spectrum_id":"CCMSLIB00017273627","spectrum_index":31816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 42.9798 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.028,"smiles":null,"spectrum_id":"CCMSLIB00017273630","spectrum_index":31817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 35.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.134,"smiles":null,"spectrum_id":"CCMSLIB00017273634","spectrum_index":31818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Hydroxy-2-quinoxalinyl)acetone (delta mass: 10.0203 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.102,"smiles":null,"spectrum_id":"CCMSLIB00017273637","spectrum_index":31819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 45.023 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.083,"smiles":null,"spectrum_id":"CCMSLIB00017273639","spectrum_index":31820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.144,"smiles":null,"spectrum_id":"CCMSLIB00017273642","spectrum_index":31821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 68.1085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.174,"smiles":null,"spectrum_id":"CCMSLIB00017273645","spectrum_index":31822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 82.0365 Da; putative annotation: N/A; putative formula: CH2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.101,"smiles":null,"spectrum_id":"CCMSLIB00017273649","spectrum_index":31823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 222.1625 Da; putative annotation: N/A; putative formula: C14H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.199,"smiles":null,"spectrum_id":"CCMSLIB00017273652","spectrum_index":31824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 276.0843 Da; putative annotation: N/A; putative formula: C11H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.213,"smiles":null,"spectrum_id":"CCMSLIB00017273655","spectrum_index":31825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 448.2431 Da; putative annotation: N/A; putative formula: C31H33N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.367,"smiles":null,"spectrum_id":"CCMSLIB00017273659","spectrum_index":31826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-yl] acetate (delta mass: 53.0728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.264,"smiles":null,"spectrum_id":"CCMSLIB00017273662","spectrum_index":31827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 35.0245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.174,"smiles":null,"spectrum_id":"CCMSLIB00017273665","spectrum_index":31828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 17.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.16,"smiles":null,"spectrum_id":"CCMSLIB00017273667","spectrum_index":31829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-1-yl)propanamide (delta mass: 57.0677 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017273670","spectrum_index":31830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 294.2559 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.327,"smiles":null,"spectrum_id":"CCMSLIB00017273673","spectrum_index":31831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 196.0805 Da; putative annotation: N/A; putative formula: C14H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.234,"smiles":null,"spectrum_id":"CCMSLIB00017273677","spectrum_index":31832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 357.2516 Da; putative annotation: N/A; putative formula: C19H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.312,"smiles":null,"spectrum_id":"CCMSLIB00017273680","spectrum_index":31833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Difluoromethoxy)-1H-indole-2-carboxylic acid (delta mass: 33.0294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.076,"smiles":null,"spectrum_id":"CCMSLIB00017273682","spectrum_index":31834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 490.1043 Da; putative annotation: N/A; putative formula: C23H22O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.228,"smiles":null,"spectrum_id":"CCMSLIB00017273685","spectrum_index":31835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(1H)-Quinolinone, 3,4-dihydro-4-hydroxy-3-methoxy-4-(4-methoxyphenyl)- (delta mass: 39.0068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.13,"smiles":null,"spectrum_id":"CCMSLIB00017273688","spectrum_index":31836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 82.0131 Da; putative annotation: N/A; putative formula: C3H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.1,"smiles":null,"spectrum_id":"CCMSLIB00017273692","spectrum_index":31837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 196.2222 Da; putative annotation: N/A; putative formula: C14H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.418,"smiles":null,"spectrum_id":"CCMSLIB00017273695","spectrum_index":31838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 147.0532 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.145,"smiles":null,"spectrum_id":"CCMSLIB00017273698","spectrum_index":31839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 28.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.165,"smiles":null,"spectrum_id":"CCMSLIB00017273700","spectrum_index":31840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 93.0606 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.157,"smiles":null,"spectrum_id":"CCMSLIB00017273703","spectrum_index":31841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 272.0724 Da; putative annotation: N/A; putative formula: C13H20S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.123,"smiles":null,"spectrum_id":"CCMSLIB00017273706","spectrum_index":31842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione (delta mass: 165.0794 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.208,"smiles":null,"spectrum_id":"CCMSLIB00017273709","spectrum_index":31843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 487.314 Da; putative annotation: N/A; putative formula: C25H45NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.385,"smiles":null,"spectrum_id":"CCMSLIB00017273712","spectrum_index":31844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 120.173 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.268,"smiles":null,"spectrum_id":"CCMSLIB00017273714","spectrum_index":31845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,11-Dihydro-16H-benzo[a]carbazole (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.107,"smiles":null,"spectrum_id":"CCMSLIB00017273717","spectrum_index":31846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 112.0166 Da; putative annotation: N/A; putative formula: C5H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.103,"smiles":null,"spectrum_id":"CCMSLIB00017273720","spectrum_index":31847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 197.1769 Da; putative annotation: N/A; putative formula: C12H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.299,"smiles":null,"spectrum_id":"CCMSLIB00017273723","spectrum_index":31848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 623.262 Da; putative annotation: N/A; putative formula: C28H49NO8S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1128.44,"smiles":null,"spectrum_id":"CCMSLIB00017273727","spectrum_index":31849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 60.0178 Da; putative annotation: N/A; putative formula: CH4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.124,"smiles":null,"spectrum_id":"CCMSLIB00017273730","spectrum_index":31850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Pyridinylacetic acid (delta mass: 8.989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.044,"smiles":null,"spectrum_id":"CCMSLIB00017273733","spectrum_index":31851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mannitol (delta mass: 378.0734 Da; putative annotation: N/A; putative formula: C13H18N2O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.16,"smiles":null,"spectrum_id":"CCMSLIB00017273735","spectrum_index":31852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 172.1096 Da; putative annotation: N/A; putative formula: C9H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.263,"smiles":null,"spectrum_id":"CCMSLIB00017273738","spectrum_index":31853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 247.1423 Da; putative annotation: N/A; putative formula: C11H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.213,"smiles":null,"spectrum_id":"CCMSLIB00017273742","spectrum_index":31854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephromopsic acid (delta mass: 14.0142 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.267,"smiles":null,"spectrum_id":"CCMSLIB00017273745","spectrum_index":31855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 53.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.176,"smiles":null,"spectrum_id":"CCMSLIB00017273748","spectrum_index":31856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 72.9886 Da; putative annotation: N/A; putative formula: H-1N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.101,"smiles":null,"spectrum_id":"CCMSLIB00017273752","spectrum_index":31857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Val-Arg (delta mass: 99.0687 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.277,"smiles":null,"spectrum_id":"CCMSLIB00017273755","spectrum_index":31858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 147.1018 Da; putative annotation: N/A; putative formula: C5H13N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.23,"smiles":null,"spectrum_id":"CCMSLIB00017273759","spectrum_index":31859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 128.011 Da; putative annotation: N/A; putative formula: C5H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.091,"smiles":null,"spectrum_id":"CCMSLIB00017273762","spectrum_index":31860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 188.1925 Da; putative annotation: N/A; putative formula: C15H24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.263,"smiles":null,"spectrum_id":"CCMSLIB00017273764","spectrum_index":31861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 453.8782 Da; putative annotation: N/A; putative formula: C10H10N6O-1S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.992,"smiles":null,"spectrum_id":"CCMSLIB00017273767","spectrum_index":31862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 13.0081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.084,"smiles":null,"spectrum_id":"CCMSLIB00017273771","spectrum_index":31863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSAMINE (delta mass: 137.0293 Da; putative annotation: N/A; putative formula: C7H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.116,"smiles":null,"spectrum_id":"CCMSLIB00017273774","spectrum_index":31864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 75.1046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.164,"smiles":null,"spectrum_id":"CCMSLIB00017273778","spectrum_index":31865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 162.1084 Da; putative annotation: N/A; putative formula: CH10N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.284,"smiles":null,"spectrum_id":"CCMSLIB00017273781","spectrum_index":31866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 150.0347 Da; putative annotation: N/A; putative formula: C7H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.105,"smiles":null,"spectrum_id":"CCMSLIB00017273783","spectrum_index":31867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 122.0367 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.107,"smiles":null,"spectrum_id":"CCMSLIB00017273787","spectrum_index":31868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1137.5605 Da; putative annotation: N/A; putative formula: C56H75N13O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1300.62,"smiles":null,"spectrum_id":"CCMSLIB00017273790","spectrum_index":31869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381059-01!5-[5-(3,5-dihydroxydecanoyloxy)-3-hydroxydecanoyl]oxy-3-hydroxydecanoic acid (delta mass: 98.0378 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.432,"smiles":null,"spectrum_id":"CCMSLIB00017273793","spectrum_index":31870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 54.011 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.139,"smiles":null,"spectrum_id":"CCMSLIB00017273795","spectrum_index":31871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 741.5593 Da; putative annotation: N/A; putative formula: C35H71N11O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.708,"smiles":null,"spectrum_id":"CCMSLIB00017273798","spectrum_index":31872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Gly (delta mass: 90.0468 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.165,"smiles":null,"spectrum_id":"CCMSLIB00017273802","spectrum_index":31873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 482.1696 Da; putative annotation: N/A; putative formula: C18H26N8O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.318,"smiles":null,"spectrum_id":"CCMSLIB00017273805","spectrum_index":31874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 16.6899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.766,"smiles":null,"spectrum_id":"CCMSLIB00017273808","spectrum_index":31875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 88.0315 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.128,"smiles":null,"spectrum_id":"CCMSLIB00017273812","spectrum_index":31876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 86.0364 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017273815","spectrum_index":31877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 192.1171 Da; putative annotation: N/A; putative formula: C11H17N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.271,"smiles":null,"spectrum_id":"CCMSLIB00017273818","spectrum_index":31878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 86.0518 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.279,"smiles":null,"spectrum_id":"CCMSLIB00017273819","spectrum_index":31879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 74.0383 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.119,"smiles":null,"spectrum_id":"CCMSLIB00017273822","spectrum_index":31880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 120.9928 Da; putative annotation: N/A; putative formula: C2H4NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.261,"smiles":null,"spectrum_id":"CCMSLIB00017273825","spectrum_index":31881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 454.2889 Da; putative annotation: N/A; putative formula: C18H30N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.36,"smiles":null,"spectrum_id":"CCMSLIB00017273827","spectrum_index":31882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Staurosporine (delta mass: 343.1455 Da; putative annotation: N/A; putative formula: C16H25NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.353,"smiles":null,"spectrum_id":"CCMSLIB00017273830","spectrum_index":31883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 282.2569 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.333,"smiles":null,"spectrum_id":"CCMSLIB00017273833","spectrum_index":31884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corynoline (delta mass: 32.0991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.248,"smiles":null,"spectrum_id":"CCMSLIB00017273836","spectrum_index":31885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 451.1637 Da; putative annotation: N/A; putative formula: C17H31N3O7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.25,"smiles":null,"spectrum_id":"CCMSLIB00017273839","spectrum_index":31886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 60.0228 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.177,"smiles":null,"spectrum_id":"CCMSLIB00017273841","spectrum_index":31887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-carboxypropanoylamino)-3-indol-3-ylpropanoic acid CollisionEnergy:205060 (delta mass: 27.9954 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.109,"smiles":null,"spectrum_id":"CCMSLIB00017273844","spectrum_index":31888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Octopamine from NIST14 (delta mass: 22.8364 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.923,"smiles":null,"spectrum_id":"CCMSLIB00017273846","spectrum_index":31889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Trifluoromethyl)-1H-indole-2-carboxylic acid (delta mass: 97.9531 Da; putative annotation: N/A; putative formula: C3H-1O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.995,"smiles":null,"spectrum_id":"CCMSLIB00017273849","spectrum_index":31890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 85.0516 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.143,"smiles":null,"spectrum_id":"CCMSLIB00017273852","spectrum_index":31891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(4-methoxyphenyl)methanamine (delta mass: 94.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.186,"smiles":null,"spectrum_id":"CCMSLIB00017273855","spectrum_index":31892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 28.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.112,"smiles":null,"spectrum_id":"CCMSLIB00017273857","spectrum_index":31893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 286.1745 Da; putative annotation: N/A; putative formula: C13H27N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.328,"smiles":null,"spectrum_id":"CCMSLIB00017273860","spectrum_index":31894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 44.0259 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017273863","spectrum_index":31895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 350.1534 Da; putative annotation: N/A; putative formula: C23H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.255,"smiles":null,"spectrum_id":"CCMSLIB00017273866","spectrum_index":31896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9H-Xanthene-4-acetic acid, 5,6-dimethyl-9-oxo- (delta mass: 18.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017273869","spectrum_index":31897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 269.0222 Da; putative annotation: N/A; putative formula: C8H7N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.109,"smiles":null,"spectrum_id":"CCMSLIB00017273872","spectrum_index":31898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 23.9967 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.092,"smiles":null,"spectrum_id":"CCMSLIB00017273875","spectrum_index":31899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 120.0924 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.194,"smiles":null,"spectrum_id":"CCMSLIB00017273878","spectrum_index":31900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 36.0565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.226,"smiles":null,"spectrum_id":"CCMSLIB00017273880","spectrum_index":31901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 69.0289 Da; putative annotation: N/A; putative formula: C2H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.094,"smiles":null,"spectrum_id":"CCMSLIB00017273883","spectrum_index":31902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 107.1087 Da; putative annotation: N/A; putative formula: C8H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017273886","spectrum_index":31903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 60.1147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.216,"smiles":null,"spectrum_id":"CCMSLIB00017273889","spectrum_index":31904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 114.1039 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.149,"smiles":null,"spectrum_id":"CCMSLIB00017273892","spectrum_index":31905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 128.0582 Da; putative annotation: L-(+)-glutamine - 30.0 eV; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.129,"smiles":null,"spectrum_id":"CCMSLIB00017273894","spectrum_index":31906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 204.1892 Da; putative annotation: (-)-Isolongifolol; putative formula: C15H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.281,"smiles":null,"spectrum_id":"CCMSLIB00017273897","spectrum_index":31907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 414.0942 Da; putative annotation: afzelin; putative formula: C21H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.223,"smiles":null,"spectrum_id":"CCMSLIB00017273900","spectrum_index":31908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 224.1165 Da; putative annotation: 3-[5-(2-Methylpropyl)-3,6-dioxopiperazin-2-yl]propanoic acid; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.266,"smiles":null,"spectrum_id":"CCMSLIB00017273902","spectrum_index":31909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 286.193 Da; putative annotation: h_266_oxandrolone_m3; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.264,"smiles":null,"spectrum_id":"CCMSLIB00017273904","spectrum_index":31910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 280.0358 Da; putative annotation: 3,8-Dihydroxy-1-methylanthraquinone-2-carboxylic acid; putative formula: C16H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.096,"smiles":null,"spectrum_id":"CCMSLIB00017273907","spectrum_index":31911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Ser (delta mass: 131.0731 Da; putative annotation: .alpha.-Cyclopropyl-3-pyridinemethanol; putative formula: C9H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.202,"smiles":null,"spectrum_id":"CCMSLIB00017273910","spectrum_index":31912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Leu (delta mass: 113.0844 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017273913","spectrum_index":31913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 263.261 Da; putative annotation: Oleamide; putative formula: C18H33N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.488,"smiles":null,"spectrum_id":"CCMSLIB00017273916","spectrum_index":31914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 244.1345 Da; putative annotation: 3-Hexen-1-ol O-.beta.-D-glucopyranoside; putative formula: C12H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.273,"smiles":null,"spectrum_id":"CCMSLIB00017273919","spectrum_index":31915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 252.1108 Da; putative annotation: N/A; putative formula: C12H16N2O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.171,"smiles":null,"spectrum_id":"CCMSLIB00017273921","spectrum_index":31916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 234.2052 Da; putative annotation: N/A; putative formula: C15H26N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.305,"smiles":null,"spectrum_id":"CCMSLIB00017273924","spectrum_index":31917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 99.032 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.129,"smiles":null,"spectrum_id":"CCMSLIB00017273927","spectrum_index":31918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 276.0837 Da; putative annotation: N/A; putative formula: C16H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.233,"smiles":null,"spectrum_id":"CCMSLIB00017273930","spectrum_index":31919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 61.0159 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.149,"smiles":null,"spectrum_id":"CCMSLIB00017273932","spectrum_index":31920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 106.0443 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.12,"smiles":null,"spectrum_id":"CCMSLIB00017273935","spectrum_index":31921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Allylphenoxy)acetic acid (delta mass: 58.0417 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017273938","spectrum_index":31922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 129.0424 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.192,"smiles":null,"spectrum_id":"CCMSLIB00017273941","spectrum_index":31923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine (delta mass: 43.9897 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.139,"smiles":null,"spectrum_id":"CCMSLIB00017273943","spectrum_index":31924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 768.1911 Da; putative annotation: N/A; putative formula: C38H40O13S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.256,"smiles":null,"spectrum_id":"CCMSLIB00017273946","spectrum_index":31925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 50.0162 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.071,"smiles":null,"spectrum_id":"CCMSLIB00017273949","spectrum_index":31926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 106.0887 Da; putative annotation: N/A; putative formula: C7H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.149,"smiles":null,"spectrum_id":"CCMSLIB00017273952","spectrum_index":31927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,5,7,8-Pentamethyl-6-hydroxychroman (delta mass: 74.0372 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.191,"smiles":null,"spectrum_id":"CCMSLIB00017273955","spectrum_index":31928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTITOL (delta mass: 24.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017273957","spectrum_index":31929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-threonine (delta mass: 40.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.128,"smiles":null,"spectrum_id":"CCMSLIB00017273961","spectrum_index":31930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 70.0451 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.132,"smiles":null,"spectrum_id":"CCMSLIB00017273963","spectrum_index":31931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 16.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.102,"smiles":null,"spectrum_id":"CCMSLIB00017273966","spectrum_index":31932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumigaclavine C (delta mass: 45.0217 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.26,"smiles":null,"spectrum_id":"CCMSLIB00017273969","spectrum_index":31933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 82.9425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.029,"smiles":null,"spectrum_id":"CCMSLIB00017273972","spectrum_index":31934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 263.2344 Da; putative annotation: N/A; putative formula: C16H29N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.42,"smiles":null,"spectrum_id":"CCMSLIB00017273975","spectrum_index":31935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 576.2836 Da; putative annotation: N/A; putative formula: C33H40N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":889.427,"smiles":null,"spectrum_id":"CCMSLIB00017273977","spectrum_index":31936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 285.1075 Da; putative annotation: N/A; putative formula: C10H15N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.183,"smiles":null,"spectrum_id":"CCMSLIB00017273980","spectrum_index":31937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 267.0467 Da; putative annotation: N/A; putative formula: C14H9N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.315,"smiles":null,"spectrum_id":"CCMSLIB00017273983","spectrum_index":31938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-mannosamine - 40.0 eV (delta mass: 436.7764 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.874,"smiles":null,"spectrum_id":"CCMSLIB00017273985","spectrum_index":31939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 107.072 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.158,"smiles":null,"spectrum_id":"CCMSLIB00017273988","spectrum_index":31940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 121.1028 Da; putative annotation: N/A; putative formula: C7H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.169,"smiles":null,"spectrum_id":"CCMSLIB00017273990","spectrum_index":31941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatinine - 40.0 eV (delta mass: 17.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":131.091,"smiles":null,"spectrum_id":"CCMSLIB00017273993","spectrum_index":31942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 105.0791 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.181,"smiles":null,"spectrum_id":"CCMSLIB00017273996","spectrum_index":31943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-.alpha.-Cyclohexylglycine (delta mass: 68.0625 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017273999","spectrum_index":31944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 14.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.138,"smiles":null,"spectrum_id":"CCMSLIB00017274002","spectrum_index":31945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 342.2514 Da; putative annotation: N/A; putative formula: C18H34N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.401,"smiles":null,"spectrum_id":"CCMSLIB00017274004","spectrum_index":31946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 168.0423 Da; putative annotation: N/A; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.166,"smiles":null,"spectrum_id":"CCMSLIB00017274007","spectrum_index":31947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 366.1646 Da; putative annotation: N/A; putative formula: C15H30N2O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.319,"smiles":null,"spectrum_id":"CCMSLIB00017274010","spectrum_index":31948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 181.0963 Da; putative annotation: N/A; putative formula: C7H11N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.177,"smiles":null,"spectrum_id":"CCMSLIB00017274013","spectrum_index":31949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 171.1308 Da; putative annotation: N/A; putative formula: C8H18N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.18,"smiles":null,"spectrum_id":"CCMSLIB00017274016","spectrum_index":31950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gabapentin (delta mass: 54.0467 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017274018","spectrum_index":31951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 277.1883 Da; putative annotation: N/A; putative formula: C13H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.259,"smiles":null,"spectrum_id":"CCMSLIB00017274021","spectrum_index":31952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 278.1278 Da; putative annotation: N/A; putative formula: C19H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.287,"smiles":null,"spectrum_id":"CCMSLIB00017274024","spectrum_index":31953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 397.2692 Da; putative annotation: N/A; putative formula: C19H35N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.438,"smiles":null,"spectrum_id":"CCMSLIB00017274026","spectrum_index":31954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 20.0123 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.049,"smiles":null,"spectrum_id":"CCMSLIB00017274028","spectrum_index":31955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 2.424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.5,"smiles":null,"spectrum_id":"CCMSLIB00017274031","spectrum_index":31956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 31.0084 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.112,"smiles":null,"spectrum_id":"CCMSLIB00017274034","spectrum_index":31957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 44.1042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.253,"smiles":null,"spectrum_id":"CCMSLIB00017274035","spectrum_index":31958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 214.1571 Da; putative annotation: N/A; putative formula: C12H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.223,"smiles":null,"spectrum_id":"CCMSLIB00017274038","spectrum_index":31959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017274041","spectrum_index":31960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Trifluoromethyl)-1H-indole-2-carboxylic acid (delta mass: 70.0808 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.123,"smiles":null,"spectrum_id":"CCMSLIB00017274044","spectrum_index":31961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Acetyl-L-serine (delta mass: 112.1256 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.186,"smiles":null,"spectrum_id":"CCMSLIB00017274045","spectrum_index":31962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SODIUM D-GLUCONATE (delta mass: 97.0892 Da; putative annotation: N/A; putative formula: C6H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.155,"smiles":null,"spectrum_id":"CCMSLIB00017274048","spectrum_index":31963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 73.0444 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.146,"smiles":null,"spectrum_id":"CCMSLIB00017274051","spectrum_index":31964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 199.0657 Da; putative annotation: N/A; putative formula: C11H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.105,"smiles":null,"spectrum_id":"CCMSLIB00017274052","spectrum_index":31965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 180.0209 Da; putative annotation: N/A; putative formula: C12H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.056,"smiles":null,"spectrum_id":"CCMSLIB00017274055","spectrum_index":31966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxywarfarin (delta mass: 259.0977 Da; putative annotation: N/A; putative formula: C10H17N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.205,"smiles":null,"spectrum_id":"CCMSLIB00017274058","spectrum_index":31967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 5.0116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.093,"smiles":null,"spectrum_id":"CCMSLIB00017274059","spectrum_index":31968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 52.0319 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.092,"smiles":null,"spectrum_id":"CCMSLIB00017274062","spectrum_index":31969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 476.6612 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":981.838,"smiles":null,"spectrum_id":"CCMSLIB00017274065","spectrum_index":31970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 746.1886 Da; putative annotation: N/A; putative formula: C27H44N2O16P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1413.42,"smiles":null,"spectrum_id":"CCMSLIB00017274068","spectrum_index":31971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa (delta mass: 54.0466 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017274069","spectrum_index":31972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 362.006 Da; putative annotation: N/A; putative formula: C12H14N2O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.073,"smiles":null,"spectrum_id":"CCMSLIB00017274072","spectrum_index":31973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 181.193 Da; putative annotation: N/A; putative formula: C11H23N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.269,"smiles":null,"spectrum_id":"CCMSLIB00017274075","spectrum_index":31974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carvedilol (delta mass: 438.1584 Da; putative annotation: N/A; putative formula: C20H30N4OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":845.355,"smiles":null,"spectrum_id":"CCMSLIB00017274076","spectrum_index":31975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 160.0287 Da; putative annotation: N/A; putative formula: C6H9O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.068,"smiles":null,"spectrum_id":"CCMSLIB00017274079","spectrum_index":31976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 78.0317 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.186,"smiles":null,"spectrum_id":"CCMSLIB00017274082","spectrum_index":31977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 446.1807 Da; putative annotation: N/A; putative formula: C22H38OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.272,"smiles":null,"spectrum_id":"CCMSLIB00017274084","spectrum_index":31978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 137.0651 Da; putative annotation: N/A; putative formula: C8H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.167,"smiles":null,"spectrum_id":"CCMSLIB00017274086","spectrum_index":31979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 101.0636 Da; putative annotation: N/A; putative formula: C8H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.144,"smiles":null,"spectrum_id":"CCMSLIB00017274089","spectrum_index":31980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:102040\"\" (delta mass: 84.0581 Da; putative annotation: N/A; putative formula: C5H8O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.155,"smiles":null,"spectrum_id":"CCMSLIB00017274092","spectrum_index":31981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C9:0 (delta mass: 94.0516 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.259,"smiles":null,"spectrum_id":"CCMSLIB00017274093","spectrum_index":31982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol (delta mass: 70.1138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.273,"smiles":null,"spectrum_id":"CCMSLIB00017274096","spectrum_index":31983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 15.7882 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.974,"smiles":null,"spectrum_id":"CCMSLIB00017274099","spectrum_index":31984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 145.0201 Da; putative annotation: N/A; putative formula: C5H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.159,"smiles":null,"spectrum_id":"CCMSLIB00017274100","spectrum_index":31985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methylaspartic acid (delta mass: 70.0415 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017274103","spectrum_index":31986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 53.0492 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.108,"smiles":null,"spectrum_id":"CCMSLIB00017274106","spectrum_index":31987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 103.084 Da; putative annotation: N/A; putative formula: C2H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.144,"smiles":null,"spectrum_id":"CCMSLIB00017274109","spectrum_index":31988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 11.0177 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.131,"smiles":null,"spectrum_id":"CCMSLIB00017274110","spectrum_index":31989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 78.0471 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017274113","spectrum_index":31990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lofemizole (delta mass: 91.0425 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.095,"smiles":null,"spectrum_id":"CCMSLIB00017274116","spectrum_index":31991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 75.998 Da; putative annotation: N/A; putative formula: C2H4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.11,"smiles":null,"spectrum_id":"CCMSLIB00017274119","spectrum_index":31992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 47.0249 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.101,"smiles":null,"spectrum_id":"CCMSLIB00017274120","spectrum_index":31993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 152.0635 Da; putative annotation: N/A; putative formula: C12H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.16,"smiles":null,"spectrum_id":"CCMSLIB00017274123","spectrum_index":31994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 272.0471 Da; putative annotation: N/A; putative formula: C12H19O-1P3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.074,"smiles":null,"spectrum_id":"CCMSLIB00017274126","spectrum_index":31995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 111.0684 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.171,"smiles":null,"spectrum_id":"CCMSLIB00017274127","spectrum_index":31996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 338.2236 Da; putative annotation: N/A; putative formula: C17H31N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.32,"smiles":null,"spectrum_id":"CCMSLIB00017274130","spectrum_index":31997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 161.0678 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.243,"smiles":null,"spectrum_id":"CCMSLIB00017274133","spectrum_index":31998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 216.0752 Da; putative annotation: N/A; putative formula: C13H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.198,"smiles":null,"spectrum_id":"CCMSLIB00017274135","spectrum_index":31999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01042 Hexahydrocurcumin (delta mass: 136.0513 Da; putative annotation: N/A; putative formula: C2H9N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.232,"smiles":null,"spectrum_id":"CCMSLIB00017274138","spectrum_index":32000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cellobiose (D[+]) (delta mass: 675.3609 Da; putative annotation: N/A; putative formula: C30H54N5O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1018.48,"smiles":null,"spectrum_id":"CCMSLIB00017274139","spectrum_index":32001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 70.0 eV (delta mass: 58.9284 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.031,"smiles":null,"spectrum_id":"CCMSLIB00017274142","spectrum_index":32002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 331.0217 Da; putative annotation: N/A; putative formula: C9H17NO6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.061,"smiles":null,"spectrum_id":"CCMSLIB00017274145","spectrum_index":32003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 74.12 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.16,"smiles":null,"spectrum_id":"CCMSLIB00017274146","spectrum_index":32004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE0; CorrDec (delta mass: 72.0569 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.133,"smiles":null,"spectrum_id":"CCMSLIB00017274149","spectrum_index":32005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 200.0485 Da; putative annotation: N/A; putative formula: C13H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.172,"smiles":null,"spectrum_id":"CCMSLIB00017274152","spectrum_index":32006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 351.1548 Da; putative annotation: N/A; putative formula: C16H33NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.226,"smiles":null,"spectrum_id":"CCMSLIB00017274155","spectrum_index":32007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 26.9995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017274158","spectrum_index":32008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 263.0795 Da; putative annotation: N/A; putative formula: C13H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.223,"smiles":null,"spectrum_id":"CCMSLIB00017274159","spectrum_index":32009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 112.0027 Da; putative annotation: N/A; putative formula: C2N4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.068,"smiles":null,"spectrum_id":"CCMSLIB00017274162","spectrum_index":32010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 426.2054 Da; putative annotation: N/A; putative formula: C26H26N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.359,"smiles":null,"spectrum_id":"CCMSLIB00017274165","spectrum_index":32011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 268.1565 Da; putative annotation: N/A; putative formula: C11H21N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.31,"smiles":null,"spectrum_id":"CCMSLIB00017274166","spectrum_index":32012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Pro-Ile from NIST14 (delta mass: 97.0532 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.292,"smiles":null,"spectrum_id":"CCMSLIB00017274169","spectrum_index":32013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 103.1053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.144,"smiles":null,"spectrum_id":"CCMSLIB00017274172","spectrum_index":32014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 95.9995 Da; putative annotation: N/A; putative formula: C2HN4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.174,"smiles":null,"spectrum_id":"CCMSLIB00017274173","spectrum_index":32015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 157.0735 Da; putative annotation: N/A; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.165,"smiles":null,"spectrum_id":"CCMSLIB00017274176","spectrum_index":32016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 101.0577 Da; putative annotation: N/A; putative formula: C3H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.353,"smiles":null,"spectrum_id":"CCMSLIB00017274179","spectrum_index":32017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 159.9857 Da; putative annotation: N/A; putative formula: C4H5N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.119,"smiles":null,"spectrum_id":"CCMSLIB00017274182","spectrum_index":32018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 789.4306 Da; putative annotation: N/A; putative formula: C43H59N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":970.501,"smiles":null,"spectrum_id":"CCMSLIB00017274183","spectrum_index":32019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 90.0833 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.159,"smiles":null,"spectrum_id":"CCMSLIB00017274186","spectrum_index":32020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 92.0623 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017274189","spectrum_index":32021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 18.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017274191","spectrum_index":32022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 128.0833 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.17,"smiles":null,"spectrum_id":"CCMSLIB00017274193","spectrum_index":32023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of lysergol (delta mass: 18.0355 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.185,"smiles":null,"spectrum_id":"CCMSLIB00017274196","spectrum_index":32024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 50.0594 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.123,"smiles":null,"spectrum_id":"CCMSLIB00017274197","spectrum_index":32025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one (delta mass: 145.0834 Da; putative annotation: N/A; putative formula: C5H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.165,"smiles":null,"spectrum_id":"CCMSLIB00017274200","spectrum_index":32026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006044 Indole-3-acetonitrile|2-(1H-indol-3-yl)acetonitrile (delta mass: 92.0111 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.087,"smiles":null,"spectrum_id":"CCMSLIB00017274202","spectrum_index":32027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 79.1104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.176,"smiles":null,"spectrum_id":"CCMSLIB00017274204","spectrum_index":32028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-1-(4-phenoxyphenyl)methanamine (delta mass: 34.0207 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.143,"smiles":null,"spectrum_id":"CCMSLIB00017274206","spectrum_index":32029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 56.9881 Da; putative annotation: N/A; putative formula: N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.069,"smiles":null,"spectrum_id":"CCMSLIB00017274209","spectrum_index":32030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1134.3699 Da; putative annotation: N/A; putative formula: C42H70O35)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1297.43,"smiles":null,"spectrum_id":"CCMSLIB00017274211","spectrum_index":32031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 1032.601 Da; putative annotation: N/A; putative formula: C53H80N10O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1699.83,"smiles":null,"spectrum_id":"CCMSLIB00017274213","spectrum_index":32032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 809.7943 Da; putative annotation: N/A; putative formula: C3H7O46P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1314.97,"smiles":null,"spectrum_id":"CCMSLIB00017274215","spectrum_index":32033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mer-N5075-A_35716_dereplictor_pv_5.17819e-12 (delta mass: 613.3274 Da; putative annotation: N/A; putative formula: C36H39N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1211.66,"smiles":null,"spectrum_id":"CCMSLIB00017274218","spectrum_index":32034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 186.0506 Da; putative annotation: N/A; putative formula: C12H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.227,"smiles":null,"spectrum_id":"CCMSLIB00017274220","spectrum_index":32035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[3-[3-Hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxyphenyl]-5-oxo-2H-furan-2-yl]acetic acid (delta mass: 45.9998 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.107,"smiles":null,"spectrum_id":"CCMSLIB00017274222","spectrum_index":32036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.197,"smiles":null,"spectrum_id":"CCMSLIB00017274224","spectrum_index":32037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 27.0359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.122,"smiles":null,"spectrum_id":"CCMSLIB00017274227","spectrum_index":32038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 262.266 Da; putative annotation: N/A; putative formula: C19H34)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.378,"smiles":null,"spectrum_id":"CCMSLIB00017274230","spectrum_index":32039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 63.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.103,"smiles":null,"spectrum_id":"CCMSLIB00017274232","spectrum_index":32040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 48.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.139,"smiles":null,"spectrum_id":"CCMSLIB00017274234","spectrum_index":32041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 130.8688 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.928,"smiles":null,"spectrum_id":"CCMSLIB00017274236","spectrum_index":32042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 166.1794 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.255,"smiles":null,"spectrum_id":"CCMSLIB00017274239","spectrum_index":32043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 212.0156 Da; putative annotation: N/A; putative formula: C9H10O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.087,"smiles":null,"spectrum_id":"CCMSLIB00017274241","spectrum_index":32044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 136.0525 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.149,"smiles":null,"spectrum_id":"CCMSLIB00017274244","spectrum_index":32045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 206.0397 Da; putative annotation: N/A; putative formula: C3H6N6O5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.11,"smiles":null,"spectrum_id":"CCMSLIB00017274246","spectrum_index":32046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 79.0427 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.129,"smiles":null,"spectrum_id":"CCMSLIB00017274249","spectrum_index":32047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 60.0 eV (delta mass: 244.0637 Da; putative annotation: N/A; putative formula: C16H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.15,"smiles":null,"spectrum_id":"CCMSLIB00017274252","spectrum_index":32048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 281.1731 Da; putative annotation: N/A; putative formula: C16H28NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.26,"smiles":null,"spectrum_id":"CCMSLIB00017274255","spectrum_index":32049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 302.3965 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.672,"smiles":null,"spectrum_id":"CCMSLIB00017274256","spectrum_index":32050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 273.1575 Da; putative annotation: N/A; putative formula: C13H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.218,"smiles":null,"spectrum_id":"CCMSLIB00017274259","spectrum_index":32051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 82.042 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017274262","spectrum_index":32052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 116.0832 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.206,"smiles":null,"spectrum_id":"CCMSLIB00017274265","spectrum_index":32053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311013 Feruloyl putrescine (isomer of 1173) (delta mass: 550.2204 Da; putative annotation: N/A; putative formula: C31H34O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":815.375,"smiles":null,"spectrum_id":"CCMSLIB00017274266","spectrum_index":32054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 159.0532 Da; putative annotation: N/A; putative formula: C6H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.113,"smiles":null,"spectrum_id":"CCMSLIB00017274269","spectrum_index":32055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 312.2404 Da; putative annotation: N/A; putative formula: C19H37O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.389,"smiles":null,"spectrum_id":"CCMSLIB00017274270","spectrum_index":32056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 161.0696 Da; putative annotation: N/A; putative formula: C7H15NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.161,"smiles":null,"spectrum_id":"CCMSLIB00017274273","spectrum_index":32057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 174.5887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.66,"smiles":null,"spectrum_id":"CCMSLIB00017274276","spectrum_index":32058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 37.0334 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.12,"smiles":null,"spectrum_id":"CCMSLIB00017274277","spectrum_index":32059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one (delta mass: 72.0564 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.19,"smiles":null,"spectrum_id":"CCMSLIB00017274280","spectrum_index":32060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 135.066 Da; putative annotation: N/A; putative formula: C4H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.098,"smiles":null,"spectrum_id":"CCMSLIB00017274283","spectrum_index":32061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 242.0707 Da; putative annotation: N/A; putative formula: C11H15O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.224,"smiles":null,"spectrum_id":"CCMSLIB00017274285","spectrum_index":32062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Aminomethyl)-7-fluoroquinolin-2-ol (delta mass: 27.0196 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.097,"smiles":null,"spectrum_id":"CCMSLIB00017274287","spectrum_index":32063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.128,"smiles":null,"spectrum_id":"CCMSLIB00017274290","spectrum_index":32064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 26.0256 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.149,"smiles":null,"spectrum_id":"CCMSLIB00017274293","spectrum_index":32065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 328.0586 Da; putative annotation: N/A; putative formula: C10H20N2O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.119,"smiles":null,"spectrum_id":"CCMSLIB00017274294","spectrum_index":32066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 234.1044 Da; putative annotation: N/A; putative formula: C17H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.254,"smiles":null,"spectrum_id":"CCMSLIB00017274297","spectrum_index":32067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 185.1049 Da; putative annotation: N/A; putative formula: C9H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.176,"smiles":null,"spectrum_id":"CCMSLIB00017274300","spectrum_index":32068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 291.2809 Da; putative annotation: N/A; putative formula: C17H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.372,"smiles":null,"spectrum_id":"CCMSLIB00017274303","spectrum_index":32069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 89.0111 Da; putative annotation: N/A; putative formula: C2H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.098,"smiles":null,"spectrum_id":"CCMSLIB00017274305","spectrum_index":32070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 573.5274 Da; putative annotation: N/A; putative formula: C41H67N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.63,"smiles":null,"spectrum_id":"CCMSLIB00017274307","spectrum_index":32071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 346.1644 Da; putative annotation: N/A; putative formula: C17H22N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.251,"smiles":null,"spectrum_id":"CCMSLIB00017274310","spectrum_index":32072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.123,"smiles":null,"spectrum_id":"CCMSLIB00017274313","spectrum_index":32073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 44.0383 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.119,"smiles":null,"spectrum_id":"CCMSLIB00017274315","spectrum_index":32074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 41.0502 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.152,"smiles":null,"spectrum_id":"CCMSLIB00017274317","spectrum_index":32075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 156.1495 Da; putative annotation: N/A; putative formula: C6H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.23,"smiles":null,"spectrum_id":"CCMSLIB00017274320","spectrum_index":32076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 418.1767 Da; putative annotation: N/A; putative formula: C23H18N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.294,"smiles":null,"spectrum_id":"CCMSLIB00017274322","spectrum_index":32077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Magnocurarine (delta mass: 102.0726 Da; putative annotation: N/A; putative formula: C4H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.248,"smiles":null,"spectrum_id":"CCMSLIB00017274324","spectrum_index":32078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 65.0622 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.164,"smiles":null,"spectrum_id":"CCMSLIB00017274327","spectrum_index":32079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 1.9806 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.051,"smiles":null,"spectrum_id":"CCMSLIB00017274330","spectrum_index":32080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 408.2279 Da; putative annotation: N/A; putative formula: C15H28N12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.366,"smiles":null,"spectrum_id":"CCMSLIB00017274332","spectrum_index":32081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 148.0471 Da; putative annotation: N/A; putative formula: C6H13PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.174,"smiles":null,"spectrum_id":"CCMSLIB00017274335","spectrum_index":32082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 194.2609 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.389,"smiles":null,"spectrum_id":"CCMSLIB00017274337","spectrum_index":32083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 200.1775 Da; putative annotation: N/A; putative formula: C12H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.216,"smiles":null,"spectrum_id":"CCMSLIB00017274340","spectrum_index":32084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]- (delta mass: 24.3075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.5,"smiles":null,"spectrum_id":"CCMSLIB00017274343","spectrum_index":32085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU162308 Codeine|(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-ol (delta mass: 17.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.185,"smiles":null,"spectrum_id":"CCMSLIB00017274345","spectrum_index":32086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 88.0624 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.175,"smiles":null,"spectrum_id":"CCMSLIB00017274347","spectrum_index":32087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 132.0422 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.113,"smiles":null,"spectrum_id":"CCMSLIB00017274350","spectrum_index":32088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Glu (delta mass: 129.0429 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.125,"smiles":null,"spectrum_id":"CCMSLIB00017274353","spectrum_index":32089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 129.0426 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.118,"smiles":null,"spectrum_id":"CCMSLIB00017274355","spectrum_index":32090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 165.0791 Da; putative annotation: (1R,2S)-(-)-3,4-Dihydroxynorephedrine; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.185,"smiles":null,"spectrum_id":"CCMSLIB00017274357","spectrum_index":32091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 114.0685 Da; putative annotation: 6-Hydroxycaproic acid; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.201,"smiles":null,"spectrum_id":"CCMSLIB00017274360","spectrum_index":32092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 252.0997 Da; putative annotation: Phenylmethyl-glucopyranoside; putative formula: C13H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.16,"smiles":null,"spectrum_id":"CCMSLIB00017274363","spectrum_index":32093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 203.0398 Da; putative annotation: 4-(1,3-Benzothiazol-2-yl)butanoic acid; putative formula: C11H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.111,"smiles":null,"spectrum_id":"CCMSLIB00017274365","spectrum_index":32094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 317.1093 Da; putative annotation: For-Met-Ala-Ser; putative formula: C12H19N3O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.206,"smiles":null,"spectrum_id":"CCMSLIB00017274367","spectrum_index":32095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 162.05 Da; putative annotation: D-Fructose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.153,"smiles":null,"spectrum_id":"CCMSLIB00017274370","spectrum_index":32096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 133.0892 Da; putative annotation: 4-Hydroxyamphetamine; putative formula: C9H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.259,"smiles":null,"spectrum_id":"CCMSLIB00017274373","spectrum_index":32097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 110.0516 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.175,"smiles":null,"spectrum_id":"CCMSLIB00017274375","spectrum_index":32098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 29.0238 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.126,"smiles":null,"spectrum_id":"CCMSLIB00017274378","spectrum_index":32099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-methoxyphenyl)propylamine CollisionEnergy:102040 (delta mass: 208.0231 Da; putative annotation: N/A; putative formula: C7H4N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.146,"smiles":null,"spectrum_id":"CCMSLIB00017274381","spectrum_index":32100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 671.4455 Da; putative annotation: N/A; putative formula: C32H65NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.594,"smiles":null,"spectrum_id":"CCMSLIB00017274383","spectrum_index":32101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 495.3416 Da; putative annotation: N/A; putative formula: C35H46NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.49,"smiles":null,"spectrum_id":"CCMSLIB00017274386","spectrum_index":32102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 44.0653 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.154,"smiles":null,"spectrum_id":"CCMSLIB00017274388","spectrum_index":32103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 141.0411 Da; putative annotation: N/A; putative formula: C2H3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.122,"smiles":null,"spectrum_id":"CCMSLIB00017274391","spectrum_index":32104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 138.0827 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.206,"smiles":null,"spectrum_id":"CCMSLIB00017274394","spectrum_index":32105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 81.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.134,"smiles":null,"spectrum_id":"CCMSLIB00017274396","spectrum_index":32106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 63.9499 Da; putative annotation: N/A; putative formula: HPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.036,"smiles":null,"spectrum_id":"CCMSLIB00017274399","spectrum_index":32107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 106.0496 Da; putative annotation: N/A; putative formula: CH6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.11,"smiles":null,"spectrum_id":"CCMSLIB00017274402","spectrum_index":32108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 25.0239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.116,"smiles":null,"spectrum_id":"CCMSLIB00017274404","spectrum_index":32109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 171.039 Da; putative annotation: N/A; putative formula: C4H5N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.11,"smiles":null,"spectrum_id":"CCMSLIB00017274406","spectrum_index":32110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 248.0754 Da; putative annotation: N/A; putative formula: C17H13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.178,"smiles":null,"spectrum_id":"CCMSLIB00017274409","spectrum_index":32111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 110.1134 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.252,"smiles":null,"spectrum_id":"CCMSLIB00017274411","spectrum_index":32112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 87.0023 Da; putative annotation: N/A; putative formula: HN5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.156,"smiles":null,"spectrum_id":"CCMSLIB00017274413","spectrum_index":32113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,3-(2,3-Dihydroxypropyl)diindole (delta mass: 210.1353 Da; putative annotation: N/A; putative formula: C7H14N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.279,"smiles":null,"spectrum_id":"CCMSLIB00017274416","spectrum_index":32114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 98.0158 Da; putative annotation: N/A; putative formula: C8H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.086,"smiles":null,"spectrum_id":"CCMSLIB00017274419","spectrum_index":32115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 232.1827 Da; putative annotation: N/A; putative formula: C16H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.274,"smiles":null,"spectrum_id":"CCMSLIB00017274422","spectrum_index":32116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 41.077 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.164,"smiles":null,"spectrum_id":"CCMSLIB00017274423","spectrum_index":32117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(5-Nitro-1H-indol-3-yl)ethan-1-one (delta mass: 16.0309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.092,"smiles":null,"spectrum_id":"CCMSLIB00017274426","spectrum_index":32118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 295.1784 Da; putative annotation: N/A; putative formula: C16H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.249,"smiles":null,"spectrum_id":"CCMSLIB00017274429","spectrum_index":32119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 141.0741 Da; putative annotation: N/A; putative formula: C6H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.14,"smiles":null,"spectrum_id":"CCMSLIB00017274430","spectrum_index":32120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mannitol (delta mass: 394.0693 Da; putative annotation: N/A; putative formula: C24H15N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.156,"smiles":null,"spectrum_id":"CCMSLIB00017274433","spectrum_index":32121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 172.0848 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.145,"smiles":null,"spectrum_id":"CCMSLIB00017274436","spectrum_index":32122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 90.0439 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.156,"smiles":null,"spectrum_id":"CCMSLIB00017274439","spectrum_index":32123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 203.6047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.691,"smiles":null,"spectrum_id":"CCMSLIB00017274441","spectrum_index":32124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 168.0301 Da; putative annotation: N/A; putative formula: C3H9N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.065,"smiles":null,"spectrum_id":"CCMSLIB00017274444","spectrum_index":32125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 251.13 Da; putative annotation: N/A; putative formula: C11H18N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.216,"smiles":null,"spectrum_id":"CCMSLIB00017274446","spectrum_index":32126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 605.4289 Da; putative annotation: N/A; putative formula: C35H59NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.531,"smiles":null,"spectrum_id":"CCMSLIB00017274449","spectrum_index":32127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (delta mass: 101.0836 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.217,"smiles":null,"spectrum_id":"CCMSLIB00017274452","spectrum_index":32128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 59.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017274453","spectrum_index":32129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 111.044 Da; putative annotation: N/A; putative formula: C4H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.131,"smiles":null,"spectrum_id":"CCMSLIB00017274456","spectrum_index":32130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 182.1025 Da; putative annotation: N/A; putative formula: C5H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.152,"smiles":null,"spectrum_id":"CCMSLIB00017274459","spectrum_index":32131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 371.216 Da; putative annotation: N/A; putative formula: C26H30NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.271,"smiles":null,"spectrum_id":"CCMSLIB00017274462","spectrum_index":32132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 58.02 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.101,"smiles":null,"spectrum_id":"CCMSLIB00017274463","spectrum_index":32133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 172.0494 Da; putative annotation: N/A; putative formula: C7H12N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.204,"smiles":null,"spectrum_id":"CCMSLIB00017274466","spectrum_index":32134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 256.5102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.685,"smiles":null,"spectrum_id":"CCMSLIB00017274469","spectrum_index":32135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 306.1146 Da; putative annotation: N/A; putative formula: C16H15N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.21,"smiles":null,"spectrum_id":"CCMSLIB00017274471","spectrum_index":32136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 99.9998 Da; putative annotation: N/A; putative formula: C4H6O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.07,"smiles":null,"spectrum_id":"CCMSLIB00017274473","spectrum_index":32137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 392.0768 Da; putative annotation: N/A; putative formula: C20H8N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.21,"smiles":null,"spectrum_id":"CCMSLIB00017274476","spectrum_index":32138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 66.0272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.197,"smiles":null,"spectrum_id":"CCMSLIB00017274479","spectrum_index":32139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-3-Benzazepine-7,8-diol, 6-chloro-2,3,4,5-tetrahydro-1-phenyl- (delta mass: 17.0498 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.144,"smiles":null,"spectrum_id":"CCMSLIB00017274481","spectrum_index":32140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 241.1679 Da; putative annotation: N/A; putative formula: C13H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.264,"smiles":null,"spectrum_id":"CCMSLIB00017274483","spectrum_index":32141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 176.0927 Da; putative annotation: N/A; putative formula: C6H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.179,"smiles":null,"spectrum_id":"CCMSLIB00017274486","spectrum_index":32142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 187.0631 Da; putative annotation: N/A; putative formula: C9H8F3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.134,"smiles":null,"spectrum_id":"CCMSLIB00017274489","spectrum_index":32143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 108.0576 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017274491","spectrum_index":32144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 122.0369 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.165,"smiles":null,"spectrum_id":"CCMSLIB00017274493","spectrum_index":32145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 283.1988 Da; putative annotation: N/A; putative formula: C16H31NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.3,"smiles":null,"spectrum_id":"CCMSLIB00017274496","spectrum_index":32146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Diphenyl-1H-indole-7-carboxylic acid (delta mass: 114.0159 Da; putative annotation: N/A; putative formula: C5H8O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.134,"smiles":null,"spectrum_id":"CCMSLIB00017274499","spectrum_index":32147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 143.0729 Da; putative annotation: N/A; putative formula: C10H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.265,"smiles":null,"spectrum_id":"CCMSLIB00017274501","spectrum_index":32148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 297.1324 Da; putative annotation: N/A; putative formula: C13H19N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.229,"smiles":null,"spectrum_id":"CCMSLIB00017274503","spectrum_index":32149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,7-dimethoxy-4-oxochromen-2-yl)propanoic acid (delta mass: 73.0727 Da; putative annotation: N/A; putative formula: CH7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.159,"smiles":null,"spectrum_id":"CCMSLIB00017274506","spectrum_index":32150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 63.0747 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.196,"smiles":null,"spectrum_id":"CCMSLIB00017274509","spectrum_index":32151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-7-carboxaldehyde (delta mass: 30.0 Da; putative annotation: N/A; putative formula: CH3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.06,"smiles":null,"spectrum_id":"CCMSLIB00017274510","spectrum_index":32152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 63.0339 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.145,"smiles":null,"spectrum_id":"CCMSLIB00017274513","spectrum_index":32153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C6:0 (delta mass: 136.0374 Da; putative annotation: N/A; putative formula: C4H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.197,"smiles":null,"spectrum_id":"CCMSLIB00017274516","spectrum_index":32154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Pyridinyl)ethanol (delta mass: 69.0649 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.141,"smiles":null,"spectrum_id":"CCMSLIB00017274518","spectrum_index":32155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 306.2617 Da; putative annotation: N/A; putative formula: C15H30N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.379,"smiles":null,"spectrum_id":"CCMSLIB00017274521","spectrum_index":32156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 400.7341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.794,"smiles":null,"spectrum_id":"CCMSLIB00017274522","spectrum_index":32157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 46.0611 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.141,"smiles":null,"spectrum_id":"CCMSLIB00017274525","spectrum_index":32158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 62.0523 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.176,"smiles":null,"spectrum_id":"CCMSLIB00017274528","spectrum_index":32159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 88.068 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.144,"smiles":null,"spectrum_id":"CCMSLIB00017274531","spectrum_index":32160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Ethynyl-1H-indole (delta mass: 27.012 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.077,"smiles":null,"spectrum_id":"CCMSLIB00017274532","spectrum_index":32161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 214.0476 Da; putative annotation: N/A; putative formula: C9H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.129,"smiles":null,"spectrum_id":"CCMSLIB00017274535","spectrum_index":32162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 441.309 Da; putative annotation: N/A; putative formula: C24H43NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":785.458,"smiles":null,"spectrum_id":"CCMSLIB00017274538","spectrum_index":32163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 230.0692 Da; putative annotation: N/A; putative formula: C12H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.124,"smiles":null,"spectrum_id":"CCMSLIB00017274540","spectrum_index":32164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381340-01!(5E)-heptadeca-5,16-diene-1,2,4-triol (delta mass: 62.0522 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.295,"smiles":null,"spectrum_id":"CCMSLIB00017274543","spectrum_index":32165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 412.1342 Da; putative annotation: N/A; putative formula: C15H20N6O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.283,"smiles":null,"spectrum_id":"CCMSLIB00017274546","spectrum_index":32166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 251.1366 Da; putative annotation: N/A; putative formula: C10H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.202,"smiles":null,"spectrum_id":"CCMSLIB00017274548","spectrum_index":32167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017274551","spectrum_index":32168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 122.1922 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.31,"smiles":null,"spectrum_id":"CCMSLIB00017274554","spectrum_index":32169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 27.1041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.216,"smiles":null,"spectrum_id":"CCMSLIB00017274556","spectrum_index":32170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 363.0472 Da; putative annotation: N/A; putative formula: C15H9N9O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.123,"smiles":null,"spectrum_id":"CCMSLIB00017274559","spectrum_index":32171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 70.0419 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017274561","spectrum_index":32172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 359.2248 Da; putative annotation: N/A; putative formula: C25H29NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.322,"smiles":null,"spectrum_id":"CCMSLIB00017274564","spectrum_index":32173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380224-01!1,7-bis(3,4-dihydroxyphenyl)-6-methoxyheptan-3-one (delta mass: 128.0258 Da; putative annotation: N/A; putative formula: C9H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.19,"smiles":null,"spectrum_id":"CCMSLIB00017274567","spectrum_index":32174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 270.12 Da; putative annotation: N/A; putative formula: C9H10N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.206,"smiles":null,"spectrum_id":"CCMSLIB00017274568","spectrum_index":32175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CloxacillinNa (delta mass: 164.0687 Da; putative annotation: N/A; putative formula: C6H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.141,"smiles":null,"spectrum_id":"CCMSLIB00017274571","spectrum_index":32176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 343.1713 Da; putative annotation: N/A; putative formula: C19H25N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.212,"smiles":null,"spectrum_id":"CCMSLIB00017274574","spectrum_index":32177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 331.1431 Da; putative annotation: N/A; putative formula: C19H17N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.24,"smiles":null,"spectrum_id":"CCMSLIB00017274577","spectrum_index":32178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 590.2978 Da; putative annotation: N/A; putative formula: C31H34N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":962.442,"smiles":null,"spectrum_id":"CCMSLIB00017274578","spectrum_index":32179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 64.9938 Da; putative annotation: N/A; putative formula: C3H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.091,"smiles":null,"spectrum_id":"CCMSLIB00017274581","spectrum_index":32180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 532.1583 Da; putative annotation: N/A; putative formula: C32H20N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.218,"smiles":null,"spectrum_id":"CCMSLIB00017274584","spectrum_index":32181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 27.0473 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.249,"smiles":null,"spectrum_id":"CCMSLIB00017274585","spectrum_index":32182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 371.108 Da; putative annotation: N/A; putative formula: C13H17N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.185,"smiles":null,"spectrum_id":"CCMSLIB00017274588","spectrum_index":32183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 298.0456 Da; putative annotation: N/A; putative formula: C5H6N12O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.148,"smiles":null,"spectrum_id":"CCMSLIB00017274591","spectrum_index":32184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 56.0621 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.237,"smiles":null,"spectrum_id":"CCMSLIB00017274594","spectrum_index":32185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1246.8292 Da; putative annotation: N/A; putative formula: C49H98N32O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1468.93,"smiles":null,"spectrum_id":"CCMSLIB00017274595","spectrum_index":32186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 50.0 eV (delta mass: 34.9931 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.069,"smiles":null,"spectrum_id":"CCMSLIB00017274598","spectrum_index":32187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 124.0893 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.165,"smiles":null,"spectrum_id":"CCMSLIB00017274601","spectrum_index":32188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 292.1418 Da; putative annotation: N/A; putative formula: C17H25PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.291,"smiles":null,"spectrum_id":"CCMSLIB00017274602","spectrum_index":32189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 148.1463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.248,"smiles":null,"spectrum_id":"CCMSLIB00017274605","spectrum_index":32190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 157.0488 Da; putative annotation: N/A; putative formula: C5H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.241,"smiles":null,"spectrum_id":"CCMSLIB00017274608","spectrum_index":32191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.076,"smiles":null,"spectrum_id":"CCMSLIB00017274611","spectrum_index":32192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 246.2328 Da; putative annotation: N/A; putative formula: C18H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.303,"smiles":null,"spectrum_id":"CCMSLIB00017274612","spectrum_index":32193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lauryldiethanolamine (delta mass: 256.2396 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.514,"smiles":null,"spectrum_id":"CCMSLIB00017274615","spectrum_index":32194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 146.094 Da; putative annotation: N/A; putative formula: C7H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.18,"smiles":null,"spectrum_id":"CCMSLIB00017274618","spectrum_index":32195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 262.2284 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.32,"smiles":null,"spectrum_id":"CCMSLIB00017274620","spectrum_index":32196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 60.0203 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.315,"smiles":null,"spectrum_id":"CCMSLIB00017274623","spectrum_index":32197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 83.0367 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.128,"smiles":null,"spectrum_id":"CCMSLIB00017274624","spectrum_index":32198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 214.0244 Da; putative annotation: N/A; putative formula: C5H11O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.085,"smiles":null,"spectrum_id":"CCMSLIB00017274627","spectrum_index":32199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 140.027 Da; putative annotation: N/A; putative formula: C3H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.107,"smiles":null,"spectrum_id":"CCMSLIB00017274629","spectrum_index":32200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 70.0 eV (delta mass: 179.9619 Da; putative annotation: N/A; putative formula: C8H5O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.065,"smiles":null,"spectrum_id":"CCMSLIB00017274631","spectrum_index":32201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne Acetate (delta mass: 82.0779 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.331,"smiles":null,"spectrum_id":"CCMSLIB00017274634","spectrum_index":32202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 262.1054 Da; putative annotation: N/A; putative formula: C11H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.176,"smiles":null,"spectrum_id":"CCMSLIB00017274637","spectrum_index":32203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 65.011 Da; putative annotation: N/A; putative formula: CH-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.066,"smiles":null,"spectrum_id":"CCMSLIB00017274638","spectrum_index":32204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 42.9849 Da; putative annotation: N/A; putative formula: CHNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.055,"smiles":null,"spectrum_id":"CCMSLIB00017274641","spectrum_index":32205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 98.0734 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.259,"smiles":null,"spectrum_id":"CCMSLIB00017274644","spectrum_index":32206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 33.0411 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.153,"smiles":null,"spectrum_id":"CCMSLIB00017274646","spectrum_index":32207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trifluperidol (delta mass: 352.2268 Da; putative annotation: N/A; putative formula: C20H32O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.401,"smiles":null,"spectrum_id":"CCMSLIB00017274649","spectrum_index":32208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 95.0374 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017274650","spectrum_index":32209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 590.3715 Da; putative annotation: N/A; putative formula: C38H55OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.468,"smiles":null,"spectrum_id":"CCMSLIB00017274653","spectrum_index":32210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 18.0544 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.13,"smiles":null,"spectrum_id":"CCMSLIB00017274656","spectrum_index":32211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1202.5711 Da; putative annotation: N/A; putative formula: C69H78N12O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1395.64,"smiles":null,"spectrum_id":"CCMSLIB00017274659","spectrum_index":32212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 228.1067 Da; putative annotation: N/A; putative formula: C15H17P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.165,"smiles":null,"spectrum_id":"CCMSLIB00017274660","spectrum_index":32213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 258.1104 Da; putative annotation: N/A; putative formula: C12H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.17,"smiles":null,"spectrum_id":"CCMSLIB00017274663","spectrum_index":32214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 60.0324 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017274666","spectrum_index":32215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Octenoyl-carnitine; LC-tDDA; CE20 (delta mass: 66.0103 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.212,"smiles":null,"spectrum_id":"CCMSLIB00017274669","spectrum_index":32216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Formoterol (delta mass: 254.1485 Da; putative annotation: N/A; putative formula: C10H18N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.329,"smiles":null,"spectrum_id":"CCMSLIB00017274670","spectrum_index":32217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 298.1816 Da; putative annotation: N/A; putative formula: C15H27N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.278,"smiles":null,"spectrum_id":"CCMSLIB00017274673","spectrum_index":32218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.gamma.-Glutamyl-L-glutamic acid (delta mass: 240.0746 Da; putative annotation: N/A; putative formula: C15H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.178,"smiles":null,"spectrum_id":"CCMSLIB00017274675","spectrum_index":32219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CLE_291.1026_12.2 (delta mass: 180.1246 Da; putative annotation: N/A; putative formula: C6H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.227,"smiles":null,"spectrum_id":"CCMSLIB00017274678","spectrum_index":32220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 102.0461 Da; putative annotation: N/A; putative formula: C2H7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017274680","spectrum_index":32221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Thr-Lys (delta mass: 83.0737 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.318,"smiles":null,"spectrum_id":"CCMSLIB00017274682","spectrum_index":32222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 602.7754 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.873,"smiles":null,"spectrum_id":"CCMSLIB00017274685","spectrum_index":32223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 386.2674 Da; putative annotation: N/A; putative formula: C22H42OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.354,"smiles":null,"spectrum_id":"CCMSLIB00017274688","spectrum_index":32224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 523.2997 Da; putative annotation: N/A; putative formula: C24H45NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.354,"smiles":null,"spectrum_id":"CCMSLIB00017274690","spectrum_index":32225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 799.5088 Da; putative annotation: N/A; putative formula: C53H70NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":962.569,"smiles":null,"spectrum_id":"CCMSLIB00017274693","spectrum_index":32226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.128,"smiles":null,"spectrum_id":"CCMSLIB00017274695","spectrum_index":32227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Oxomorphine (delta mass: 64.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.176,"smiles":null,"spectrum_id":"CCMSLIB00017274698","spectrum_index":32228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 112.9328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.056,"smiles":null,"spectrum_id":"CCMSLIB00017274700","spectrum_index":32229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 252.2816 Da; putative annotation: N/A; putative formula: C18H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.352,"smiles":null,"spectrum_id":"CCMSLIB00017274702","spectrum_index":32230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 128.0603 Da; putative annotation: N/A; putative formula: C4H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.235,"smiles":null,"spectrum_id":"CCMSLIB00017274705","spectrum_index":32231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 211.1138 Da; putative annotation: N/A; putative formula: C10H17N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.21,"smiles":null,"spectrum_id":"CCMSLIB00017274708","spectrum_index":32232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 98.0627 Da; putative annotation: N/A; putative formula: C6H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.165,"smiles":null,"spectrum_id":"CCMSLIB00017274711","spectrum_index":32233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Amino(cyclohexyl)acetic acid ethyl ester (delta mass: 54.0506 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.199,"smiles":null,"spectrum_id":"CCMSLIB00017274712","spectrum_index":32234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 68.026 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017274715","spectrum_index":32235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 79.9572 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.112,"smiles":null,"spectrum_id":"CCMSLIB00017274718","spectrum_index":32236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 315.1386 Da; putative annotation: N/A; putative formula: C18H22NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.256,"smiles":null,"spectrum_id":"CCMSLIB00017274720","spectrum_index":32237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 316.24 Da; putative annotation: N/A; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.311,"smiles":null,"spectrum_id":"CCMSLIB00017274722","spectrum_index":32238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 573.2267 Da; putative annotation: N/A; putative formula: C22H39NO16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.297,"smiles":null,"spectrum_id":"CCMSLIB00017274725","spectrum_index":32239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 253.7816 Da; putative annotation: N/A; putative formula: C2H-2O-1P8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.852,"smiles":null,"spectrum_id":"CCMSLIB00017274728","spectrum_index":32240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 300.194 Da; putative annotation: N/A; putative formula: C16H28O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.363,"smiles":null,"spectrum_id":"CCMSLIB00017274730","spectrum_index":32241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 168.0843 Da; putative annotation: N/A; putative formula: C7H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.207,"smiles":null,"spectrum_id":"CCMSLIB00017274732","spectrum_index":32242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 86.9957 Da; putative annotation: N/A; putative formula: C2HNO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.098,"smiles":null,"spectrum_id":"CCMSLIB00017274735","spectrum_index":32243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 16.4403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017274738","spectrum_index":32244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 1056.7783 Da; putative annotation: N/A; putative formula: C70H104O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1440.93,"smiles":null,"spectrum_id":"CCMSLIB00017274739","spectrum_index":32245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 244.1466 Da; putative annotation: N/A; putative formula: C16H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.184,"smiles":null,"spectrum_id":"CCMSLIB00017274742","spectrum_index":32246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 28.1247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.173,"smiles":null,"spectrum_id":"CCMSLIB00017274745","spectrum_index":32247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 340.3486 Da; putative annotation: N/A; putative formula: C26H44O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.43,"smiles":null,"spectrum_id":"CCMSLIB00017274747","spectrum_index":32248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 32.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.228,"smiles":null,"spectrum_id":"CCMSLIB00017274749","spectrum_index":32249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 119.0619 Da; putative annotation: N/A; putative formula: C3H10N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.164,"smiles":null,"spectrum_id":"CCMSLIB00017274752","spectrum_index":32250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Ala (delta mass: 285.1331 Da; putative annotation: N/A; putative formula: C13H23N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.262,"smiles":null,"spectrum_id":"CCMSLIB00017274755","spectrum_index":32251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 169.0693 Da; putative annotation: N/A; putative formula: H3N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.172,"smiles":null,"spectrum_id":"CCMSLIB00017274758","spectrum_index":32252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.092,"smiles":null,"spectrum_id":"CCMSLIB00017274759","spectrum_index":32253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 97.0529 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.124,"smiles":null,"spectrum_id":"CCMSLIB00017274762","spectrum_index":32254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 47.9992 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.065,"smiles":null,"spectrum_id":"CCMSLIB00017274765","spectrum_index":32255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid (delta mass: 366.1113 Da; putative annotation: N/A; putative formula: C21H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.207,"smiles":null,"spectrum_id":"CCMSLIB00017274767","spectrum_index":32256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 114.0404 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.081,"smiles":null,"spectrum_id":"CCMSLIB00017274769","spectrum_index":32257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 104.0263 Da; putative annotation: N/A; putative formula: C7H4O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.086,"smiles":null,"spectrum_id":"CCMSLIB00017274772","spectrum_index":32258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(1H-Indol-3-yl)vinyl]isoquinoline (delta mass: 28.0411 Da; putative annotation: N/A; putative formula: CH4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.164,"smiles":null,"spectrum_id":"CCMSLIB00017274775","spectrum_index":32259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mecillinam (delta mass: 42.9836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.137,"smiles":null,"spectrum_id":"CCMSLIB00017274777","spectrum_index":32260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.149,"smiles":null,"spectrum_id":"CCMSLIB00017274779","spectrum_index":32261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 269.199 Da; putative annotation: N/A; putative formula: C15H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.27,"smiles":null,"spectrum_id":"CCMSLIB00017274783","spectrum_index":32262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 136.1356 Da; putative annotation: N/A; putative formula: C9H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.238,"smiles":null,"spectrum_id":"CCMSLIB00017274785","spectrum_index":32263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxycodone (delta mass: 88.0543 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.193,"smiles":null,"spectrum_id":"CCMSLIB00017274788","spectrum_index":32264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 144.0887 Da; putative annotation: N/A; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.149,"smiles":null,"spectrum_id":"CCMSLIB00017274791","spectrum_index":32265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 164.0656 Da; putative annotation: N/A; putative formula: C2H8N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.141,"smiles":null,"spectrum_id":"CCMSLIB00017274794","spectrum_index":32266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140304 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 63.0036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017274795","spectrum_index":32267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 54.9213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.937,"smiles":null,"spectrum_id":"CCMSLIB00017274798","spectrum_index":32268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 164.0838 Da; putative annotation: N/A; putative formula: C10H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.165,"smiles":null,"spectrum_id":"CCMSLIB00017274800","spectrum_index":32269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 197.0217 Da; putative annotation: N/A; putative formula: C4H12N3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.061,"smiles":null,"spectrum_id":"CCMSLIB00017274803","spectrum_index":32270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 97.0528 Da; putative annotation: L-Proline; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.118,"smiles":null,"spectrum_id":"CCMSLIB00017274806","spectrum_index":32271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Glu (delta mass: 113.0844 Da; putative annotation: L-Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017274808","spectrum_index":32272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 108.0211 Da; putative annotation: 1,3,5-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017274811","spectrum_index":32273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 104.061 Da; putative annotation: 3-Methylbenzenemethanol; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.168,"smiles":null,"spectrum_id":"CCMSLIB00017274814","spectrum_index":32274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 103.0418 Da; putative annotation: Benzamide; putative formula: C7H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.149,"smiles":null,"spectrum_id":"CCMSLIB00017274816","spectrum_index":32275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 162.0531 Da; putative annotation: D-Fructose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.282,"smiles":null,"spectrum_id":"CCMSLIB00017274819","spectrum_index":32276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 114.031 Da; putative annotation: Ethyl hydrogen malonate; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.102,"smiles":null,"spectrum_id":"CCMSLIB00017274821","spectrum_index":32277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 196.0673 Da; putative annotation: 3-Nitrobiphenyl-4-amine; putative formula: C12H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.194,"smiles":null,"spectrum_id":"CCMSLIB00017274824","spectrum_index":32278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 318.146 Da; putative annotation: N/A; putative formula: C12H23N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.237,"smiles":null,"spectrum_id":"CCMSLIB00017274827","spectrum_index":32279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 262.1548 Da; putative annotation: N/A; putative formula: C16H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.33,"smiles":null,"spectrum_id":"CCMSLIB00017274830","spectrum_index":32280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 88.0157 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.165,"smiles":null,"spectrum_id":"CCMSLIB00017274831","spectrum_index":32281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 178.1766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.316,"smiles":null,"spectrum_id":"CCMSLIB00017274834","spectrum_index":32282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 126.111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.206,"smiles":null,"spectrum_id":"CCMSLIB00017274837","spectrum_index":32283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 668.3043 Da; putative annotation: N/A; putative formula: C33H48O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.396,"smiles":null,"spectrum_id":"CCMSLIB00017274839","spectrum_index":32284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 160.1083 Da; putative annotation: N/A; putative formula: C4H12N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.205,"smiles":null,"spectrum_id":"CCMSLIB00017274841","spectrum_index":32285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 263.248 Da; putative annotation: N/A; putative formula: C15H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.345,"smiles":null,"spectrum_id":"CCMSLIB00017274843","spectrum_index":32286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 57.0216 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017274846","spectrum_index":32287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 60.0209 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.112,"smiles":null,"spectrum_id":"CCMSLIB00017274849","spectrum_index":32288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 583.3939 Da; putative annotation: N/A; putative formula: C29H53N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.542,"smiles":null,"spectrum_id":"CCMSLIB00017274850","spectrum_index":32289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 334.143 Da; putative annotation: N/A; putative formula: C19H18N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.302,"smiles":null,"spectrum_id":"CCMSLIB00017274853","spectrum_index":32290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 330.1437 Da; putative annotation: N/A; putative formula: C15H26N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.266,"smiles":null,"spectrum_id":"CCMSLIB00017274856","spectrum_index":32291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017274859","spectrum_index":32292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 71.985 Da; putative annotation: N/A; putative formula: C2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.045,"smiles":null,"spectrum_id":"CCMSLIB00017274860","spectrum_index":32293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 45.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.149,"smiles":null,"spectrum_id":"CCMSLIB00017274863","spectrum_index":32294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 61.0235 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.11,"smiles":null,"spectrum_id":"CCMSLIB00017274865","spectrum_index":32295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 142.1567 Da; putative annotation: N/A; putative formula: C7H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.295,"smiles":null,"spectrum_id":"CCMSLIB00017274867","spectrum_index":32296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA283009 Naltrexone|(5alpha)-17-(Cyclopropylmethyl)-3,14-dihydroxy-4,5-epoxymorphinan-6-one (delta mass: 17.07 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.24,"smiles":null,"spectrum_id":"CCMSLIB00017274870","spectrum_index":32297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 38.0153 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.07,"smiles":null,"spectrum_id":"CCMSLIB00017274873","spectrum_index":32298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 94.0753 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.087,"smiles":null,"spectrum_id":"CCMSLIB00017274875","spectrum_index":32299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 62.0849 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.155,"smiles":null,"spectrum_id":"CCMSLIB00017274878","spectrum_index":32300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 293.1524 Da; putative annotation: N/A; putative formula: C10H23N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.322,"smiles":null,"spectrum_id":"CCMSLIB00017274881","spectrum_index":32301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin analogue LVR (or VLR) (delta mass: 19.0139 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.301,"smiles":null,"spectrum_id":"CCMSLIB00017274884","spectrum_index":32302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 29.0266 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.087,"smiles":null,"spectrum_id":"CCMSLIB00017274886","spectrum_index":32303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 268.0398 Da; putative annotation: N/A; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.163,"smiles":null,"spectrum_id":"CCMSLIB00017274888","spectrum_index":32304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 444.3661 Da; putative annotation: N/A; putative formula: C27H48N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.5,"smiles":null,"spectrum_id":"CCMSLIB00017274891","spectrum_index":32305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 132.042 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.181,"smiles":null,"spectrum_id":"CCMSLIB00017274894","spectrum_index":32306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one (delta mass: 77.0497 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.126,"smiles":null,"spectrum_id":"CCMSLIB00017274897","spectrum_index":32307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 13.0033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.063,"smiles":null,"spectrum_id":"CCMSLIB00017274898","spectrum_index":32308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 179.0795 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.255,"smiles":null,"spectrum_id":"CCMSLIB00017274901","spectrum_index":32309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmane (delta mass: 45.1044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.196,"smiles":null,"spectrum_id":"CCMSLIB00017274904","spectrum_index":32310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 152.0727 Da; putative annotation: N/A; putative formula: C11H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.212,"smiles":null,"spectrum_id":"CCMSLIB00017274907","spectrum_index":32311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 341.1376 Da; putative annotation: N/A; putative formula: C18H19N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.229,"smiles":null,"spectrum_id":"CCMSLIB00017274908","spectrum_index":32312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 236.175 Da; putative annotation: N/A; putative formula: C11H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.246,"smiles":null,"spectrum_id":"CCMSLIB00017274911","spectrum_index":32313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 808.4184 Da; putative annotation: N/A; putative formula: C42H64O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1135.55,"smiles":null,"spectrum_id":"CCMSLIB00017274914","spectrum_index":32314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100304 N-alpha-Acetyl-L-ornithine|Ac-Orn|AOR|(2S)-2-acetamido-5-aminopentanoic acid|Nalpha-Acetyl-L-ornithine (delta mass: 129.0504 Da; putative annotation: N/A; putative formula: C3H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.158,"smiles":null,"spectrum_id":"CCMSLIB00017274917","spectrum_index":32315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 36.0724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.195,"smiles":null,"spectrum_id":"CCMSLIB00017274918","spectrum_index":32316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 36.0234 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.126,"smiles":null,"spectrum_id":"CCMSLIB00017274921","spectrum_index":32317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 161.0208 Da; putative annotation: N/A; putative formula: C3H-1N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.112,"smiles":null,"spectrum_id":"CCMSLIB00017274924","spectrum_index":32318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 208.0705 Da; putative annotation: N/A; putative formula: C7H16N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.151,"smiles":null,"spectrum_id":"CCMSLIB00017274927","spectrum_index":32319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 235.175 Da; putative annotation: N/A; putative formula: C15H25NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.255,"smiles":null,"spectrum_id":"CCMSLIB00017274928","spectrum_index":32320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 611.4231 Da; putative annotation: N/A; putative formula: C27H53N11O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.494,"smiles":null,"spectrum_id":"CCMSLIB00017274931","spectrum_index":32321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cassythicine (delta mass: 458.1471 Da; putative annotation: N/A; putative formula: C18H26N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.286,"smiles":null,"spectrum_id":"CCMSLIB00017274934","spectrum_index":32322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 153.0787 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.176,"smiles":null,"spectrum_id":"CCMSLIB00017274936","spectrum_index":32323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 102.0627 Da; putative annotation: N/A; putative formula: C4H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.145,"smiles":null,"spectrum_id":"CCMSLIB00017274938","spectrum_index":32324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 99.0629 Da; putative annotation: N/A; putative formula: C5H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.164,"smiles":null,"spectrum_id":"CCMSLIB00017274941","spectrum_index":32325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 16.8066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.96,"smiles":null,"spectrum_id":"CCMSLIB00017274944","spectrum_index":32326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 3-amino-4-methoxyindole-2-carboxylate CollisionEnergy:102040 (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.102,"smiles":null,"spectrum_id":"CCMSLIB00017274947","spectrum_index":32327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 749.5882 Da; putative annotation: N/A; putative formula: C39H75N9O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1416.82,"smiles":null,"spectrum_id":"CCMSLIB00017274948","spectrum_index":32328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 557.6879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1062.86,"smiles":null,"spectrum_id":"CCMSLIB00017274951","spectrum_index":32329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 59.1004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.166,"smiles":null,"spectrum_id":"CCMSLIB00017274954","spectrum_index":32330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 158.0216 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.087,"smiles":null,"spectrum_id":"CCMSLIB00017274955","spectrum_index":32331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 143.0579 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.128,"smiles":null,"spectrum_id":"CCMSLIB00017274958","spectrum_index":32332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 126.0316 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.118,"smiles":null,"spectrum_id":"CCMSLIB00017274961","spectrum_index":32333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nitro-2,4-quinolinediol (delta mass: 17.1346 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.175,"smiles":null,"spectrum_id":"CCMSLIB00017274964","spectrum_index":32334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-(4-Chlorophenyl)ethyl](methyl)amine (delta mass: 70.0351 Da; putative annotation: N/A; putative formula: C4H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.108,"smiles":null,"spectrum_id":"CCMSLIB00017274966","spectrum_index":32335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 60.0787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.196,"smiles":null,"spectrum_id":"CCMSLIB00017274968","spectrum_index":32336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 66.9728 Da; putative annotation: N/A; putative formula: CH-2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.054,"smiles":null,"spectrum_id":"CCMSLIB00017274971","spectrum_index":32337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 51.0222 Da; putative annotation: N/A; putative formula: C2HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.12,"smiles":null,"spectrum_id":"CCMSLIB00017274974","spectrum_index":32338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carboxylic acid, ethyl ester (delta mass: 57.0563 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.143,"smiles":null,"spectrum_id":"CCMSLIB00017274977","spectrum_index":32339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.108,"smiles":null,"spectrum_id":"CCMSLIB00017274978","spectrum_index":32340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 174.1538 Da; putative annotation: N/A; putative formula: C12H18N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.22,"smiles":null,"spectrum_id":"CCMSLIB00017274981","spectrum_index":32341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 246.0374 Da; putative annotation: N/A; putative formula: C9H10O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.134,"smiles":null,"spectrum_id":"CCMSLIB00017274984","spectrum_index":32342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 70.9999 Da; putative annotation: N/A; putative formula: C2HNO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.07,"smiles":null,"spectrum_id":"CCMSLIB00017274985","spectrum_index":32343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 9.9806 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017274988","spectrum_index":32344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 47.9899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.05,"smiles":null,"spectrum_id":"CCMSLIB00017274991","spectrum_index":32345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 31.9469 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.059,"smiles":null,"spectrum_id":"CCMSLIB00017274993","spectrum_index":32346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Pro (delta mass: 113.084 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.187,"smiles":null,"spectrum_id":"CCMSLIB00017274996","spectrum_index":32347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 368.1929 Da; putative annotation: N/A; putative formula: C30H24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.284,"smiles":null,"spectrum_id":"CCMSLIB00017274999","spectrum_index":32348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300259 Gelsemine (delta mass: 63.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.244,"smiles":null,"spectrum_id":"CCMSLIB00017275001","spectrum_index":32349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 103.029 Da; putative annotation: N/A; putative formula: C4HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.109,"smiles":null,"spectrum_id":"CCMSLIB00017275004","spectrum_index":32350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 50.0411 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.092,"smiles":null,"spectrum_id":"CCMSLIB00017275007","spectrum_index":32351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 60.9888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.054,"smiles":null,"spectrum_id":"CCMSLIB00017275009","spectrum_index":32352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 39.078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.126,"smiles":null,"spectrum_id":"CCMSLIB00017275011","spectrum_index":32353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 46.0067 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.093,"smiles":null,"spectrum_id":"CCMSLIB00017275014","spectrum_index":32354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Phe (delta mass: 113.0825 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.253,"smiles":null,"spectrum_id":"CCMSLIB00017275017","spectrum_index":32355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 25.0022 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.078,"smiles":null,"spectrum_id":"CCMSLIB00017275019","spectrum_index":32356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 32.0273 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.166,"smiles":null,"spectrum_id":"CCMSLIB00017275022","spectrum_index":32357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 132.036 Da; putative annotation: N/A; putative formula: C4H8N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.143,"smiles":null,"spectrum_id":"CCMSLIB00017275025","spectrum_index":32358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 55.0422 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017275027","spectrum_index":32359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 68.0501 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.085,"smiles":null,"spectrum_id":"CCMSLIB00017275029","spectrum_index":32360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 92.0456 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.189,"smiles":null,"spectrum_id":"CCMSLIB00017275032","spectrum_index":32361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 166.0476 Da; putative annotation: N/A; putative formula: C5H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.207,"smiles":null,"spectrum_id":"CCMSLIB00017275035","spectrum_index":32362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[3-[3-Hydroxy-4-(4-hydroxyphenyl)-2,5-dimethoxyphenyl]-5-oxo-2H-furan-2-yl]acetic acid (delta mass: 121.019 Da; putative annotation: N/A; putative formula: C5H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.126,"smiles":null,"spectrum_id":"CCMSLIB00017275037","spectrum_index":32363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 184.0347 Da; putative annotation: N/A; putative formula: C12H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.105,"smiles":null,"spectrum_id":"CCMSLIB00017275039","spectrum_index":32364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 102.0831 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017275042","spectrum_index":32365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 471.158 Da; putative annotation: N/A; putative formula: C30H21N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.229,"smiles":null,"spectrum_id":"CCMSLIB00017275045","spectrum_index":32366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 601.4778 Da; putative annotation: N/A; putative formula: C31H63N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":932.632,"smiles":null,"spectrum_id":"CCMSLIB00017275047","spectrum_index":32367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 284.3084 Da; putative annotation: N/A; putative formula: C15H36N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.379,"smiles":null,"spectrum_id":"CCMSLIB00017275049","spectrum_index":32368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 116.0833 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.217,"smiles":null,"spectrum_id":"CCMSLIB00017275052","spectrum_index":32369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 27.9923 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.042,"smiles":null,"spectrum_id":"CCMSLIB00017275055","spectrum_index":32370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 390.2767 Da; putative annotation: N/A; putative formula: C24H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.4,"smiles":null,"spectrum_id":"CCMSLIB00017275056","spectrum_index":32371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 417.1576 Da; putative annotation: N/A; putative formula: C25H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.239,"smiles":null,"spectrum_id":"CCMSLIB00017275059","spectrum_index":32372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 366.3588 Da; putative annotation: N/A; putative formula: C19H42N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.4,"smiles":null,"spectrum_id":"CCMSLIB00017275062","spectrum_index":32373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 56.9786 Da; putative annotation: N/A; putative formula: H-1N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.08,"smiles":null,"spectrum_id":"CCMSLIB00017275063","spectrum_index":32374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 112.1657 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.193,"smiles":null,"spectrum_id":"CCMSLIB00017275066","spectrum_index":32375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 64.0675 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.31,"smiles":null,"spectrum_id":"CCMSLIB00017275069","spectrum_index":32376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 174.0146 Da; putative annotation: N/A; putative formula: C3H6N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.143,"smiles":null,"spectrum_id":"CCMSLIB00017275072","spectrum_index":32377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 752.2181 Da; putative annotation: N/A; putative formula: C35H36N4O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.278,"smiles":null,"spectrum_id":"CCMSLIB00017275073","spectrum_index":32378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 169.1441 Da; putative annotation: N/A; putative formula: C6H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.273,"smiles":null,"spectrum_id":"CCMSLIB00017275076","spectrum_index":32379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 484.3554 Da; putative annotation: N/A; putative formula: C31H48O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.453,"smiles":null,"spectrum_id":"CCMSLIB00017275079","spectrum_index":32380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 402.3703 Da; putative annotation: N/A; putative formula: C25H46N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.457,"smiles":null,"spectrum_id":"CCMSLIB00017275080","spectrum_index":32381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 26.0334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.06,"smiles":null,"spectrum_id":"CCMSLIB00017275083","spectrum_index":32382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 74.036 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017275086","spectrum_index":32383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 75.0314 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.091,"smiles":null,"spectrum_id":"CCMSLIB00017275089","spectrum_index":32384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 60.9602 Da; putative annotation: N/A; putative formula: H-1NOS)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.025,"smiles":null,"spectrum_id":"CCMSLIB00017275090","spectrum_index":32385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 551.194 Da; putative annotation: N/A; putative formula: C25H33N3O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.235,"smiles":null,"spectrum_id":"CCMSLIB00017275093","spectrum_index":32386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TURANOSE (delta mass: 357.1212 Da; putative annotation: N/A; putative formula: C19H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.245,"smiles":null,"spectrum_id":"CCMSLIB00017275096","spectrum_index":32387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 148.0696 Da; putative annotation: N/A; putative formula: C2H8N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.203,"smiles":null,"spectrum_id":"CCMSLIB00017275097","spectrum_index":32388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 100.052 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017275100","spectrum_index":32389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.186,"smiles":null,"spectrum_id":"CCMSLIB00017275103","spectrum_index":32390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 217.0955 Da; putative annotation: N/A; putative formula: C10H19NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.156,"smiles":null,"spectrum_id":"CCMSLIB00017275106","spectrum_index":32391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 371.1588 Da; putative annotation: N/A; putative formula: C18H29NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.245,"smiles":null,"spectrum_id":"CCMSLIB00017275107","spectrum_index":32392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 143.0578 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.155,"smiles":null,"spectrum_id":"CCMSLIB00017275110","spectrum_index":32393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 124.1607 Da; putative annotation: N/A; putative formula: C10H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.242,"smiles":null,"spectrum_id":"CCMSLIB00017275113","spectrum_index":32394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 96.0158 Da; putative annotation: N/A; putative formula: C4H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.988,"smiles":null,"spectrum_id":"CCMSLIB00017275115","spectrum_index":32395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 294.2556 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.379,"smiles":null,"spectrum_id":"CCMSLIB00017275117","spectrum_index":32396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine (delta mass: 342.2384 Da; putative annotation: N/A; putative formula: C23H34S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.502,"smiles":null,"spectrum_id":"CCMSLIB00017275120","spectrum_index":32397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 160.1099 Da; putative annotation: N/A; putative formula: C8H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.263,"smiles":null,"spectrum_id":"CCMSLIB00017275123","spectrum_index":32398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 343.2209 Da; putative annotation: N/A; putative formula: C17H34N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.291,"smiles":null,"spectrum_id":"CCMSLIB00017275126","spectrum_index":32399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.18,"smiles":null,"spectrum_id":"CCMSLIB00017275127","spectrum_index":32400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 87.0354 Da; putative annotation: N/A; putative formula: C2H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.121,"smiles":null,"spectrum_id":"CCMSLIB00017275130","spectrum_index":32401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 315.1682 Da; putative annotation: N/A; putative formula: C15H25NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.239,"smiles":null,"spectrum_id":"CCMSLIB00017275132","spectrum_index":32402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1,N1-dimethyl-N2-phenyl-1,2-ethanediamine (delta mass: 44.015 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.154,"smiles":null,"spectrum_id":"CCMSLIB00017275134","spectrum_index":32403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 44.9667 Da; putative annotation: N/A; putative formula: C25H37N9O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.045,"smiles":null,"spectrum_id":"CCMSLIB00017275137","spectrum_index":32404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 563.2292 Da; putative annotation: N/A; putative formula: C39H35NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":744.27,"smiles":null,"spectrum_id":"CCMSLIB00017275140","spectrum_index":32405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 26.0202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.111,"smiles":null,"spectrum_id":"CCMSLIB00017275143","spectrum_index":32406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 435.2219 Da; putative annotation: N/A; putative formula: C18H33N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.302,"smiles":null,"spectrum_id":"CCMSLIB00017275144","spectrum_index":32407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 275.3941 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.67,"smiles":null,"spectrum_id":"CCMSLIB00017275147","spectrum_index":32408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 10.0078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.156,"smiles":null,"spectrum_id":"CCMSLIB00017275149","spectrum_index":32409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 239.1285 Da; putative annotation: N/A; putative formula: C12H13N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.19,"smiles":null,"spectrum_id":"CCMSLIB00017275152","spectrum_index":32410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 98.0987 Da; putative annotation: N/A; putative formula: C4H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.238,"smiles":null,"spectrum_id":"CCMSLIB00017275155","spectrum_index":32411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 16.0066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.098,"smiles":null,"spectrum_id":"CCMSLIB00017275157","spectrum_index":32412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-methoxyphenyl)propylamine CollisionEnergy:102040 (delta mass: 240.0491 Da; putative annotation: N/A; putative formula: C8H16O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.172,"smiles":null,"spectrum_id":"CCMSLIB00017275160","spectrum_index":32413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptoline CollisionEnergy:102040 (delta mass: 264.2461 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.353,"smiles":null,"spectrum_id":"CCMSLIB00017275163","spectrum_index":32414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.134,"smiles":null,"spectrum_id":"CCMSLIB00017275165","spectrum_index":32415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP) (delta mass: 62.0324 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.146,"smiles":null,"spectrum_id":"CCMSLIB00017275167","spectrum_index":32416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 175.992 Da; putative annotation: N/A; putative formula: C3H5N4OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.057,"smiles":null,"spectrum_id":"CCMSLIB00017275170","spectrum_index":32417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 226.0747 Da; putative annotation: N/A; putative formula: C10H14N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.349,"smiles":null,"spectrum_id":"CCMSLIB00017275173","spectrum_index":32418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isomuronic acid (delta mass: 305.2561 Da; putative annotation: N/A; putative formula: C17H31N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.504,"smiles":null,"spectrum_id":"CCMSLIB00017275176","spectrum_index":32419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1074.5633 Da; putative annotation: N/A; putative formula: C68H70N10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1237.62,"smiles":null,"spectrum_id":"CCMSLIB00017275178","spectrum_index":32420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 57.036 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.227,"smiles":null,"spectrum_id":"CCMSLIB00017275180","spectrum_index":32421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 79.0424 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017275183","spectrum_index":32422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 250.1998 Da; putative annotation: N/A; putative formula: C11H22N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.248,"smiles":null,"spectrum_id":"CCMSLIB00017275186","spectrum_index":32423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 156.1518 Da; putative annotation: N/A; putative formula: C10H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.197,"smiles":null,"spectrum_id":"CCMSLIB00017275188","spectrum_index":32424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 302.0642 Da; putative annotation: N/A; putative formula: C15H15N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.103,"smiles":null,"spectrum_id":"CCMSLIB00017275191","spectrum_index":32425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 196.0734 Da; putative annotation: N/A; putative formula: C10H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.178,"smiles":null,"spectrum_id":"CCMSLIB00017275194","spectrum_index":32426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 320.2715 Da; putative annotation: N/A; putative formula: C21H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.347,"smiles":null,"spectrum_id":"CCMSLIB00017275197","spectrum_index":32427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 91.1007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.265,"smiles":null,"spectrum_id":"CCMSLIB00017275198","spectrum_index":32428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 208.0734 Da; putative annotation: N/A; putative formula: C11H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.123,"smiles":null,"spectrum_id":"CCMSLIB00017275201","spectrum_index":32429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 54.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.211,"smiles":null,"spectrum_id":"CCMSLIB00017275204","spectrum_index":32430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 152.0364 Da; putative annotation: N/A; putative formula: C4H5N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.175,"smiles":null,"spectrum_id":"CCMSLIB00017275207","spectrum_index":32431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 318.1829 Da; putative annotation: N/A; putative formula: C19H26O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.243,"smiles":null,"spectrum_id":"CCMSLIB00017275208","spectrum_index":32432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 92.0624 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017275211","spectrum_index":32433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 42.0194 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017275214","spectrum_index":32434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 218.0693 Da; putative annotation: N/A; putative formula: C11H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.134,"smiles":null,"spectrum_id":"CCMSLIB00017275216","spectrum_index":32435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[1-(Aminomethyl)cyclopentyl]acetic acid (delta mass: 145.8824 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.0,"smiles":null,"spectrum_id":"CCMSLIB00017275219","spectrum_index":32436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Prodigiosin (delta mass: 14.0046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.212,"smiles":null,"spectrum_id":"CCMSLIB00017275221","spectrum_index":32437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 70.103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.169,"smiles":null,"spectrum_id":"CCMSLIB00017275224","spectrum_index":32438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reserpic acid (delta mass: 378.2087 Da; putative annotation: N/A; putative formula: C21H27N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.416,"smiles":null,"spectrum_id":"CCMSLIB00017275227","spectrum_index":32439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 41.0219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.07,"smiles":null,"spectrum_id":"CCMSLIB00017275229","spectrum_index":32440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 84.0573 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.16,"smiles":null,"spectrum_id":"CCMSLIB00017275232","spectrum_index":32441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 174.0684 Da; putative annotation: N/A; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.149,"smiles":null,"spectrum_id":"CCMSLIB00017275235","spectrum_index":32442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 205.9977 Da; putative annotation: N/A; putative formula: C6H7O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.075,"smiles":null,"spectrum_id":"CCMSLIB00017275237","spectrum_index":32443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-3-(3,4-Dimethoxyphenyl)prop-2-enamide (delta mass: 27.0336 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.13,"smiles":null,"spectrum_id":"CCMSLIB00017275240","spectrum_index":32444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 50.9055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.982,"smiles":null,"spectrum_id":"CCMSLIB00017275243","spectrum_index":32445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 121.0194 Da; putative annotation: N/A; putative formula: C5H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.106,"smiles":null,"spectrum_id":"CCMSLIB00017275244","spectrum_index":32446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 66.0469 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.196,"smiles":null,"spectrum_id":"CCMSLIB00017275247","spectrum_index":32447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 14.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.091,"smiles":null,"spectrum_id":"CCMSLIB00017275250","spectrum_index":32448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 178.063 Da; putative annotation: N/A; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017275252","spectrum_index":32449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 162.0525 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.149,"smiles":null,"spectrum_id":"CCMSLIB00017275254","spectrum_index":32450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 235.106 Da; putative annotation: N/A; putative formula: C9H17NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.187,"smiles":null,"spectrum_id":"CCMSLIB00017275257","spectrum_index":32451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 113.0837 Da; putative annotation: NORLEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.228,"smiles":null,"spectrum_id":"CCMSLIB00017275260","spectrum_index":32452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyl-L-threonine (delta mass: 129.0425 Da; putative annotation: O-Acetyl-L-serine; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.124,"smiles":null,"spectrum_id":"CCMSLIB00017275263","spectrum_index":32453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 130.0423 Da; putative annotation: Massbank:PR304055 p-Coumaraldehyde; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.166,"smiles":null,"spectrum_id":"CCMSLIB00017275264","spectrum_index":32454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 113.084 Da; putative annotation: 6-Aminocaproic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.155,"smiles":null,"spectrum_id":"CCMSLIB00017275267","spectrum_index":32455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RIBITOL (delta mass: 224.0692 Da; putative annotation: Lumichrome; putative formula: C12H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.145,"smiles":null,"spectrum_id":"CCMSLIB00017275270","spectrum_index":32456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 104.0257 Da; putative annotation: 4-hydroxybenzaldehyde CollisionEnergy:102040; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.112,"smiles":null,"spectrum_id":"CCMSLIB00017275272","spectrum_index":32457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 120.0688 Da; putative annotation: 4(1H)-Pyrimidinone, 6-(1-methylethyl)-; putative formula: C7H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017275274","spectrum_index":32458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 116.057 Da; putative annotation: (2S)-2-Amino-4-(aminooxy)butanoic acid; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.164,"smiles":null,"spectrum_id":"CCMSLIB00017275277","spectrum_index":32459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of Massbank:PB000474 Tyramine|4-(2-aminoethyl)phenol (delta mass: 146.0577 Da; putative annotation: \"\"1,5-ANHYDRO-GLUCITOL\"\"; putative formula: C6H10O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.149,"smiles":null,"spectrum_id":"CCMSLIB00017275280","spectrum_index":32460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 59.0369 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.097,"smiles":null,"spectrum_id":"CCMSLIB00017275283","spectrum_index":32461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 126.0312 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.086,"smiles":null,"spectrum_id":"CCMSLIB00017275284","spectrum_index":32462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 659.355 Da; putative annotation: N/A; putative formula: C50H45N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":841.473,"smiles":null,"spectrum_id":"CCMSLIB00017275287","spectrum_index":32463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 221.0697 Da; putative annotation: N/A; putative formula: C12H15NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.14,"smiles":null,"spectrum_id":"CCMSLIB00017275290","spectrum_index":32464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE10; MS2Dec (delta mass: 119.0575 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.164,"smiles":null,"spectrum_id":"CCMSLIB00017275292","spectrum_index":32465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 413.1971 Da; putative annotation: N/A; putative formula: C20H32NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.283,"smiles":null,"spectrum_id":"CCMSLIB00017275294","spectrum_index":32466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 27.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.155,"smiles":null,"spectrum_id":"CCMSLIB00017275297","spectrum_index":32467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 292.1142 Da; putative annotation: N/A; putative formula: C9H12N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.263,"smiles":null,"spectrum_id":"CCMSLIB00017275300","spectrum_index":32468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Allyl-2,6-dimethoxyphenol (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017275301","spectrum_index":32469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 54.0885 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.164,"smiles":null,"spectrum_id":"CCMSLIB00017275304","spectrum_index":32470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indazole-3-carboxamide, N-[1-(aminocarbonyl)-2-methylpropyl]-1-(5-fluoro-4-hydroxypentyl)- (delta mass: 59.1701 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.368,"smiles":null,"spectrum_id":"CCMSLIB00017275307","spectrum_index":32471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 72.0668 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.122,"smiles":null,"spectrum_id":"CCMSLIB00017275308","spectrum_index":32472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 300.2222 Da; putative annotation: N/A; putative formula: C17H33O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.287,"smiles":null,"spectrum_id":"CCMSLIB00017275311","spectrum_index":32473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380746-01!1,7-bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 258.1047 Da; putative annotation: N/A; putative formula: C19H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.279,"smiles":null,"spectrum_id":"CCMSLIB00017275313","spectrum_index":32474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 290.0482 Da; putative annotation: N/A; putative formula: C13H6N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.139,"smiles":null,"spectrum_id":"CCMSLIB00017275315","spectrum_index":32475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Berberrubine (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.123,"smiles":null,"spectrum_id":"CCMSLIB00017275318","spectrum_index":32476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE30; CorrDec (delta mass: 29.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.118,"smiles":null,"spectrum_id":"CCMSLIB00017275321","spectrum_index":32477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 85.9951 Da; putative annotation: N/A; putative formula: C2H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.967,"smiles":null,"spectrum_id":"CCMSLIB00017275322","spectrum_index":32478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 86.022 Da; putative annotation: N/A; putative formula: CH2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.149,"smiles":null,"spectrum_id":"CCMSLIB00017275325","spectrum_index":32479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 631.323 Da; putative annotation: N/A; putative formula: C32H41N9O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.441,"smiles":null,"spectrum_id":"CCMSLIB00017275328","spectrum_index":32480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 427.3812 Da; putative annotation: N/A; putative formula: C29H49NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.441,"smiles":null,"spectrum_id":"CCMSLIB00017275330","spectrum_index":32481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 28.0966 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.14,"smiles":null,"spectrum_id":"CCMSLIB00017275333","spectrum_index":32482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 302.1198 Da; putative annotation: N/A; putative formula: C15H26S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.18,"smiles":null,"spectrum_id":"CCMSLIB00017275335","spectrum_index":32483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 911.4876 Da; putative annotation: N/A; putative formula: C44H61N15O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.56,"smiles":null,"spectrum_id":"CCMSLIB00017275338","spectrum_index":32484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 189.1002 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.171,"smiles":null,"spectrum_id":"CCMSLIB00017275340","spectrum_index":32485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dichloro-1H-indole-2-carboxylic acid (delta mass: 46.0641 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.041,"smiles":null,"spectrum_id":"CCMSLIB00017275343","spectrum_index":32486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 662.603 Da; putative annotation: N/A; putative formula: C43H82O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.726,"smiles":null,"spectrum_id":"CCMSLIB00017275345","spectrum_index":32487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 14.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017275347","spectrum_index":32488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 94.0486 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.144,"smiles":null,"spectrum_id":"CCMSLIB00017275350","spectrum_index":32489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reserpic acid (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.228,"smiles":null,"spectrum_id":"CCMSLIB00017275353","spectrum_index":32490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 372.2167 Da; putative annotation: N/A; putative formula: C20H28N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.303,"smiles":null,"spectrum_id":"CCMSLIB00017275356","spectrum_index":32491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 143.0584 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.182,"smiles":null,"spectrum_id":"CCMSLIB00017275357","spectrum_index":32492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 2.314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.5,"smiles":null,"spectrum_id":"CCMSLIB00017275360","spectrum_index":32493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 43.0545 Da; putative annotation: N/A; putative formula: CH5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.141,"smiles":null,"spectrum_id":"CCMSLIB00017275363","spectrum_index":32494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 42.0118 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.291,"smiles":null,"spectrum_id":"CCMSLIB00017275364","spectrum_index":32495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 153.0791 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.171,"smiles":null,"spectrum_id":"CCMSLIB00017275367","spectrum_index":32496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-O-Methylvisamminol (delta mass: 27.0473 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.17,"smiles":null,"spectrum_id":"CCMSLIB00017275370","spectrum_index":32497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 531.2993 Da; putative annotation: N/A; putative formula: C34H45NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.37,"smiles":null,"spectrum_id":"CCMSLIB00017275371","spectrum_index":32498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 869.4774 Da; putative annotation: N/A; putative formula: C44H71NO16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1032.54,"smiles":null,"spectrum_id":"CCMSLIB00017275374","spectrum_index":32499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 203.0797 Da; putative annotation: N/A; putative formula: C8H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.281,"smiles":null,"spectrum_id":"CCMSLIB00017275377","spectrum_index":32500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 134.0368 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.108,"smiles":null,"spectrum_id":"CCMSLIB00017275380","spectrum_index":32501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 278.1663 Da; putative annotation: N/A; putative formula: C12H26N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.437,"smiles":null,"spectrum_id":"CCMSLIB00017275381","spectrum_index":32502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 100.0304 Da; putative annotation: N/A; putative formula: C2H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.096,"smiles":null,"spectrum_id":"CCMSLIB00017275384","spectrum_index":32503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 59.0469 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017275387","spectrum_index":32504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 365.1685 Da; putative annotation: N/A; putative formula: C13H15N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.239,"smiles":null,"spectrum_id":"CCMSLIB00017275388","spectrum_index":32505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[4-(dimethylamino)butyl]isothiourea (delta mass: 55.0486 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.17,"smiles":null,"spectrum_id":"CCMSLIB00017275391","spectrum_index":32506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 262.2293 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.337,"smiles":null,"spectrum_id":"CCMSLIB00017275394","spectrum_index":32507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyloxycarbonylglycine (delta mass: 147.0534 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.129,"smiles":null,"spectrum_id":"CCMSLIB00017275396","spectrum_index":32508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 228.2088 Da; putative annotation: N/A; putative formula: C14H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.248,"smiles":null,"spectrum_id":"CCMSLIB00017275399","spectrum_index":32509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 60.0 eV (delta mass: 153.0415 Da; putative annotation: N/A; putative formula: CH8N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.133,"smiles":null,"spectrum_id":"CCMSLIB00017275402","spectrum_index":32510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 214.158 Da; putative annotation: N/A; putative formula: C13H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.265,"smiles":null,"spectrum_id":"CCMSLIB00017275404","spectrum_index":32511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 138.0631 Da; putative annotation: N/A; putative formula: C7H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.165,"smiles":null,"spectrum_id":"CCMSLIB00017275407","spectrum_index":32512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 180.0242 Da; putative annotation: N/A; putative formula: C11H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.1,"smiles":null,"spectrum_id":"CCMSLIB00017275410","spectrum_index":32513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 168.1261 Da; putative annotation: N/A; putative formula: C9H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.239,"smiles":null,"spectrum_id":"CCMSLIB00017275412","spectrum_index":32514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 138.0522 Da; putative annotation: N/A; putative formula: CH2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.092,"smiles":null,"spectrum_id":"CCMSLIB00017275414","spectrum_index":32515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 144.0404 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.127,"smiles":null,"spectrum_id":"CCMSLIB00017275417","spectrum_index":32516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 69.0196 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.106,"smiles":null,"spectrum_id":"CCMSLIB00017275420","spectrum_index":32517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 580.185 Da; putative annotation: N/A; putative formula: C36H29N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":815.245,"smiles":null,"spectrum_id":"CCMSLIB00017275422","spectrum_index":32518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 241.1149 Da; putative annotation: N/A; putative formula: C12H21NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.219,"smiles":null,"spectrum_id":"CCMSLIB00017275424","spectrum_index":32519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 197.0237 Da; putative annotation: N/A; putative formula: C3H3N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.158,"smiles":null,"spectrum_id":"CCMSLIB00017275427","spectrum_index":32520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 56.0057 Da; putative annotation: N/A; putative formula: C6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.087,"smiles":null,"spectrum_id":"CCMSLIB00017275430","spectrum_index":32521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 242.0192 Da; putative annotation: N/A; putative formula: C6H11O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.272,"smiles":null,"spectrum_id":"CCMSLIB00017275433","spectrum_index":32522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 180.1683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.239,"smiles":null,"spectrum_id":"CCMSLIB00017275435","spectrum_index":32523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 62.0494 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.173,"smiles":null,"spectrum_id":"CCMSLIB00017275437","spectrum_index":32524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Butoxyethanol (delta mass: 38.0517 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.158,"smiles":null,"spectrum_id":"CCMSLIB00017275440","spectrum_index":32525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 39.0119 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.114,"smiles":null,"spectrum_id":"CCMSLIB00017275443","spectrum_index":32526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 22.4192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.5,"smiles":null,"spectrum_id":"CCMSLIB00017275445","spectrum_index":32527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 200.1417 Da; putative annotation: N/A; putative formula: C11H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.223,"smiles":null,"spectrum_id":"CCMSLIB00017275448","spectrum_index":32528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 488.2024 Da; putative annotation: N/A; putative formula: C23H40N2OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.283,"smiles":null,"spectrum_id":"CCMSLIB00017275450","spectrum_index":32529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 864.3954 Da; putative annotation: N/A; putative formula: C49H60N4O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.51,"smiles":null,"spectrum_id":"CCMSLIB00017275453","spectrum_index":32530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 731.3758 Da; putative annotation: N/A; putative formula: C34H58N3O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.493,"smiles":null,"spectrum_id":"CCMSLIB00017275455","spectrum_index":32531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 568.377 Da; putative annotation: N/A; putative formula: C27H58N2O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.437,"smiles":null,"spectrum_id":"CCMSLIB00017275458","spectrum_index":32532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 52.516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.587,"smiles":null,"spectrum_id":"CCMSLIB00017275460","spectrum_index":32533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 601.522 Da; putative annotation: N/A; putative formula: C42H67NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":787.593,"smiles":null,"spectrum_id":"CCMSLIB00017275463","spectrum_index":32534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 60.0096 Da; putative annotation: N/A; putative formula: C4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.149,"smiles":null,"spectrum_id":"CCMSLIB00017275466","spectrum_index":32535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 278.0681 Da; putative annotation: N/A; putative formula: C10H11N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.217,"smiles":null,"spectrum_id":"CCMSLIB00017275468","spectrum_index":32536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 48.0132 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.11,"smiles":null,"spectrum_id":"CCMSLIB00017275470","spectrum_index":32537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 45.0217 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.066,"smiles":null,"spectrum_id":"CCMSLIB00017275473","spectrum_index":32538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 55.0045 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.055,"smiles":null,"spectrum_id":"CCMSLIB00017275476","spectrum_index":32539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 62.0493 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.12,"smiles":null,"spectrum_id":"CCMSLIB00017275478","spectrum_index":32540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 188.1016 Da; putative annotation: N/A; putative formula: C5H12N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.144,"smiles":null,"spectrum_id":"CCMSLIB00017275481","spectrum_index":32541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 263.1849 Da; putative annotation: N/A; putative formula: C11H25N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.339,"smiles":null,"spectrum_id":"CCMSLIB00017275483","spectrum_index":32542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 277.2009 Da; putative annotation: N/A; putative formula: C13H23N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.354,"smiles":null,"spectrum_id":"CCMSLIB00017275486","spectrum_index":32543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 72.0367 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017275488","spectrum_index":32544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 17.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.077,"smiles":null,"spectrum_id":"CCMSLIB00017275491","spectrum_index":32545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 74.062 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017275494","spectrum_index":32546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 294.2149 Da; putative annotation: N/A; putative formula: C10H22N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.38,"smiles":null,"spectrum_id":"CCMSLIB00017275496","spectrum_index":32547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 32.0224 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.103,"smiles":null,"spectrum_id":"CCMSLIB00017275498","spectrum_index":32548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-trans-Hydroxynorcotinine (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.066,"smiles":null,"spectrum_id":"CCMSLIB00017275501","spectrum_index":32549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 364.316 Da; putative annotation: N/A; putative formula: C24H44S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.412,"smiles":null,"spectrum_id":"CCMSLIB00017275504","spectrum_index":32550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 63.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.207,"smiles":null,"spectrum_id":"CCMSLIB00017275507","spectrum_index":32551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 149.1927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.341,"smiles":null,"spectrum_id":"CCMSLIB00017275508","spectrum_index":32552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 114.039 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.115,"smiles":null,"spectrum_id":"CCMSLIB00017275511","spectrum_index":32553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 519.091 Da; putative annotation: N/A; putative formula: C23H13N13O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.13,"smiles":null,"spectrum_id":"CCMSLIB00017275514","spectrum_index":32554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 110.0412 Da; putative annotation: N/A; putative formula: C5H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.227,"smiles":null,"spectrum_id":"CCMSLIB00017275515","spectrum_index":32555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 97.0423 Da; putative annotation: N/A; putative formula: C5H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.139,"smiles":null,"spectrum_id":"CCMSLIB00017275518","spectrum_index":32556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanylleucine (delta mass: 113.0847 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.224,"smiles":null,"spectrum_id":"CCMSLIB00017275521","spectrum_index":32557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 300.1812 Da; putative annotation: N/A; putative formula: C14H20N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.32,"smiles":null,"spectrum_id":"CCMSLIB00017275523","spectrum_index":32558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 98.0367 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.212,"smiles":null,"spectrum_id":"CCMSLIB00017275525","spectrum_index":32559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 36.0362 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.31,"smiles":null,"spectrum_id":"CCMSLIB00017275528","spectrum_index":32560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 31.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017275530","spectrum_index":32561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 36.013 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.134,"smiles":null,"spectrum_id":"CCMSLIB00017275533","spectrum_index":32562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 112.0623 Da; putative annotation: N/A; putative formula: CH4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.175,"smiles":null,"spectrum_id":"CCMSLIB00017275536","spectrum_index":32563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 73.0956 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.191,"smiles":null,"spectrum_id":"CCMSLIB00017275538","spectrum_index":32564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoajmaline (delta mass: 199.2251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.432,"smiles":null,"spectrum_id":"CCMSLIB00017275540","spectrum_index":32565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 162.9253 Da; putative annotation: N/A; putative formula: CH-2N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.03,"smiles":null,"spectrum_id":"CCMSLIB00017275543","spectrum_index":32566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Pro (delta mass: 99.0689 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.166,"smiles":null,"spectrum_id":"CCMSLIB00017275546","spectrum_index":32567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2,3-Dihydro-1H-perimidin-2-yl)-1,2-benzenediol (delta mass: 18.0896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.202,"smiles":null,"spectrum_id":"CCMSLIB00017275548","spectrum_index":32568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Amino-5,8-difluorospiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)picolinonitrile (delta mass: 146.0623 Da; putative annotation: N/A; putative formula: C4H10N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.205,"smiles":null,"spectrum_id":"CCMSLIB00017275550","spectrum_index":32569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 91.9583 Da; putative annotation: N/A; putative formula: CH2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.05,"smiles":null,"spectrum_id":"CCMSLIB00017275553","spectrum_index":32570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylenetetramine (delta mass: 185.9497 Da; putative annotation: N/A; putative formula: C4H2N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.11,"smiles":null,"spectrum_id":"CCMSLIB00017275555","spectrum_index":32571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenylethylamine (delta mass: 35.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.154,"smiles":null,"spectrum_id":"CCMSLIB00017275557","spectrum_index":32572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetamide (delta mass: 166.9873 Da; putative annotation: N/A; putative formula: C7H5NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.074,"smiles":null,"spectrum_id":"CCMSLIB00017275560","spectrum_index":32573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 14.0301 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.09,"smiles":null,"spectrum_id":"CCMSLIB00017275563","spectrum_index":32574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gabapentin Related Compound E (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.081,"smiles":null,"spectrum_id":"CCMSLIB00017275565","spectrum_index":32575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 41.0628 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.196,"smiles":null,"spectrum_id":"CCMSLIB00017275567","spectrum_index":32576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML01010 Demecolcine (delta mass: 68.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.239,"smiles":null,"spectrum_id":"CCMSLIB00017275570","spectrum_index":32577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-4-methylpentanoic acid (delta mass: 114.0681 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017275573","spectrum_index":32578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 107.0646 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.145,"smiles":null,"spectrum_id":"CCMSLIB00017275574","spectrum_index":32579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 146.0729 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.149,"smiles":null,"spectrum_id":"CCMSLIB00017275577","spectrum_index":32580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 134.004 Da; putative annotation: N/A; putative formula: C4H6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.116,"smiles":null,"spectrum_id":"CCMSLIB00017275580","spectrum_index":32581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 149.0841 Da; putative annotation: N/A; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.192,"smiles":null,"spectrum_id":"CCMSLIB00017275581","spectrum_index":32582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirubactin (delta mass: 209.072 Da; putative annotation: N/A; putative formula: C7H15NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.292,"smiles":null,"spectrum_id":"CCMSLIB00017275584","spectrum_index":32583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyl-L-threonine (delta mass: 129.0429 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.124,"smiles":null,"spectrum_id":"CCMSLIB00017275587","spectrum_index":32584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nitrazepam (delta mass: 27.0014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.089,"smiles":null,"spectrum_id":"CCMSLIB00017275590","spectrum_index":32585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 198.1093 Da; putative annotation: N/A; putative formula: C11H20O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.18,"smiles":null,"spectrum_id":"CCMSLIB00017275592","spectrum_index":32586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 156.0536 Da; putative annotation: N/A; putative formula: C6H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.161,"smiles":null,"spectrum_id":"CCMSLIB00017275594","spectrum_index":32587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 117.0106 Da; putative annotation: N/A; putative formula: CH3N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.154,"smiles":null,"spectrum_id":"CCMSLIB00017275597","spectrum_index":32588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cysmethynil (delta mass: 18.0331 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.292,"smiles":null,"spectrum_id":"CCMSLIB00017275600","spectrum_index":32589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paxilline (delta mass: 18.0071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.255,"smiles":null,"spectrum_id":"CCMSLIB00017275603","spectrum_index":32590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 56.0347 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.157,"smiles":null,"spectrum_id":"CCMSLIB00017275605","spectrum_index":32591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 97.0532 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.124,"smiles":null,"spectrum_id":"CCMSLIB00017275607","spectrum_index":32592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 14.8261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.944,"smiles":null,"spectrum_id":"CCMSLIB00017275610","spectrum_index":32593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.066,"smiles":null,"spectrum_id":"CCMSLIB00017275613","spectrum_index":32594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 66.0469 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.128,"smiles":null,"spectrum_id":"CCMSLIB00017275616","spectrum_index":32595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 47.1699 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.274,"smiles":null,"spectrum_id":"CCMSLIB00017275618","spectrum_index":32596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 253.1301 Da; putative annotation: N/A; putative formula: C17H19NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.228,"smiles":null,"spectrum_id":"CCMSLIB00017275621","spectrum_index":32597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 476.1641 Da; putative annotation: N/A; putative formula: C19H28N2O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.224,"smiles":null,"spectrum_id":"CCMSLIB00017275624","spectrum_index":32598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 309.121 Da; putative annotation: N/A; putative formula: C15H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.275,"smiles":null,"spectrum_id":"CCMSLIB00017275626","spectrum_index":32599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 187.0568 Da; putative annotation: N/A; putative formula: C10H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.17,"smiles":null,"spectrum_id":"CCMSLIB00017275629","spectrum_index":32600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 381.1729 Da; putative annotation: N/A; putative formula: C26H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.234,"smiles":null,"spectrum_id":"CCMSLIB00017275632","spectrum_index":32601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 180.1146 Da; putative annotation: N/A; putative formula: C11H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.195,"smiles":null,"spectrum_id":"CCMSLIB00017275633","spectrum_index":32602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 109.042 Da; putative annotation: N/A; putative formula: C6H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.185,"smiles":null,"spectrum_id":"CCMSLIB00017275636","spectrum_index":32603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 314.1743 Da; putative annotation: N/A; putative formula: C17H22N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.323,"smiles":null,"spectrum_id":"CCMSLIB00017275639","spectrum_index":32604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 41.7582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.897,"smiles":null,"spectrum_id":"CCMSLIB00017275642","spectrum_index":32605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 378.224 Da; putative annotation: N/A; putative formula: C15H26N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.299,"smiles":null,"spectrum_id":"CCMSLIB00017275645","spectrum_index":32606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 84.0165 Da; putative annotation: N/A; putative formula: N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.051,"smiles":null,"spectrum_id":"CCMSLIB00017275646","spectrum_index":32607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 112.05 Da; putative annotation: N/A; putative formula: C2H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.147,"smiles":null,"spectrum_id":"CCMSLIB00017275649","spectrum_index":32608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 379.2386 Da; putative annotation: N/A; putative formula: C20H34N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.309,"smiles":null,"spectrum_id":"CCMSLIB00017275652","spectrum_index":32609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 251.1771 Da; putative annotation: N/A; putative formula: C17H21N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.272,"smiles":null,"spectrum_id":"CCMSLIB00017275655","spectrum_index":32610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 43.9969 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.056,"smiles":null,"spectrum_id":"CCMSLIB00017275657","spectrum_index":32611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 142.0514 Da; putative annotation: N/A; putative formula: C3H7N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017275659","spectrum_index":32612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 1479.598 Da; putative annotation: N/A; putative formula: C60H101N7O31S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1647.7,"smiles":null,"spectrum_id":"CCMSLIB00017275662","spectrum_index":32613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 4.9972 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.056,"smiles":null,"spectrum_id":"CCMSLIB00017275665","spectrum_index":32614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myrtucommulone B (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.249,"smiles":null,"spectrum_id":"CCMSLIB00017275668","spectrum_index":32615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 175.0473 Da; putative annotation: N/A; putative formula: C3HN11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.217,"smiles":null,"spectrum_id":"CCMSLIB00017275669","spectrum_index":32616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 94.0056 Da; putative annotation: N/A; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.092,"smiles":null,"spectrum_id":"CCMSLIB00017275672","spectrum_index":32617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 76.0329 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.115,"smiles":null,"spectrum_id":"CCMSLIB00017275675","spectrum_index":32618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 924.5392 Da; putative annotation: N/A; putative formula: C41H72N12O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1591.77,"smiles":null,"spectrum_id":"CCMSLIB00017275677","spectrum_index":32619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Di-p-coumaroylputrescine (delta mass: 99.0678 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.249,"smiles":null,"spectrum_id":"CCMSLIB00017275679","spectrum_index":32620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-8-methoxy-5H-pyrimido[5,4-b]indole (delta mass: 15.0328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017275682","spectrum_index":32621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-quinolin-4-yl(5-vinylquinuclidin-2-yl)methanol (delta mass: 307.2973 Da; putative annotation: N/A; putative formula: C19H37N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.478,"smiles":null,"spectrum_id":"CCMSLIB00017275685","spectrum_index":32622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 122.0372 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.134,"smiles":null,"spectrum_id":"CCMSLIB00017275687","spectrum_index":32623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4-(Difluoromethoxy)-3-methoxyphenyl]methanamine (delta mass: 165.0701 Da; putative annotation: N/A; putative formula: C9H12NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.153,"smiles":null,"spectrum_id":"CCMSLIB00017275689","spectrum_index":32624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 84.0216 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017275692","spectrum_index":32625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 623.5073 Da; putative annotation: N/A; putative formula: C44H65NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":809.579,"smiles":null,"spectrum_id":"CCMSLIB00017275695","spectrum_index":32626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 110.0223 Da; putative annotation: N/A; putative formula: C3H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.103,"smiles":null,"spectrum_id":"CCMSLIB00017275697","spectrum_index":32627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 10.0292 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017275699","spectrum_index":32628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 276.0843 Da; putative annotation: N/A; putative formula: C11H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017275702","spectrum_index":32629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 115.0382 Da; putative annotation: N/A; putative formula: C3H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.114,"smiles":null,"spectrum_id":"CCMSLIB00017275705","spectrum_index":32630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-2-Hydroxycinnamic acid (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.06,"smiles":null,"spectrum_id":"CCMSLIB00017275707","spectrum_index":32631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 113.0478 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017275709","spectrum_index":32632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 49.0318 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017275712","spectrum_index":32633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-QUINOLINECARBOXYLIC ACID - 70.0 eV (delta mass: 133.8445 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.9,"smiles":null,"spectrum_id":"CCMSLIB00017275715","spectrum_index":32634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.186,"smiles":null,"spectrum_id":"CCMSLIB00017275718","spectrum_index":32635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 63.0482 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.135,"smiles":null,"spectrum_id":"CCMSLIB00017275719","spectrum_index":32636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 803.3086 Da; putative annotation: N/A; putative formula: C34H45N9O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":984.379,"smiles":null,"spectrum_id":"CCMSLIB00017275722","spectrum_index":32637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 664.9233 Da; putative annotation: N/A; putative formula: C10H15N5O21P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":975.037,"smiles":null,"spectrum_id":"CCMSLIB00017275725","spectrum_index":32638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 223.1209 Da; putative annotation: N/A; putative formula: C12H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.223,"smiles":null,"spectrum_id":"CCMSLIB00017275728","spectrum_index":32639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 58.0826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.222,"smiles":null,"spectrum_id":"CCMSLIB00017275729","spectrum_index":32640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 381.0199 Da; putative annotation: N/A; putative formula: C23H12NO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.117,"smiles":null,"spectrum_id":"CCMSLIB00017275732","spectrum_index":32641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Val (delta mass: 99.0687 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.187,"smiles":null,"spectrum_id":"CCMSLIB00017275735","spectrum_index":32642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 16.9533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.029,"smiles":null,"spectrum_id":"CCMSLIB00017275738","spectrum_index":32643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 627.4182 Da; putative annotation: N/A; putative formula: C35H57N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.567,"smiles":null,"spectrum_id":"CCMSLIB00017275741","spectrum_index":32644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 57.0856 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.144,"smiles":null,"spectrum_id":"CCMSLIB00017275742","spectrum_index":32645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 915.5202 Da; putative annotation: N/A; putative formula: C68H69NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1096.59,"smiles":null,"spectrum_id":"CCMSLIB00017275745","spectrum_index":32646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 597.2522 Da; putative annotation: N/A; putative formula: C32H35N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.293,"smiles":null,"spectrum_id":"CCMSLIB00017275748","spectrum_index":32647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 154.0747 Da; putative annotation: N/A; putative formula: C7H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.155,"smiles":null,"spectrum_id":"CCMSLIB00017275749","spectrum_index":32648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311014 Feruloyl agmatine (isomer of 1607) (delta mass: 86.0367 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.213,"smiles":null,"spectrum_id":"CCMSLIB00017275752","spectrum_index":32649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 521.4289 Da; putative annotation: N/A; putative formula: C32H61NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.577,"smiles":null,"spectrum_id":"CCMSLIB00017275755","spectrum_index":32650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 170.0579 Da; putative annotation: N/A; putative formula: C8H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017275757","spectrum_index":32651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 99.0673 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.117,"smiles":null,"spectrum_id":"CCMSLIB00017275759","spectrum_index":32652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 125.0939 Da; putative annotation: N/A; putative formula: C6H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.164,"smiles":null,"spectrum_id":"CCMSLIB00017275763","spectrum_index":32653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 27.977 Da; putative annotation: N/A; putative formula: CO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.053,"smiles":null,"spectrum_id":"CCMSLIB00017275765","spectrum_index":32654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 162.125 Da; putative annotation: N/A; putative formula: C9H14N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.284,"smiles":null,"spectrum_id":"CCMSLIB00017275768","spectrum_index":32655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 68.0625 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.353,"smiles":null,"spectrum_id":"CCMSLIB00017275771","spectrum_index":32656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 310.2139 Da; putative annotation: N/A; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.264,"smiles":null,"spectrum_id":"CCMSLIB00017275772","spectrum_index":32657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 88.0522 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.117,"smiles":null,"spectrum_id":"CCMSLIB00017275775","spectrum_index":32658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ajmaline (delta mass: 246.1525 Da; putative annotation: N/A; putative formula: C10H24N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.359,"smiles":null,"spectrum_id":"CCMSLIB00017275777","spectrum_index":32659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 279.0248 Da; putative annotation: N/A; putative formula: C10H9N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.096,"smiles":null,"spectrum_id":"CCMSLIB00017275779","spectrum_index":32660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 794.4536 Da; putative annotation: N/A; putative formula: C57H64O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1001.54,"smiles":null,"spectrum_id":"CCMSLIB00017275782","spectrum_index":32661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 64.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.239,"smiles":null,"spectrum_id":"CCMSLIB00017275785","spectrum_index":32662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 45.083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.169,"smiles":null,"spectrum_id":"CCMSLIB00017275787","spectrum_index":32663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 84.0216 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017275789","spectrum_index":32664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.097,"smiles":null,"spectrum_id":"CCMSLIB00017275792","spectrum_index":32665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 59.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.145,"smiles":null,"spectrum_id":"CCMSLIB00017275795","spectrum_index":32666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Norepinephrine (delta mass: 202.0477 Da; putative annotation: N/A; putative formula: C8H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.129,"smiles":null,"spectrum_id":"CCMSLIB00017275798","spectrum_index":32667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 40.0679 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.164,"smiles":null,"spectrum_id":"CCMSLIB00017275799","spectrum_index":32668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 90.1021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017275802","spectrum_index":32669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 234.2973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.43,"smiles":null,"spectrum_id":"CCMSLIB00017275805","spectrum_index":32670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 37.9789 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.06,"smiles":null,"spectrum_id":"CCMSLIB00017275806","spectrum_index":32671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 168.115 Da; putative annotation: 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl-; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.18,"smiles":null,"spectrum_id":"CCMSLIB00017275809","spectrum_index":32672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Ile (delta mass: 224.1166 Da; putative annotation: 3-[5-(2-Methylpropyl)-3,6-dioxopiperazin-2-yl]propanoic acid; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.277,"smiles":null,"spectrum_id":"CCMSLIB00017275812","spectrum_index":32673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 198.1245 Da; putative annotation: Virginiaebutanolide C; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.257,"smiles":null,"spectrum_id":"CCMSLIB00017275814","spectrum_index":32674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 104.0264 Da; putative annotation: 4-Hydroxybenzaldehyde; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.086,"smiles":null,"spectrum_id":"CCMSLIB00017275816","spectrum_index":32675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 131.036 Da; putative annotation: Indole-2,3-diol; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.112,"smiles":null,"spectrum_id":"CCMSLIB00017275819","spectrum_index":32676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 200.0584 Da; putative annotation: 4-Amino-6-methoxy-3-quinolinecarboxylic acid; putative formula: C11H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.129,"smiles":null,"spectrum_id":"CCMSLIB00017275822","spectrum_index":32677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 576.1538 Da; putative annotation: Saponarin; putative formula: C27H28O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.213,"smiles":null,"spectrum_id":"CCMSLIB00017275825","spectrum_index":32678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000701322-01!2-phenyl-1H-indole (delta mass: 223.0991 Da; putative annotation: Mefenamic acid; putative formula: C15H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.195,"smiles":null,"spectrum_id":"CCMSLIB00017275826","spectrum_index":32679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 67.0426 Da; putative annotation: 2-Pyrrolidinone; AIF; CE10; CorrDec; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.129,"smiles":null,"spectrum_id":"CCMSLIB00017275829","spectrum_index":32680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"Benzo[a]phenanthridine-10,11-diol, 5,6,6a,7,8,12b-hexahydro-, trans- [CAS]\"\" (delta mass: 158.9968 Da; putative annotation: N/A; putative formula: CHN7OS)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.13,"smiles":null,"spectrum_id":"CCMSLIB00017275832","spectrum_index":32681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 645.338 Da; putative annotation: N/A; putative formula: C33H51N5O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":827.456,"smiles":null,"spectrum_id":"CCMSLIB00017275834","spectrum_index":32682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 591.3461 Da; putative annotation: N/A; putative formula: C38H45N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.401,"smiles":null,"spectrum_id":"CCMSLIB00017275836","spectrum_index":32683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 539.3676 Da; putative annotation: N/A; putative formula: C37H50NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.516,"smiles":null,"spectrum_id":"CCMSLIB00017275839","spectrum_index":32684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 23.0051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.091,"smiles":null,"spectrum_id":"CCMSLIB00017275842","spectrum_index":32685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 240.0234 Da; putative annotation: N/A; putative formula: C7H15O3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.14,"smiles":null,"spectrum_id":"CCMSLIB00017275844","spectrum_index":32686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 318.0943 Da; putative annotation: N/A; putative formula: C18H14N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.243,"smiles":null,"spectrum_id":"CCMSLIB00017275846","spectrum_index":32687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 603.2921 Da; putative annotation: N/A; putative formula: C27H46N3O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":785.41,"smiles":null,"spectrum_id":"CCMSLIB00017275849","spectrum_index":32688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 354.3138 Da; putative annotation: N/A; putative formula: C22H42O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.351,"smiles":null,"spectrum_id":"CCMSLIB00017275852","spectrum_index":32689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 40.0171 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.093,"smiles":null,"spectrum_id":"CCMSLIB00017275854","spectrum_index":32690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 66.0108 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.081,"smiles":null,"spectrum_id":"CCMSLIB00017275856","spectrum_index":32691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 63.0298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.127,"smiles":null,"spectrum_id":"CCMSLIB00017275859","spectrum_index":32692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 160.0338 Da; putative annotation: N/A; putative formula: C4H9N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.129,"smiles":null,"spectrum_id":"CCMSLIB00017275862","spectrum_index":32693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 213.1351 Da; putative annotation: N/A; putative formula: C7H15N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.284,"smiles":null,"spectrum_id":"CCMSLIB00017275865","spectrum_index":32694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 142.0784 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.144,"smiles":null,"spectrum_id":"CCMSLIB00017275867","spectrum_index":32695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N''-(4,6-Dimethyl-2-pyrimidinyl)-N-[2-(4-methoxyphenyl)ethyl]guanidine (delta mass: 100.0666 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.249,"smiles":null,"spectrum_id":"CCMSLIB00017275870","spectrum_index":32696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 97.0528 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.155,"smiles":null,"spectrum_id":"CCMSLIB00017275872","spectrum_index":32697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Thr (delta mass: 99.0687 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.203,"smiles":null,"spectrum_id":"CCMSLIB00017275875","spectrum_index":32698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 54.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017275877","spectrum_index":32699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 43.0056 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.097,"smiles":null,"spectrum_id":"CCMSLIB00017275880","spectrum_index":32700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 256.1149 Da; putative annotation: N/A; putative formula: C14H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.185,"smiles":null,"spectrum_id":"CCMSLIB00017275883","spectrum_index":32701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 214.1307 Da; putative annotation: N/A; putative formula: C12H23O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.259,"smiles":null,"spectrum_id":"CCMSLIB00017275885","spectrum_index":32702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 17.4493 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.52,"smiles":null,"spectrum_id":"CCMSLIB00017275888","spectrum_index":32703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole; LC-tDDA; CE30 (delta mass: 36.0015 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.061,"smiles":null,"spectrum_id":"CCMSLIB00017275890","spectrum_index":32704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 117.0576 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.108,"smiles":null,"spectrum_id":"CCMSLIB00017275893","spectrum_index":32705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-[4-(methylethyl)phenyl]prop-2-enoic acid CollisionEnergy:102040 (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.102,"smiles":null,"spectrum_id":"CCMSLIB00017275896","spectrum_index":32706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 308.0065 Da; putative annotation: N/A; putative formula: C6H14O10P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.275,"smiles":null,"spectrum_id":"CCMSLIB00017275897","spectrum_index":32707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 536.2797 Da; putative annotation: N/A; putative formula: C26H36N10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.366,"smiles":null,"spectrum_id":"CCMSLIB00017275900","spectrum_index":32708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 91.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017275903","spectrum_index":32709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 327.156 Da; putative annotation: N/A; putative formula: C14H17N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.3,"smiles":null,"spectrum_id":"CCMSLIB00017275905","spectrum_index":32710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 236.2156 Da; putative annotation: N/A; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.401,"smiles":null,"spectrum_id":"CCMSLIB00017275908","spectrum_index":32711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 97.0638 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.172,"smiles":null,"spectrum_id":"CCMSLIB00017275910","spectrum_index":32712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 509.202 Da; putative annotation: N/A; putative formula: C34H28N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.273,"smiles":null,"spectrum_id":"CCMSLIB00017275913","spectrum_index":32713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 303.6666 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.753,"smiles":null,"spectrum_id":"CCMSLIB00017275915","spectrum_index":32714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin D (delta mass: 603.2906 Da; putative annotation: N/A; putative formula: C29H41N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.476,"smiles":null,"spectrum_id":"CCMSLIB00017275918","spectrum_index":32715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[1-(Aminomethyl)cyclopentyl]acetic acid (delta mass: 246.2351 Da; putative annotation: N/A; putative formula: C18H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.353,"smiles":null,"spectrum_id":"CCMSLIB00017275920","spectrum_index":32716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alsterpaullone (delta mass: 115.0199 Da; putative annotation: N/A; putative formula: C3H5N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.107,"smiles":null,"spectrum_id":"CCMSLIB00017275923","spectrum_index":32717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 84.0939 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.362,"smiles":null,"spectrum_id":"CCMSLIB00017275926","spectrum_index":32718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 114.0466 Da; putative annotation: N/A; putative formula: C9H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.143,"smiles":null,"spectrum_id":"CCMSLIB00017275927","spectrum_index":32719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 178.9336 Da; putative annotation: N/A; putative formula: C3HNO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.009,"smiles":null,"spectrum_id":"CCMSLIB00017275930","spectrum_index":32720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 121.0235 Da; putative annotation: N/A; putative formula: H3N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.173,"smiles":null,"spectrum_id":"CCMSLIB00017275933","spectrum_index":32721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 148.0381 Da; putative annotation: N/A; putative formula: C6H12S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.119,"smiles":null,"spectrum_id":"CCMSLIB00017275934","spectrum_index":32722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Amino-4-ethoxyphenyl)acetamide (delta mass: 30.9945 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017275937","spectrum_index":32723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-methyl-4-phenylbutanoic acid (delta mass: 32.005 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.123,"smiles":null,"spectrum_id":"CCMSLIB00017275940","spectrum_index":32724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 366.2768 Da; putative annotation: N/A; putative formula: C22H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.358,"smiles":null,"spectrum_id":"CCMSLIB00017275943","spectrum_index":32725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 47.0085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.079,"smiles":null,"spectrum_id":"CCMSLIB00017275946","spectrum_index":32726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 39.0203 Da; putative annotation: N/A; putative formula: CHN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017275949","spectrum_index":32727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 244.1314 Da; putative annotation: N/A; putative formula: C12H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.197,"smiles":null,"spectrum_id":"CCMSLIB00017275950","spectrum_index":32728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 17.8953 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.961,"smiles":null,"spectrum_id":"CCMSLIB00017275953","spectrum_index":32729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 43.0185 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.115,"smiles":null,"spectrum_id":"CCMSLIB00017275956","spectrum_index":32730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-2-carboxylic acid (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.039,"smiles":null,"spectrum_id":"CCMSLIB00017275959","spectrum_index":32731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 102.0679 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.148,"smiles":null,"spectrum_id":"CCMSLIB00017275961","spectrum_index":32732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Gly-Ile from NIST14 (delta mass: 71.0371 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.16,"smiles":null,"spectrum_id":"CCMSLIB00017275963","spectrum_index":32733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 183.1516 Da; putative annotation: N/A; putative formula: C11H22NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.243,"smiles":null,"spectrum_id":"CCMSLIB00017275966","spectrum_index":32734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 210.1979 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.256,"smiles":null,"spectrum_id":"CCMSLIB00017275969","spectrum_index":32735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 24.9954 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.03,"smiles":null,"spectrum_id":"CCMSLIB00017275970","spectrum_index":32736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 125.0169 Da; putative annotation: N/A; putative formula: C3H3N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.033,"smiles":null,"spectrum_id":"CCMSLIB00017275973","spectrum_index":32737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 369.1684 Da; putative annotation: N/A; putative formula: C22H28NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.291,"smiles":null,"spectrum_id":"CCMSLIB00017275976","spectrum_index":32738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 200.1187 Da; putative annotation: N/A; putative formula: C8H17N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.184,"smiles":null,"spectrum_id":"CCMSLIB00017275978","spectrum_index":32739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 67.0427 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.108,"smiles":null,"spectrum_id":"CCMSLIB00017275981","spectrum_index":32740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 360.1207 Da; putative annotation: N/A; putative formula: C14H25N4OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.16,"smiles":null,"spectrum_id":"CCMSLIB00017275984","spectrum_index":32741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 17.9371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.024,"smiles":null,"spectrum_id":"CCMSLIB00017275986","spectrum_index":32742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 327.1017 Da; putative annotation: N/A; putative formula: C13H13N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.255,"smiles":null,"spectrum_id":"CCMSLIB00017275988","spectrum_index":32743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 144.1492 Da; putative annotation: N/A; putative formula: C5H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.236,"smiles":null,"spectrum_id":"CCMSLIB00017275990","spectrum_index":32744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 127.0995 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.17,"smiles":null,"spectrum_id":"CCMSLIB00017275993","spectrum_index":32745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 162.0483 Da; putative annotation: N/A; putative formula: C5H12N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.14,"smiles":null,"spectrum_id":"CCMSLIB00017275996","spectrum_index":32746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Carbazole-1-carboxamide, 6-chloro-2,3,4,9-tetrahydro- (delta mass: 46.144 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.223,"smiles":null,"spectrum_id":"CCMSLIB00017275997","spectrum_index":32747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 650.5417 Da; putative annotation: N/A; putative formula: C41H71N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":836.613,"smiles":null,"spectrum_id":"CCMSLIB00017276000","spectrum_index":32748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 74.0371 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.165,"smiles":null,"spectrum_id":"CCMSLIB00017276003","spectrum_index":32749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 248.9645 Da; putative annotation: N/A; putative formula: C5H7N5O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.056,"smiles":null,"spectrum_id":"CCMSLIB00017276006","spectrum_index":32750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 51.0475 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017276007","spectrum_index":32751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 232.1096 Da; putative annotation: N/A; putative formula: C14H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017276011","spectrum_index":32752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 113.0635 Da; putative annotation: N/A; putative formula: C9H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.171,"smiles":null,"spectrum_id":"CCMSLIB00017276013","spectrum_index":32753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-3-ylmethanamine (delta mass: 67.0337 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.121,"smiles":null,"spectrum_id":"CCMSLIB00017276016","spectrum_index":32754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 50.0726 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.137,"smiles":null,"spectrum_id":"CCMSLIB00017276019","spectrum_index":32755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 601.5111 Da; putative annotation: N/A; putative formula: C28H63N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":839.597,"smiles":null,"spectrum_id":"CCMSLIB00017276020","spectrum_index":32756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 129.0792 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017276023","spectrum_index":32757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Ergothioneine (delta mass: 173.0473 Da; putative annotation: N/A; putative formula: C10H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.143,"smiles":null,"spectrum_id":"CCMSLIB00017276026","spectrum_index":32758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxobenzo[cd]indol-1(2H)-yl)acetic acid (delta mass: 269.0423 Da; putative annotation: N/A; putative formula: C15H12NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.108,"smiles":null,"spectrum_id":"CCMSLIB00017276029","spectrum_index":32759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 16.0349 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.13,"smiles":null,"spectrum_id":"CCMSLIB00017276030","spectrum_index":32760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 59.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.16,"smiles":null,"spectrum_id":"CCMSLIB00017276033","spectrum_index":32761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 536.2136 Da; putative annotation: N/A; putative formula: C33H32N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":865.482,"smiles":null,"spectrum_id":"CCMSLIB00017276036","spectrum_index":32762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 320.1756 Da; putative annotation: N/A; putative formula: C15H29O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.288,"smiles":null,"spectrum_id":"CCMSLIB00017276039","spectrum_index":32763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 31.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.175,"smiles":null,"spectrum_id":"CCMSLIB00017276042","spectrum_index":32764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 242.2019 Da; putative annotation: N/A; putative formula: C12H27N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.273,"smiles":null,"spectrum_id":"CCMSLIB00017276044","spectrum_index":32765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 218.2036 Da; putative annotation: N/A; putative formula: C16H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.316,"smiles":null,"spectrum_id":"CCMSLIB00017276047","spectrum_index":32766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 356.2937 Da; putative annotation: N/A; putative formula: C22H44O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.417,"smiles":null,"spectrum_id":"CCMSLIB00017276049","spectrum_index":32767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 332.1832 Da; putative annotation: N/A; putative formula: C16H28O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.254,"smiles":null,"spectrum_id":"CCMSLIB00017276052","spectrum_index":32768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 216.1058 Da; putative annotation: N/A; putative formula: C8H18N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.229,"smiles":null,"spectrum_id":"CCMSLIB00017276054","spectrum_index":32769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 70.042 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.09,"smiles":null,"spectrum_id":"CCMSLIB00017276057","spectrum_index":32770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 42.9929 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.137,"smiles":null,"spectrum_id":"CCMSLIB00017276060","spectrum_index":32771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 5.0063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.018,"smiles":null,"spectrum_id":"CCMSLIB00017276062","spectrum_index":32772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 275.1584 Da; putative annotation: N/A; putative formula: C15H21N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.229,"smiles":null,"spectrum_id":"CCMSLIB00017276064","spectrum_index":32773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 5.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.18,"smiles":null,"spectrum_id":"CCMSLIB00017276067","spectrum_index":32774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 489.3078 Da; putative annotation: N/A; putative formula: C32H45NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.436,"smiles":null,"spectrum_id":"CCMSLIB00017276070","spectrum_index":32775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 205.0823 Da; putative annotation: N/A; putative formula: C6H7N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.164,"smiles":null,"spectrum_id":"CCMSLIB00017276071","spectrum_index":32776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Nitro-1-propenyl)indole (delta mass: 67.0068 Da; putative annotation: N/A; putative formula: C3HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.088,"smiles":null,"spectrum_id":"CCMSLIB00017276074","spectrum_index":32777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 239.166 Da; putative annotation: N/A; putative formula: C17H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.245,"smiles":null,"spectrum_id":"CCMSLIB00017276077","spectrum_index":32778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxycinnamic acid (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.081,"smiles":null,"spectrum_id":"CCMSLIB00017276080","spectrum_index":32779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoajmaline (delta mass: 367.414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.621,"smiles":null,"spectrum_id":"CCMSLIB00017276081","spectrum_index":32780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 461.2773 Da; putative annotation: N/A; putative formula: C26H39NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.348,"smiles":null,"spectrum_id":"CCMSLIB00017276084","spectrum_index":32781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 69.013 Da; putative annotation: N/A; putative formula: C3H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.093,"smiles":null,"spectrum_id":"CCMSLIB00017276087","spectrum_index":32782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 552.1969 Da; putative annotation: N/A; putative formula: C26H28N6O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.238,"smiles":null,"spectrum_id":"CCMSLIB00017276090","spectrum_index":32783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 66.0114 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.14,"smiles":null,"spectrum_id":"CCMSLIB00017276092","spectrum_index":32784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 103.0417 Da; putative annotation: N/A; putative formula: C7H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.154,"smiles":null,"spectrum_id":"CCMSLIB00017276094","spectrum_index":32785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 1028.2478 Da; putative annotation: N/A; putative formula: C54H36N12O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1533.42,"smiles":null,"spectrum_id":"CCMSLIB00017276097","spectrum_index":32786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 116.9166 Da; putative annotation: N/A; putative formula: C2H-1NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.004,"smiles":null,"spectrum_id":"CCMSLIB00017276100","spectrum_index":32787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 492.2356 Da; putative annotation: N/A; putative formula: C26H36O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.301,"smiles":null,"spectrum_id":"CCMSLIB00017276103","spectrum_index":32788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 215.137 Da; putative annotation: N/A; putative formula: C8H17N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.207,"smiles":null,"spectrum_id":"CCMSLIB00017276104","spectrum_index":32789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 75.9982 Da; putative annotation: N/A; putative formula: C2H4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.046,"smiles":null,"spectrum_id":"CCMSLIB00017276107","spectrum_index":32790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 78.0473 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017276110","spectrum_index":32791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 57.032 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.097,"smiles":null,"spectrum_id":"CCMSLIB00017276112","spectrum_index":32792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 65.0698 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.15,"smiles":null,"spectrum_id":"CCMSLIB00017276114","spectrum_index":32793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 74.0206 Da; putative annotation: N/A; putative formula: C3H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.107,"smiles":null,"spectrum_id":"CCMSLIB00017276117","spectrum_index":32794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 108.0214 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017276120","spectrum_index":32795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 44.0616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.158,"smiles":null,"spectrum_id":"CCMSLIB00017276122","spectrum_index":32796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 31.0381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.192,"smiles":null,"spectrum_id":"CCMSLIB00017276125","spectrum_index":32797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 129.042 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.218,"smiles":null,"spectrum_id":"CCMSLIB00017276127","spectrum_index":32798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 69.0578 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.145,"smiles":null,"spectrum_id":"CCMSLIB00017276130","spectrum_index":32799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 122.1494 Da; putative annotation: N/A; putative formula: C10H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.329,"smiles":null,"spectrum_id":"CCMSLIB00017276132","spectrum_index":32800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 97.0634 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.135,"smiles":null,"spectrum_id":"CCMSLIB00017276135","spectrum_index":32801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017276138","spectrum_index":32802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 102.0693 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.14,"smiles":null,"spectrum_id":"CCMSLIB00017276140","spectrum_index":32803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 54.03 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.101,"smiles":null,"spectrum_id":"CCMSLIB00017276142","spectrum_index":32804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS001331725-01!(9-oxo-10(9H)-acridinyl)acetic acid (delta mass: 15.0108 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.092,"smiles":null,"spectrum_id":"CCMSLIB00017276145","spectrum_index":32805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 29.0265 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.129,"smiles":null,"spectrum_id":"CCMSLIB00017276148","spectrum_index":32806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 107.0736 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.197,"smiles":null,"spectrum_id":"CCMSLIB00017276150","spectrum_index":32807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 266.2975 Da; putative annotation: N/A; putative formula: C19H38)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.368,"smiles":null,"spectrum_id":"CCMSLIB00017276152","spectrum_index":32808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 78.055 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.055,"smiles":null,"spectrum_id":"CCMSLIB00017276155","spectrum_index":32809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 143.1421 Da; putative annotation: N/A; putative formula: C7H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.192,"smiles":null,"spectrum_id":"CCMSLIB00017276158","spectrum_index":32810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 66.028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.187,"smiles":null,"spectrum_id":"CCMSLIB00017276160","spectrum_index":32811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 98.0415 Da; putative annotation: N/A; putative formula: C4H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.122,"smiles":null,"spectrum_id":"CCMSLIB00017276163","spectrum_index":32812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatinine (delta mass: 343.2101 Da; putative annotation: N/A; putative formula: C18H34NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.276,"smiles":null,"spectrum_id":"CCMSLIB00017276166","spectrum_index":32813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 206.1673 Da; putative annotation: N/A; putative formula: C14H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.268,"smiles":null,"spectrum_id":"CCMSLIB00017276168","spectrum_index":32814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-HYDANTOIN (delta mass: 41.997 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.047,"smiles":null,"spectrum_id":"CCMSLIB00017276171","spectrum_index":32815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 86.0367 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.112,"smiles":null,"spectrum_id":"CCMSLIB00017276174","spectrum_index":32816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 65.0178 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.113,"smiles":null,"spectrum_id":"CCMSLIB00017276175","spectrum_index":32817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 61.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.165,"smiles":null,"spectrum_id":"CCMSLIB00017276178","spectrum_index":32818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 50.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.186,"smiles":null,"spectrum_id":"CCMSLIB00017276181","spectrum_index":32819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 231.0712 Da; putative annotation: N/A; putative formula: C5H9N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.22,"smiles":null,"spectrum_id":"CCMSLIB00017276183","spectrum_index":32820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 60.0361 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.107,"smiles":null,"spectrum_id":"CCMSLIB00017276185","spectrum_index":32821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.118,"smiles":null,"spectrum_id":"CCMSLIB00017276189","spectrum_index":32822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 154.1144 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017276191","spectrum_index":32823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 39.0081 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.074,"smiles":null,"spectrum_id":"CCMSLIB00017276194","spectrum_index":32824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Diphenyl-1H-indole-7-carboxylic acid (delta mass: 212.1433 Da; putative annotation: N/A; putative formula: C13H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.261,"smiles":null,"spectrum_id":"CCMSLIB00017276197","spectrum_index":32825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 308.2426 Da; putative annotation: N/A; putative formula: C14H28N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.339,"smiles":null,"spectrum_id":"CCMSLIB00017276199","spectrum_index":32826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 168.0944 Da; putative annotation: N/A; putative formula: C13H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.16,"smiles":null,"spectrum_id":"CCMSLIB00017276201","spectrum_index":32827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 95.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.15,"smiles":null,"spectrum_id":"CCMSLIB00017276204","spectrum_index":32828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dimethyloxallylglycine (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.066,"smiles":null,"spectrum_id":"CCMSLIB00017276206","spectrum_index":32829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.122,"smiles":null,"spectrum_id":"CCMSLIB00017276209","spectrum_index":32830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,7,8-trimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.113,"smiles":null,"spectrum_id":"CCMSLIB00017276212","spectrum_index":32831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 217.1498 Da; putative annotation: N/A; putative formula: C11H23NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.256,"smiles":null,"spectrum_id":"CCMSLIB00017276214","spectrum_index":32832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 229.1507 Da; putative annotation: N/A; putative formula: C12H25NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.257,"smiles":null,"spectrum_id":"CCMSLIB00017276216","spectrum_index":32833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 100.0307 Da; putative annotation: N/A; putative formula: C2H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017276220","spectrum_index":32834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 149.1048 Da; putative annotation: N/A; putative formula: C7H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.17,"smiles":null,"spectrum_id":"CCMSLIB00017276223","spectrum_index":32835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 291.1478 Da; putative annotation: N/A; putative formula: C17H25NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.219,"smiles":null,"spectrum_id":"CCMSLIB00017276226","spectrum_index":32836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100300 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole (delta mass: 173.0888 Da; putative annotation: N/A; putative formula: C8H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.137,"smiles":null,"spectrum_id":"CCMSLIB00017276228","spectrum_index":32837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 74.1196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017276231","spectrum_index":32838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 183.9115 Da; putative annotation: N/A; putative formula: C2O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.977,"smiles":null,"spectrum_id":"CCMSLIB00017276233","spectrum_index":32839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-threonine; AIF; CE0; CorrDec (delta mass: 101.0483 Da; putative annotation: MFCD00209793 - 30.0 eV; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.124,"smiles":null,"spectrum_id":"CCMSLIB00017276236","spectrum_index":32840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 178.0385 Da; putative annotation: 2-[(3-Hydroxypyridin-2-yl)formamido]acetic acid; putative formula: C8H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.094,"smiles":null,"spectrum_id":"CCMSLIB00017276239","spectrum_index":32841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 120.0212 Da; putative annotation: 3,4-Dihydroxybenzaldehyde; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.071,"smiles":null,"spectrum_id":"CCMSLIB00017276240","spectrum_index":32842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 98.0366 Da; putative annotation: 3-Oxopentanoic acid; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.102,"smiles":null,"spectrum_id":"CCMSLIB00017276243","spectrum_index":32843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285105 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 147.0686 Da; putative annotation: N-(4-Hydroxy-3-methylphenyl)acetamide; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.228,"smiles":null,"spectrum_id":"CCMSLIB00017276246","spectrum_index":32844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(3-Aminopropyl)-N1-methylpropane-1,3-diamine (delta mass: 176.0472 Da; putative annotation: FERULATE - 20.0 eV; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.212,"smiles":null,"spectrum_id":"CCMSLIB00017276248","spectrum_index":32845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 192.1154 Da; putative annotation: Jasmonic acid; putative formula: C12H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.207,"smiles":null,"spectrum_id":"CCMSLIB00017276251","spectrum_index":32846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 150.0467 Da; putative annotation: 3-(3-Fluorophenyl)propanoic acid; putative formula: C9H7FO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.133,"smiles":null,"spectrum_id":"CCMSLIB00017276253","spectrum_index":32847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 126.031 Da; putative annotation: 2-(Hydroxymethyl)-3-methoxy-2H-furan-5-one; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017276256","spectrum_index":32848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 164.0468 Da; putative annotation: p-Hydroxyphenyllactic acid; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.118,"smiles":null,"spectrum_id":"CCMSLIB00017276259","spectrum_index":32849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 226.0592 Da; putative annotation: PyroGlu-Asp; putative formula: C9H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.256,"smiles":null,"spectrum_id":"CCMSLIB00017276261","spectrum_index":32850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 318.2046 Da; putative annotation: Fluoxymesterone; putative formula: C20H27FO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.374,"smiles":null,"spectrum_id":"CCMSLIB00017276263","spectrum_index":32851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Pro-Lys from NIST14 (delta mass: 113.0849 Da; putative annotation: Massbank:RP002103 L-tert-Leucine|(2S)-2-azaniumyl-3,3-dimethylbutanoate; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.303,"smiles":null,"spectrum_id":"CCMSLIB00017276266","spectrum_index":32852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 120.0685 Da; putative annotation: N/A; putative formula: C7H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.129,"smiles":null,"spectrum_id":"CCMSLIB00017276269","spectrum_index":32853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 65.0627 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017276270","spectrum_index":32854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 64.0159 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.113,"smiles":null,"spectrum_id":"CCMSLIB00017276273","spectrum_index":32855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 617.3066 Da; putative annotation: N/A; putative formula: C30H43N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.424,"smiles":null,"spectrum_id":"CCMSLIB00017276276","spectrum_index":32856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 14.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.19,"smiles":null,"spectrum_id":"CCMSLIB00017276279","spectrum_index":32857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Nitro-1-propenyl)indole (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.076,"smiles":null,"spectrum_id":"CCMSLIB00017276280","spectrum_index":32858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 408.1592 Da; putative annotation: N/A; putative formula: C18H20N10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.257,"smiles":null,"spectrum_id":"CCMSLIB00017276283","spectrum_index":32859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 16.7996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.875,"smiles":null,"spectrum_id":"CCMSLIB00017276286","spectrum_index":32860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne Acetate (delta mass: 60.037 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.29,"smiles":null,"spectrum_id":"CCMSLIB00017276289","spectrum_index":32861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 149.1042 Da; putative annotation: N/A; putative formula: C2H11N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.206,"smiles":null,"spectrum_id":"CCMSLIB00017276291","spectrum_index":32862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169672-02_C26H28N2O9_14H-Pyrano[3',4':6,7]indolizino[1,2-b]quinoline-11,14(3H)-dione, 4-ethenyl-3-(beta-D-glucopyranosyloxy)-4,4a,5,5a,6,12-hexahydro-, (3S,4R,4aS,5aS)- (delta mass: 43.9929 Da; putative annotation: N/A; putative formula: HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.18,"smiles":null,"spectrum_id":"CCMSLIB00017276294","spectrum_index":32863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.086,"smiles":null,"spectrum_id":"CCMSLIB00017276296","spectrum_index":32864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 143.0574 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.096,"smiles":null,"spectrum_id":"CCMSLIB00017276299","spectrum_index":32865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 158.0984 Da; putative annotation: N/A; putative formula: C6H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.194,"smiles":null,"spectrum_id":"CCMSLIB00017276301","spectrum_index":32866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP011101 Methyl trans-cinnamic acid|4-Methylcinnamic acid|(E)-3-(4-methylphenyl)prop-2-enoic acid (delta mass: 278.0747 Da; putative annotation: N/A; putative formula: C9H14N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.15,"smiles":null,"spectrum_id":"CCMSLIB00017276304","spectrum_index":32867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Ser (delta mass: 65.0262 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.135,"smiles":null,"spectrum_id":"CCMSLIB00017276307","spectrum_index":32868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 141.1544 Da; putative annotation: N/A; putative formula: C9H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.34,"smiles":null,"spectrum_id":"CCMSLIB00017276309","spectrum_index":32869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paxilline (delta mass: 17.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.264,"smiles":null,"spectrum_id":"CCMSLIB00017276312","spectrum_index":32870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 32.0348 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.112,"smiles":null,"spectrum_id":"CCMSLIB00017276314","spectrum_index":32871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 149.0337 Da; putative annotation: N/A; putative formula: C5H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.21,"smiles":null,"spectrum_id":"CCMSLIB00017276317","spectrum_index":32872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 252.0073 Da; putative annotation: N/A; putative formula: H4N12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.068,"smiles":null,"spectrum_id":"CCMSLIB00017276320","spectrum_index":32873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 75.0468 Da; putative annotation: N/A; putative formula: C6H5NO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.138,"smiles":null,"spectrum_id":"CCMSLIB00017276323","spectrum_index":32874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 109.0412 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017276326","spectrum_index":32875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 180.1517 Da; putative annotation: N/A; putative formula: C12H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.238,"smiles":null,"spectrum_id":"CCMSLIB00017276328","spectrum_index":32876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 32.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.113,"smiles":null,"spectrum_id":"CCMSLIB00017276331","spectrum_index":32877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 295.6424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.729,"smiles":null,"spectrum_id":"CCMSLIB00017276333","spectrum_index":32878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 781.4974 Da; putative annotation: N/A; putative formula: C40H59N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1124.62,"smiles":null,"spectrum_id":"CCMSLIB00017276336","spectrum_index":32879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 87.0686 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.165,"smiles":null,"spectrum_id":"CCMSLIB00017276339","spectrum_index":32880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 195.0382 Da; putative annotation: N/A; putative formula: C8H10N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.16,"smiles":null,"spectrum_id":"CCMSLIB00017276341","spectrum_index":32881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 508.3613 Da; putative annotation: N/A; putative formula: C26H52O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.453,"smiles":null,"spectrum_id":"CCMSLIB00017276344","spectrum_index":32882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 10.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.139,"smiles":null,"spectrum_id":"CCMSLIB00017276347","spectrum_index":32883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 50.0231 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.058,"smiles":null,"spectrum_id":"CCMSLIB00017276349","spectrum_index":32884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 62.0569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.352,"smiles":null,"spectrum_id":"CCMSLIB00017276352","spectrum_index":32885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 343.1416 Da; putative annotation: N/A; putative formula: C14H26N5O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.291,"smiles":null,"spectrum_id":"CCMSLIB00017276354","spectrum_index":32886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 307.1375 Da; putative annotation: N/A; putative formula: C13H26NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.291,"smiles":null,"spectrum_id":"CCMSLIB00017276357","spectrum_index":32887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 228.1937 Da; putative annotation: N/A; putative formula: C11H24N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.353,"smiles":null,"spectrum_id":"CCMSLIB00017276360","spectrum_index":32888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 134.0526 Da; putative annotation: N/A; putative formula: C4H12N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.15,"smiles":null,"spectrum_id":"CCMSLIB00017276363","spectrum_index":32889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethyl L-glutamate (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.133,"smiles":null,"spectrum_id":"CCMSLIB00017276365","spectrum_index":32890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 310.1677 Da; putative annotation: N/A; putative formula: C11H26N4O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.327,"smiles":null,"spectrum_id":"CCMSLIB00017276368","spectrum_index":32891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 37.0313 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.107,"smiles":null,"spectrum_id":"CCMSLIB00017276370","spectrum_index":32892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 46.0203 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.154,"smiles":null,"spectrum_id":"CCMSLIB00017276373","spectrum_index":32893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 171.1957 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.23,"smiles":null,"spectrum_id":"CCMSLIB00017276376","spectrum_index":32894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 124.0866 Da; putative annotation: N/A; putative formula: C4H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.22,"smiles":null,"spectrum_id":"CCMSLIB00017276378","spectrum_index":32895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 237.0274 Da; putative annotation: N/A; putative formula: C10H7NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.108,"smiles":null,"spectrum_id":"CCMSLIB00017276381","spectrum_index":32896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine; AIF; CE10; CorrDec (delta mass: 12.018 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.114,"smiles":null,"spectrum_id":"CCMSLIB00017276384","spectrum_index":32897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 40.0 eV (delta mass: 72.0578 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.16,"smiles":null,"spectrum_id":"CCMSLIB00017276386","spectrum_index":32898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 89.9982 Da; putative annotation: N/A; putative formula: CH3N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.095,"smiles":null,"spectrum_id":"CCMSLIB00017276389","spectrum_index":32899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 197.0887 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.139,"smiles":null,"spectrum_id":"CCMSLIB00017276392","spectrum_index":32900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 112.0509 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.174,"smiles":null,"spectrum_id":"CCMSLIB00017276393","spectrum_index":32901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 9.9008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.998,"smiles":null,"spectrum_id":"CCMSLIB00017276396","spectrum_index":32902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 145.0492 Da; putative annotation: N/A; putative formula: C4H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.151,"smiles":null,"spectrum_id":"CCMSLIB00017276399","spectrum_index":32903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 65.0275 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.145,"smiles":null,"spectrum_id":"CCMSLIB00017276402","spectrum_index":32904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 46.0061 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.129,"smiles":null,"spectrum_id":"CCMSLIB00017276404","spectrum_index":32905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 69.0573 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017276406","spectrum_index":32906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 128.062 Da; putative annotation: N/A; putative formula: C4H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.123,"smiles":null,"spectrum_id":"CCMSLIB00017276409","spectrum_index":32907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 188.9893 Da; putative annotation: N/A; putative formula: C2H3N7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.06,"smiles":null,"spectrum_id":"CCMSLIB00017276412","spectrum_index":32908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 168.0394 Da; putative annotation: N/A; putative formula: C4H4N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.166,"smiles":null,"spectrum_id":"CCMSLIB00017276415","spectrum_index":32909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 567.1949 Da; putative annotation: N/A; putative formula: C39H25N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1072.37,"smiles":null,"spectrum_id":"CCMSLIB00017276416","spectrum_index":32910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 124.0404 Da; putative annotation: N/A; putative formula: C4H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.09,"smiles":null,"spectrum_id":"CCMSLIB00017276419","spectrum_index":32911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 313.1179 Da; putative annotation: N/A; putative formula: C15H15N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.178,"smiles":null,"spectrum_id":"CCMSLIB00017276422","spectrum_index":32912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 320.2157 Da; putative annotation: N/A; putative formula: C16H28N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.297,"smiles":null,"spectrum_id":"CCMSLIB00017276424","spectrum_index":32913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 94.0375 Da; putative annotation: N/A; putative formula: C2H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.191,"smiles":null,"spectrum_id":"CCMSLIB00017276426","spectrum_index":32914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 549.2454 Da; putative annotation: N/A; putative formula: C21H43NO13S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.363,"smiles":null,"spectrum_id":"CCMSLIB00017276429","spectrum_index":32915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 60.0 eV (delta mass: 40.9313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.034,"smiles":null,"spectrum_id":"CCMSLIB00017276432","spectrum_index":32916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ajmaline (delta mass: 158.0296 Da; putative annotation: N/A; putative formula: CH2N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.236,"smiles":null,"spectrum_id":"CCMSLIB00017276434","spectrum_index":32917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 154.0039 Da; putative annotation: N/A; putative formula: C4H3N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.257,"smiles":null,"spectrum_id":"CCMSLIB00017276436","spectrum_index":32918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 15.0301 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.179,"smiles":null,"spectrum_id":"CCMSLIB00017276439","spectrum_index":32919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 271.151 Da; putative annotation: N/A; putative formula: C16H21N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.242,"smiles":null,"spectrum_id":"CCMSLIB00017276442","spectrum_index":32920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.139,"smiles":null,"spectrum_id":"CCMSLIB00017276444","spectrum_index":32921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 131.0406 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.138,"smiles":null,"spectrum_id":"CCMSLIB00017276446","spectrum_index":32922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 84.0404 Da; putative annotation: N/A; putative formula: C5H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.105,"smiles":null,"spectrum_id":"CCMSLIB00017276449","spectrum_index":32923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 53.0491 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.136,"smiles":null,"spectrum_id":"CCMSLIB00017276452","spectrum_index":32924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 30.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.131,"smiles":null,"spectrum_id":"CCMSLIB00017276455","spectrum_index":32925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 28.0671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017276457","spectrum_index":32926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 152.0849 Da; putative annotation: N/A; putative formula: C9H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.15,"smiles":null,"spectrum_id":"CCMSLIB00017276459","spectrum_index":32927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 97.0476 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.114,"smiles":null,"spectrum_id":"CCMSLIB00017276462","spectrum_index":32928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU228201 10,11-Dihydro-10-Hydroxycarbazepine|Licarbazepine|5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 17.1438 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.257,"smiles":null,"spectrum_id":"CCMSLIB00017276465","spectrum_index":32929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 334.2513 Da; putative annotation: N/A; putative formula: C21H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.332,"smiles":null,"spectrum_id":"CCMSLIB00017276467","spectrum_index":32930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ?-Gentiobiose (delta mass: 169.1477 Da; putative annotation: N/A; putative formula: C10H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.271,"smiles":null,"spectrum_id":"CCMSLIB00017276469","spectrum_index":32931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine propyl ester (delta mass: 174.1223 Da; putative annotation: N/A; putative formula: C5H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.23,"smiles":null,"spectrum_id":"CCMSLIB00017276472","spectrum_index":32932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 141.115 Da; putative annotation: N/A; putative formula: C8H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.201,"smiles":null,"spectrum_id":"CCMSLIB00017276475","spectrum_index":32933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 324.1061 Da; putative annotation: N/A; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.282,"smiles":null,"spectrum_id":"CCMSLIB00017276477","spectrum_index":32934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-(piperidin-4-yl)-1H-indole (delta mass: 312.1013 Da; putative annotation: N/A; putative formula: C19H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.231,"smiles":null,"spectrum_id":"CCMSLIB00017276479","spectrum_index":32935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 117.0784 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.176,"smiles":null,"spectrum_id":"CCMSLIB00017276482","spectrum_index":32936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2a-Hydroxy-7-(hydroxymethyl)-2,2,4a,10b-tetramethyl-1a,2a,4,4a,10,10a,10b,11a-octahydro-2H,7H-[1]benzoxireno[3,4-f]pyrano[2,3-b]chromene-9,11(3H,8H)-dione (delta mass: 23.0199 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.211,"smiles":null,"spectrum_id":"CCMSLIB00017276485","spectrum_index":32937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 108.0569 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.216,"smiles":null,"spectrum_id":"CCMSLIB00017276486","spectrum_index":32938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopentylacetic acid (delta mass: 57.0212 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.123,"smiles":null,"spectrum_id":"CCMSLIB00017276489","spectrum_index":32939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 31.0061 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.088,"smiles":null,"spectrum_id":"CCMSLIB00017276492","spectrum_index":32940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 85.0259 Da; putative annotation: N/A; putative formula: C2H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.108,"smiles":null,"spectrum_id":"CCMSLIB00017276494","spectrum_index":32941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 74.0731 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.154,"smiles":null,"spectrum_id":"CCMSLIB00017276497","spectrum_index":32942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxyvarenicline (delta mass: 43.9901 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.103,"smiles":null,"spectrum_id":"CCMSLIB00017276499","spectrum_index":32943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 254.1634 Da; putative annotation: N/A; putative formula: C13H22N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.25,"smiles":null,"spectrum_id":"CCMSLIB00017276501","spectrum_index":32944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 335.1738 Da; putative annotation: N/A; putative formula: C11H25N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.245,"smiles":null,"spectrum_id":"CCMSLIB00017276504","spectrum_index":32945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 170.1308 Da; putative annotation: N/A; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.217,"smiles":null,"spectrum_id":"CCMSLIB00017276507","spectrum_index":32946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 209.1411 Da; putative annotation: N/A; putative formula: C12H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.221,"smiles":null,"spectrum_id":"CCMSLIB00017276509","spectrum_index":32947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 49.0521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.148,"smiles":null,"spectrum_id":"CCMSLIB00017276511","spectrum_index":32948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 489.279 Da; putative annotation: N/A; putative formula: C23H44N3O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.349,"smiles":null,"spectrum_id":"CCMSLIB00017276514","spectrum_index":32949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Thiazolidine-4-carboxylic acid (delta mass: 27.9903 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.017,"smiles":null,"spectrum_id":"CCMSLIB00017276517","spectrum_index":32950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydro-10-phenophosphazinol 10-oxide (delta mass: 102.0264 Da; putative annotation: N/A; putative formula: C3H6N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.079,"smiles":null,"spectrum_id":"CCMSLIB00017276519","spectrum_index":32951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 280.1826 Da; putative annotation: N/A; putative formula: C20H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.274,"smiles":null,"spectrum_id":"CCMSLIB00017276521","spectrum_index":32952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 50.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017276524","spectrum_index":32953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 62.05 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.121,"smiles":null,"spectrum_id":"CCMSLIB00017276527","spectrum_index":32954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HMHQ:db (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.18,"smiles":null,"spectrum_id":"CCMSLIB00017276530","spectrum_index":32955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 197.1422 Da; putative annotation: N/A; putative formula: C11H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.239,"smiles":null,"spectrum_id":"CCMSLIB00017276531","spectrum_index":32956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 370.1857 Da; putative annotation: N/A; putative formula: C17H30N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.293,"smiles":null,"spectrum_id":"CCMSLIB00017276534","spectrum_index":32957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 74.0519 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.143,"smiles":null,"spectrum_id":"CCMSLIB00017276537","spectrum_index":32958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 60.0507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.137,"smiles":null,"spectrum_id":"CCMSLIB00017276540","spectrum_index":32959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 114.043 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.119,"smiles":null,"spectrum_id":"CCMSLIB00017276541","spectrum_index":32960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 1032.0116 Da; putative annotation: N/A; putative formula: C51H32N6OS9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1537.19,"smiles":null,"spectrum_id":"CCMSLIB00017276544","spectrum_index":32961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 52.0315 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.07,"smiles":null,"spectrum_id":"CCMSLIB00017276547","spectrum_index":32962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 489.258 Da; putative annotation: N/A; putative formula: C24H43NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.318,"smiles":null,"spectrum_id":"CCMSLIB00017276550","spectrum_index":32963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 58.0529 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.255,"smiles":null,"spectrum_id":"CCMSLIB00017276552","spectrum_index":32964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 317.111 Da; putative annotation: N/A; putative formula: C13H19NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.171,"smiles":null,"spectrum_id":"CCMSLIB00017276554","spectrum_index":32965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 90.0503 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.126,"smiles":null,"spectrum_id":"CCMSLIB00017276557","spectrum_index":32966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 49.0298 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.1,"smiles":null,"spectrum_id":"CCMSLIB00017276560","spectrum_index":32967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE10; MS2Dec (delta mass: 57.0313 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.129,"smiles":null,"spectrum_id":"CCMSLIB00017276562","spectrum_index":32968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 70.0938 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.18,"smiles":null,"spectrum_id":"CCMSLIB00017276564","spectrum_index":32969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 11.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.139,"smiles":null,"spectrum_id":"CCMSLIB00017276567","spectrum_index":32970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 34.0209 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.076,"smiles":null,"spectrum_id":"CCMSLIB00017276570","spectrum_index":32971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 192.1506 Da; putative annotation: N/A; putative formula: C13H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.211,"smiles":null,"spectrum_id":"CCMSLIB00017276572","spectrum_index":32972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 291.1568 Da; putative annotation: N/A; putative formula: C17H26NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.337,"smiles":null,"spectrum_id":"CCMSLIB00017276575","spectrum_index":32973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 255.1554 Da; putative annotation: N/A; putative formula: C8H17N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.309,"smiles":null,"spectrum_id":"CCMSLIB00017276577","spectrum_index":32974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 132.0692 Da; putative annotation: N/A; putative formula: C8H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.119,"smiles":null,"spectrum_id":"CCMSLIB00017276580","spectrum_index":32975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 76.0496 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.219,"smiles":null,"spectrum_id":"CCMSLIB00017276583","spectrum_index":32976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 105.0217 Da; putative annotation: N/A; putative formula: C6H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017276584","spectrum_index":32977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chloro-1H-indol-3-yl)acetic acid (delta mass: 17.0384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.07,"smiles":null,"spectrum_id":"CCMSLIB00017276587","spectrum_index":32978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 84.0087 Da; putative annotation: N/A; putative formula: CN4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.08,"smiles":null,"spectrum_id":"CCMSLIB00017276590","spectrum_index":32979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 108.0672 Da; putative annotation: N/A; putative formula: C6H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.133,"smiles":null,"spectrum_id":"CCMSLIB00017276591","spectrum_index":32980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 29.1406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.168,"smiles":null,"spectrum_id":"CCMSLIB00017276594","spectrum_index":32981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(9H-Carbazol-9-yl)propanoic acid (delta mass: 113.0485 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.15,"smiles":null,"spectrum_id":"CCMSLIB00017276597","spectrum_index":32982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin Pr-LL (delta mass: 119.0379 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.356,"smiles":null,"spectrum_id":"CCMSLIB00017276600","spectrum_index":32983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 156.0422 Da; putative annotation: N/A; putative formula: C7H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.129,"smiles":null,"spectrum_id":"CCMSLIB00017276601","spectrum_index":32984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 80.047 Da; putative annotation: N/A; putative formula: C3H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.175,"smiles":null,"spectrum_id":"CCMSLIB00017276604","spectrum_index":32985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 43.0073 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.042,"smiles":null,"spectrum_id":"CCMSLIB00017276606","spectrum_index":32986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 308.0683 Da; putative annotation: N/A; putative formula: C13H17N4O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.128,"smiles":null,"spectrum_id":"CCMSLIB00017276609","spectrum_index":32987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazole (delta mass: 30.0472 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":99.0919,"smiles":null,"spectrum_id":"CCMSLIB00017276612","spectrum_index":32988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 45.0051 Da; putative annotation: N/A; putative formula: CH3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.159,"smiles":null,"spectrum_id":"CCMSLIB00017276614","spectrum_index":32989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 160.1097 Da; putative annotation: N/A; putative formula: C8H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.248,"smiles":null,"spectrum_id":"CCMSLIB00017276617","spectrum_index":32990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 169.0119 Da; putative annotation: N/A; putative formula: C7H8NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.093,"smiles":null,"spectrum_id":"CCMSLIB00017276620","spectrum_index":32991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 62.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.144,"smiles":null,"spectrum_id":"CCMSLIB00017276622","spectrum_index":32992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 275.2087 Da; putative annotation: N/A; putative formula: C14H29NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.357,"smiles":null,"spectrum_id":"CCMSLIB00017276624","spectrum_index":32993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 103.0312 Da; putative annotation: N/A; putative formula: CH5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.154,"smiles":null,"spectrum_id":"CCMSLIB00017276627","spectrum_index":32994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 287.2342 Da; putative annotation: N/A; putative formula: C18H29N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":880.51,"smiles":null,"spectrum_id":"CCMSLIB00017276630","spectrum_index":32995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304223 Indole-3-acetyl-L-tryptophan (delta mass: 361.1501 Da; putative annotation: N/A; putative formula: C23H23NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.3,"smiles":null,"spectrum_id":"CCMSLIB00017276633","spectrum_index":32996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 15.9946 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.081,"smiles":null,"spectrum_id":"CCMSLIB00017276635","spectrum_index":32997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 62.0521 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.133,"smiles":null,"spectrum_id":"CCMSLIB00017276637","spectrum_index":32998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 68.0583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.181,"smiles":null,"spectrum_id":"CCMSLIB00017276640","spectrum_index":32999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 128.0982 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.288,"smiles":null,"spectrum_id":"CCMSLIB00017276642","spectrum_index":33000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 298.1658 Da; putative annotation: N/A; putative formula: C14H18N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.236,"smiles":null,"spectrum_id":"CCMSLIB00017276645","spectrum_index":33001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 103.0084 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.141,"smiles":null,"spectrum_id":"CCMSLIB00017276647","spectrum_index":33002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 303.2798 Da; putative annotation: N/A; putative formula: C18H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.413,"smiles":null,"spectrum_id":"CCMSLIB00017276650","spectrum_index":33003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 59.0592 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.119,"smiles":null,"spectrum_id":"CCMSLIB00017276652","spectrum_index":33004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 67.0384 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.13,"smiles":null,"spectrum_id":"CCMSLIB00017276655","spectrum_index":33005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 87.0472 Da; putative annotation: N/A; putative formula: C7H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.155,"smiles":null,"spectrum_id":"CCMSLIB00017276658","spectrum_index":33006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Formoterol (delta mass: 84.0415 Da; putative annotation: N/A; putative formula: C5H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.222,"smiles":null,"spectrum_id":"CCMSLIB00017276659","spectrum_index":33007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 61.775 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.845,"smiles":null,"spectrum_id":"CCMSLIB00017276662","spectrum_index":33008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 52.0317 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.134,"smiles":null,"spectrum_id":"CCMSLIB00017276665","spectrum_index":33009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 24.0355 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.132,"smiles":null,"spectrum_id":"CCMSLIB00017276668","spectrum_index":33010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 74.0555 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.33,"smiles":null,"spectrum_id":"CCMSLIB00017276669","spectrum_index":33011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indazole-3-carboxamide, 1-pentyl-N-8-quinolinyl- (delta mass: 18.0042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.191,"smiles":null,"spectrum_id":"CCMSLIB00017276672","spectrum_index":33012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 381.1678 Da; putative annotation: N/A; putative formula: C15H24N7O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.234,"smiles":null,"spectrum_id":"CCMSLIB00017276675","spectrum_index":33013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 147.104 Da; putative annotation: DL-Ephedrine; putative formula: C10H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.169,"smiles":null,"spectrum_id":"CCMSLIB00017276676","spectrum_index":33014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 242.0943 Da; putative annotation: 5-Homovanillylresorcinol; putative formula: C15H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017276679","spectrum_index":33015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 262.1567 Da; putative annotation: Brefeldin A; putative formula: C16H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.227,"smiles":null,"spectrum_id":"CCMSLIB00017276682","spectrum_index":33016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 154.0626 Da; putative annotation: (-)-Corey lactone diol; putative formula: C8H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.144,"smiles":null,"spectrum_id":"CCMSLIB00017276685","spectrum_index":33017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 329.1093 Da; putative annotation: N-(3,4-Dimethoxybenzoyl)-3-(4-fluorophenyl)-.beta.-alanine; putative formula: C18H16FNO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.19,"smiles":null,"spectrum_id":"CCMSLIB00017276688","spectrum_index":33018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 149.0838 Da; putative annotation: .alpha.-(1-Aminoethyl)-4-hydroxybenzyl alcohol; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.176,"smiles":null,"spectrum_id":"CCMSLIB00017276689","spectrum_index":33019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 165.0782 Da; putative annotation: (-)-Epinephrine; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.184,"smiles":null,"spectrum_id":"CCMSLIB00017276692","spectrum_index":33020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 103.062 Da; putative annotation: Tris(hydroxymethyl)aminomethane; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.107,"smiles":null,"spectrum_id":"CCMSLIB00017276695","spectrum_index":33021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 144.0424 Da; putative annotation: 1,6-Anhydro-.beta.-D-glucose; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.129,"smiles":null,"spectrum_id":"CCMSLIB00017276698","spectrum_index":33022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 393.3066 Da; putative annotation: N/A; putative formula: C24H43NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.404,"smiles":null,"spectrum_id":"CCMSLIB00017276699","spectrum_index":33023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 3.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.064,"smiles":null,"spectrum_id":"CCMSLIB00017276702","spectrum_index":33024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 604.2883 Da; putative annotation: N/A; putative formula: C30H32N14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.406,"smiles":null,"spectrum_id":"CCMSLIB00017276705","spectrum_index":33025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 129.1046 Da; putative annotation: N/A; putative formula: C7H16NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017276706","spectrum_index":33026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 283.1069 Da; putative annotation: N/A; putative formula: C14H13N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.178,"smiles":null,"spectrum_id":"CCMSLIB00017276709","spectrum_index":33027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 367.1395 Da; putative annotation: N/A; putative formula: C25H21NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.231,"smiles":null,"spectrum_id":"CCMSLIB00017276712","spectrum_index":33028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 81.0556 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.179,"smiles":null,"spectrum_id":"CCMSLIB00017276715","spectrum_index":33029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 145.0529 Da; putative annotation: N/A; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.203,"smiles":null,"spectrum_id":"CCMSLIB00017276717","spectrum_index":33030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 206.1308 Da; putative annotation: N/A; putative formula: C13H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.179,"smiles":null,"spectrum_id":"CCMSLIB00017276719","spectrum_index":33031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,11-Dihydro-16H-benzo[a]carbazole (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.123,"smiles":null,"spectrum_id":"CCMSLIB00017276722","spectrum_index":33032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 314.2247 Da; putative annotation: N/A; putative formula: C21H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.348,"smiles":null,"spectrum_id":"CCMSLIB00017276724","spectrum_index":33033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 82.9414 Da; putative annotation: N/A; putative formula: C2H-2NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.033,"smiles":null,"spectrum_id":"CCMSLIB00017276727","spectrum_index":33034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole - 40.0 eV (delta mass: 188.175 Da; putative annotation: N/A; putative formula: C7H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.24,"smiles":null,"spectrum_id":"CCMSLIB00017276729","spectrum_index":33035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 817.2571 Da; putative annotation: N/A; putative formula: C47H39N5O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":998.328,"smiles":null,"spectrum_id":"CCMSLIB00017276732","spectrum_index":33036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 73.0533 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.075,"smiles":null,"spectrum_id":"CCMSLIB00017276735","spectrum_index":33037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 69.0211 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.107,"smiles":null,"spectrum_id":"CCMSLIB00017276737","spectrum_index":33038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 287.288 Da; putative annotation: N/A; putative formula: C12H33N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.457,"smiles":null,"spectrum_id":"CCMSLIB00017276740","spectrum_index":33039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 224.1163 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.213,"smiles":null,"spectrum_id":"CCMSLIB00017276742","spectrum_index":33040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 63.056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.21,"smiles":null,"spectrum_id":"CCMSLIB00017276745","spectrum_index":33041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 100.0526 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.155,"smiles":null,"spectrum_id":"CCMSLIB00017276748","spectrum_index":33042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 14.0088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.075,"smiles":null,"spectrum_id":"CCMSLIB00017276750","spectrum_index":33043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 80.9808 Da; putative annotation: N/A; putative formula: C2H-1N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.172,"smiles":null,"spectrum_id":"CCMSLIB00017276753","spectrum_index":33044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 144.1672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.243,"smiles":null,"spectrum_id":"CCMSLIB00017276756","spectrum_index":33045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 358.118 Da; putative annotation: N/A; putative formula: C27H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.215,"smiles":null,"spectrum_id":"CCMSLIB00017276758","spectrum_index":33046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 160.0554 Da; putative annotation: N/A; putative formula: C9H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.131,"smiles":null,"spectrum_id":"CCMSLIB00017276760","spectrum_index":33047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510507 Tyramine|4-(2-aminoethyl)phenol (delta mass: 214.0829 Da; putative annotation: N/A; putative formula: C7H6N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.174,"smiles":null,"spectrum_id":"CCMSLIB00017276763","spectrum_index":33048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 113.0397 Da; putative annotation: N/A; putative formula: C5H8NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.167,"smiles":null,"spectrum_id":"CCMSLIB00017276766","spectrum_index":33049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 132.0214 Da; putative annotation: N/A; putative formula: C8H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.102,"smiles":null,"spectrum_id":"CCMSLIB00017276768","spectrum_index":33050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 95.9956 Da; putative annotation: N/A; putative formula: C3N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.118,"smiles":null,"spectrum_id":"CCMSLIB00017276770","spectrum_index":33051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S-Carboxymethyl-L-cysteine CollisionEnergy:102040 (delta mass: 127.0075 Da; putative annotation: N/A; putative formula: CHN7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.04,"smiles":null,"spectrum_id":"CCMSLIB00017276773","spectrum_index":33052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-methyl-9H-pyrido[3,4-b]indol-7-ol hydrochloride dihydrate (delta mass: 179.0785 Da; putative annotation: N/A; putative formula: C3H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.163,"smiles":null,"spectrum_id":"CCMSLIB00017276776","spectrum_index":33053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 750.3929 Da; putative annotation: N/A; putative formula: C51H58OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":931.464,"smiles":null,"spectrum_id":"CCMSLIB00017276778","spectrum_index":33054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 157.0515 Da; putative annotation: N/A; putative formula: C5H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.138,"smiles":null,"spectrum_id":"CCMSLIB00017276780","spectrum_index":33055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 17.0507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.147,"smiles":null,"spectrum_id":"CCMSLIB00017276783","spectrum_index":33056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geissolaevine (delta mass: 17.034 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.163,"smiles":null,"spectrum_id":"CCMSLIB00017276786","spectrum_index":33057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 56.0245 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.105,"smiles":null,"spectrum_id":"CCMSLIB00017276789","spectrum_index":33058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 64.0167 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.102,"smiles":null,"spectrum_id":"CCMSLIB00017276790","spectrum_index":33059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.gamma.-Glutamyl-L-glutamic acid (delta mass: 185.0681 Da; putative annotation: N/A; putative formula: C8H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.171,"smiles":null,"spectrum_id":"CCMSLIB00017276793","spectrum_index":33060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 244.1136 Da; putative annotation: N/A; putative formula: C12H20O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.179,"smiles":null,"spectrum_id":"CCMSLIB00017276796","spectrum_index":33061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 112.0492 Da; putative annotation: N/A; putative formula: C2H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.13,"smiles":null,"spectrum_id":"CCMSLIB00017276798","spectrum_index":33062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 28.0311 Da; putative annotation: N/A; putative formula: C2H4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017276800","spectrum_index":33063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 48.0346 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.199,"smiles":null,"spectrum_id":"CCMSLIB00017276803","spectrum_index":33064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 38.4293 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.5,"smiles":null,"spectrum_id":"CCMSLIB00017276806","spectrum_index":33065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 79.0271 Da; putative annotation: N/A; putative formula: C2HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.16,"smiles":null,"spectrum_id":"CCMSLIB00017276808","spectrum_index":33066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 198.1669 Da; putative annotation: N/A; putative formula: C11H23N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.306,"smiles":null,"spectrum_id":"CCMSLIB00017276811","spectrum_index":33067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 224.1993 Da; putative annotation: N/A; putative formula: C12H24N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.286,"smiles":null,"spectrum_id":"CCMSLIB00017276814","spectrum_index":33068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 227.1007 Da; putative annotation: N/A; putative formula: C10H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.234,"smiles":null,"spectrum_id":"CCMSLIB00017276816","spectrum_index":33069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 141.054 Da; putative annotation: N/A; putative formula: C5H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.14,"smiles":null,"spectrum_id":"CCMSLIB00017276819","spectrum_index":33070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 449.1868 Da; putative annotation: N/A; putative formula: C25H28N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.284,"smiles":null,"spectrum_id":"CCMSLIB00017276822","spectrum_index":33071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 157.0525 Da; putative annotation: N/A; putative formula: C10H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017276824","spectrum_index":33072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 305.9907 Da; putative annotation: N/A; putative formula: C7H6N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.061,"smiles":null,"spectrum_id":"CCMSLIB00017276827","spectrum_index":33073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 187.0633 Da; putative annotation: N/A; putative formula: C11H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.15,"smiles":null,"spectrum_id":"CCMSLIB00017276829","spectrum_index":33074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 196.1205 Da; putative annotation: N/A; putative formula: C10H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.228,"smiles":null,"spectrum_id":"CCMSLIB00017276831","spectrum_index":33075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 44.0258 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.112,"smiles":null,"spectrum_id":"CCMSLIB00017276834","spectrum_index":33076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroflavopereirine (delta mass: 79.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.176,"smiles":null,"spectrum_id":"CCMSLIB00017276837","spectrum_index":33077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 402.7298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.8,"smiles":null,"spectrum_id":"CCMSLIB00017276839","spectrum_index":33078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 175.1664 Da; putative annotation: N/A; putative formula: C4H17N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.214,"smiles":null,"spectrum_id":"CCMSLIB00017276841","spectrum_index":33079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.17,"smiles":null,"spectrum_id":"CCMSLIB00017276844","spectrum_index":33080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 548.2568 Da; putative annotation: N/A; putative formula: C21H32N12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":917.368,"smiles":null,"spectrum_id":"CCMSLIB00017276847","spectrum_index":33081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 106.0392 Da; putative annotation: N/A; putative formula: C3H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.12,"smiles":null,"spectrum_id":"CCMSLIB00017276848","spectrum_index":33082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 121.0735 Da; putative annotation: N/A; putative formula: C5H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017276851","spectrum_index":33083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 84.0573 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.154,"smiles":null,"spectrum_id":"CCMSLIB00017276854","spectrum_index":33084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 301.32 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.37,"smiles":null,"spectrum_id":"CCMSLIB00017276856","spectrum_index":33085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 82.0397 Da; putative annotation: N/A; putative formula: CH2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.199,"smiles":null,"spectrum_id":"CCMSLIB00017276859","spectrum_index":33086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 692.4044 Da; putative annotation: N/A; putative formula: C33H56N8O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.543,"smiles":null,"spectrum_id":"CCMSLIB00017276861","spectrum_index":33087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 56.0322 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.177,"smiles":null,"spectrum_id":"CCMSLIB00017276864","spectrum_index":33088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 59.0482 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.135,"smiles":null,"spectrum_id":"CCMSLIB00017276867","spectrum_index":33089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 163.0706 Da; putative annotation: N/A; putative formula: C3H9N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.225,"smiles":null,"spectrum_id":"CCMSLIB00017276869","spectrum_index":33090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 267.1339 Da; putative annotation: N/A; putative formula: C12H13N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.225,"smiles":null,"spectrum_id":"CCMSLIB00017276871","spectrum_index":33091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 74.0535 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.109,"smiles":null,"spectrum_id":"CCMSLIB00017276874","spectrum_index":33092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 278.1942 Da; putative annotation: N/A; putative formula: C11H26N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.254,"smiles":null,"spectrum_id":"CCMSLIB00017276877","spectrum_index":33093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 96.0421 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.185,"smiles":null,"spectrum_id":"CCMSLIB00017276879","spectrum_index":33094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 61.0311 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.123,"smiles":null,"spectrum_id":"CCMSLIB00017276881","spectrum_index":33095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 381.1997 Da; putative annotation: N/A; putative formula: C14H19N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.286,"smiles":null,"spectrum_id":"CCMSLIB00017276884","spectrum_index":33096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 636.2668 Da; putative annotation: N/A; putative formula: C28H49N2O8PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":844.4,"smiles":null,"spectrum_id":"CCMSLIB00017276887","spectrum_index":33097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-5,6-dihydroxy-6-methyl-7-oxocyclopenta[c]pyridine-5-carboxylate (delta mass: 42.0177 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.198,"smiles":null,"spectrum_id":"CCMSLIB00017276889","spectrum_index":33098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 59.9458 Da; putative annotation: N/A; putative formula: CO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.08,"smiles":null,"spectrum_id":"CCMSLIB00017276892","spectrum_index":33099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 441.411 Da; putative annotation: N/A; putative formula: C27H56NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":785.56,"smiles":null,"spectrum_id":"CCMSLIB00017276895","spectrum_index":33100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 42.0114 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.087,"smiles":null,"spectrum_id":"CCMSLIB00017276897","spectrum_index":33101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 101.0372 Da; putative annotation: N/A; putative formula: C6H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.113,"smiles":null,"spectrum_id":"CCMSLIB00017276899","spectrum_index":33102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 166.1092 Da; putative annotation: N/A; putative formula: C9H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.206,"smiles":null,"spectrum_id":"CCMSLIB00017276902","spectrum_index":33103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Debromohymenialdisine (delta mass: 36.0195 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017276905","spectrum_index":33104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 25.0294 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.068,"smiles":null,"spectrum_id":"CCMSLIB00017276906","spectrum_index":33105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 125.0842 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.16,"smiles":null,"spectrum_id":"CCMSLIB00017276909","spectrum_index":33106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 373.2222 Da; putative annotation: N/A; putative formula: C18H35N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.366,"smiles":null,"spectrum_id":"CCMSLIB00017276912","spectrum_index":33107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Ala (delta mass: 99.0682 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.197,"smiles":null,"spectrum_id":"CCMSLIB00017276913","spectrum_index":33108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 127.0565 Da; putative annotation: N/A; putative formula: C5H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.148,"smiles":null,"spectrum_id":"CCMSLIB00017276916","spectrum_index":33109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 423.1745 Da; putative annotation: N/A; putative formula: C20H30N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.25,"smiles":null,"spectrum_id":"CCMSLIB00017276919","spectrum_index":33110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 504.1687 Da; putative annotation: N/A; putative formula: C24H32N4O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.292,"smiles":null,"spectrum_id":"CCMSLIB00017276920","spectrum_index":33111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 267.1683 Da; putative annotation: N/A; putative formula: C12H21N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.291,"smiles":null,"spectrum_id":"CCMSLIB00017276923","spectrum_index":33112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 278.2041 Da; putative annotation: N/A; putative formula: C21H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.328,"smiles":null,"spectrum_id":"CCMSLIB00017276926","spectrum_index":33113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 301.1952 Da; putative annotation: N/A; putative formula: C13H29N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.319,"smiles":null,"spectrum_id":"CCMSLIB00017276929","spectrum_index":33114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 127.1349 Da; putative annotation: N/A; putative formula: C8H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.263,"smiles":null,"spectrum_id":"CCMSLIB00017276931","spectrum_index":33115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-pyruvic acid (delta mass: 49.9931 Da; putative annotation: N/A; putative formula: C2H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.059,"smiles":null,"spectrum_id":"CCMSLIB00017276933","spectrum_index":33116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 12.9952 Da; putative annotation: N/A; putative formula: C22H32N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.076,"smiles":null,"spectrum_id":"CCMSLIB00017276936","spectrum_index":33117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-tryptophan CollisionEnergy:102040 (delta mass: 261.1003 Da; putative annotation: N/A; putative formula: C14H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.208,"smiles":null,"spectrum_id":"CCMSLIB00017276939","spectrum_index":33118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 172.9205 Da; putative annotation: N/A; putative formula: H2NO4P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.069,"smiles":null,"spectrum_id":"CCMSLIB00017276940","spectrum_index":33119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 18.083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.143,"smiles":null,"spectrum_id":"CCMSLIB00017276943","spectrum_index":33120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380167-01!3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015] (delta mass: 78.0319 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017276946","spectrum_index":33121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kainic Acid (delta mass: 129.0656 Da; putative annotation: N/A; putative formula: C3H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.173,"smiles":null,"spectrum_id":"CCMSLIB00017276948","spectrum_index":33122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 156.1812 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.277,"smiles":null,"spectrum_id":"CCMSLIB00017276950","spectrum_index":33123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 305.1378 Da; putative annotation: N/A; putative formula: C15H19N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.219,"smiles":null,"spectrum_id":"CCMSLIB00017276953","spectrum_index":33124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 348.0633 Da; putative annotation: N/A; putative formula: C20H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.134,"smiles":null,"spectrum_id":"CCMSLIB00017276956","spectrum_index":33125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 178.0418 Da; putative annotation: N/A; putative formula: C13H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.107,"smiles":null,"spectrum_id":"CCMSLIB00017276958","spectrum_index":33126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Keto-1-methyl-3H-imidazo[4,5-b]pyridin-6-yl)benzamide (delta mass: 6.3967 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.5,"smiles":null,"spectrum_id":"CCMSLIB00017276961","spectrum_index":33127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 16.0307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.127,"smiles":null,"spectrum_id":"CCMSLIB00017276964","spectrum_index":33128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 24.0097 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.097,"smiles":null,"spectrum_id":"CCMSLIB00017276966","spectrum_index":33129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 137.1092 Da; putative annotation: N/A; putative formula: C6H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017276969","spectrum_index":33130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 164.0476 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017276972","spectrum_index":33131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 333.1099 Da; putative annotation: N/A; putative formula: C13H16N7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.259,"smiles":null,"spectrum_id":"CCMSLIB00017276974","spectrum_index":33132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 33.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.148,"smiles":null,"spectrum_id":"CCMSLIB00017276977","spectrum_index":33133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 196.0812 Da; putative annotation: N/A; putative formula: C4H12N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.25,"smiles":null,"spectrum_id":"CCMSLIB00017276980","spectrum_index":33134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meropenem (delta mass: 162.054 Da; putative annotation: N/A; putative formula: C7H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.213,"smiles":null,"spectrum_id":"CCMSLIB00017276983","spectrum_index":33135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Heptyl-4-hydroxyquinoline N-oxide (delta mass: 173.0491 Da; putative annotation: N/A; putative formula: C3H7N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.214,"smiles":null,"spectrum_id":"CCMSLIB00017276985","spectrum_index":33136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 58.0419 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.217,"smiles":null,"spectrum_id":"CCMSLIB00017276988","spectrum_index":33137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 193.9948 Da; putative annotation: N/A; putative formula: C9H7OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.081,"smiles":null,"spectrum_id":"CCMSLIB00017276990","spectrum_index":33138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 306.0767 Da; putative annotation: N/A; putative formula: C17H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.227,"smiles":null,"spectrum_id":"CCMSLIB00017276993","spectrum_index":33139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C6:0 (delta mass: 118.0378 Da; putative annotation: N/A; putative formula: C3H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.197,"smiles":null,"spectrum_id":"CCMSLIB00017276996","spectrum_index":33140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 194.1307 Da; putative annotation: N/A; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.238,"smiles":null,"spectrum_id":"CCMSLIB00017276998","spectrum_index":33141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 44.0511 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.154,"smiles":null,"spectrum_id":"CCMSLIB00017277001","spectrum_index":33142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 45.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.201,"smiles":null,"spectrum_id":"CCMSLIB00017277004","spectrum_index":33143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000501 5-methoxyindole-3-carbaldehyde (delta mass: 150.1162 Da; putative annotation: N/A; putative formula: C9H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.187,"smiles":null,"spectrum_id":"CCMSLIB00017277007","spectrum_index":33144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 431.1789 Da; putative annotation: N/A; putative formula: C19H29NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.25,"smiles":null,"spectrum_id":"CCMSLIB00017277009","spectrum_index":33145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 284.272 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.364,"smiles":null,"spectrum_id":"CCMSLIB00017277011","spectrum_index":33146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 256.1309 Da; putative annotation: N/A; putative formula: C13H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.29,"smiles":null,"spectrum_id":"CCMSLIB00017277014","spectrum_index":33147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 481.2319 Da; putative annotation: N/A; putative formula: C25H39NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.303,"smiles":null,"spectrum_id":"CCMSLIB00017277017","spectrum_index":33148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 81.0212 Da; putative annotation: N/A; putative formula: C4H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.113,"smiles":null,"spectrum_id":"CCMSLIB00017277019","spectrum_index":33149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 315.1899 Da; putative annotation: N/A; putative formula: C15H30N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.435,"smiles":null,"spectrum_id":"CCMSLIB00017277022","spectrum_index":33150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 360.287 Da; putative annotation: N/A; putative formula: C20H40O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.326,"smiles":null,"spectrum_id":"CCMSLIB00017277024","spectrum_index":33151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 46.0507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017277026","spectrum_index":33152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 454.2123 Da; putative annotation: N/A; putative formula: C23H35O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.325,"smiles":null,"spectrum_id":"CCMSLIB00017277029","spectrum_index":33153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 629.5546 Da; putative annotation: N/A; putative formula: C44H71NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":815.626,"smiles":null,"spectrum_id":"CCMSLIB00017277032","spectrum_index":33154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:205060\"\" (delta mass: 190.0848 Da; putative annotation: N/A; putative formula: C9H18S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.176,"smiles":null,"spectrum_id":"CCMSLIB00017277035","spectrum_index":33155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 91.1 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.171,"smiles":null,"spectrum_id":"CCMSLIB00017277037","spectrum_index":33156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1294.6011 Da; putative annotation: N/A; putative formula: C59H94N10O16S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1487.67,"smiles":null,"spectrum_id":"CCMSLIB00017277040","spectrum_index":33157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 17.0215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.144,"smiles":null,"spectrum_id":"CCMSLIB00017277042","spectrum_index":33158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 120.072 Da; putative annotation: N/A; putative formula: C7H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.148,"smiles":null,"spectrum_id":"CCMSLIB00017277045","spectrum_index":33159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-nitro-1H-imidazole-5-carboxylate (delta mass: 22.9215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.972,"smiles":null,"spectrum_id":"CCMSLIB00017277047","spectrum_index":33160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 158.0945 Da; putative annotation: N/A; putative formula: C8H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.181,"smiles":null,"spectrum_id":"CCMSLIB00017277050","spectrum_index":33161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-(1H-Indol-2-yl)-2-propenoic acid (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.097,"smiles":null,"spectrum_id":"CCMSLIB00017277053","spectrum_index":33162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 56.1186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.288,"smiles":null,"spectrum_id":"CCMSLIB00017277055","spectrum_index":33163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 655.291 Da; putative annotation: N/A; putative formula: C35H46NO9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.445,"smiles":null,"spectrum_id":"CCMSLIB00017277058","spectrum_index":33164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 179.1154 Da; putative annotation: N/A; putative formula: C8H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.196,"smiles":null,"spectrum_id":"CCMSLIB00017277060","spectrum_index":33165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluorotryptamine (delta mass: 44.0138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.112,"smiles":null,"spectrum_id":"CCMSLIB00017277063","spectrum_index":33166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Aminocyclopropanecarboxylic acid (delta mass: 16.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":118.086,"smiles":null,"spectrum_id":"CCMSLIB00017277066","spectrum_index":33167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 304.4915 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.767,"smiles":null,"spectrum_id":"CCMSLIB00017277069","spectrum_index":33168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[(3,4,5-Trimethoxyphenyl)methyl]pyridin-2-amine (delta mass: 72.0287 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.168,"smiles":null,"spectrum_id":"CCMSLIB00017277071","spectrum_index":33169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 543.2227 Da; putative annotation: N/A; putative formula: C28H37N3O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":887.372,"smiles":null,"spectrum_id":"CCMSLIB00017277073","spectrum_index":33170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1090.4277 Da; putative annotation: N/A; putative formula: C55H62N8O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1312.52,"smiles":null,"spectrum_id":"CCMSLIB00017277076","spectrum_index":33171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 611.3526 Da; putative annotation: N/A; putative formula: C29H57NO8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.407,"smiles":null,"spectrum_id":"CCMSLIB00017277079","spectrum_index":33172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 883.5296 Da; putative annotation: N/A; putative formula: C46H77NO15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1064.6,"smiles":null,"spectrum_id":"CCMSLIB00017277082","spectrum_index":33173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 111.041 Da; putative annotation: N/A; putative formula: HN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.076,"smiles":null,"spectrum_id":"CCMSLIB00017277085","spectrum_index":33174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 128.0892 Da; putative annotation: N/A; putative formula: C6H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.17,"smiles":null,"spectrum_id":"CCMSLIB00017277087","spectrum_index":33175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 46.0067 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.112,"smiles":null,"spectrum_id":"CCMSLIB00017277090","spectrum_index":33176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 49.0564 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.143,"smiles":null,"spectrum_id":"CCMSLIB00017277092","spectrum_index":33177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 256.0726 Da; putative annotation: N/A; putative formula: C15H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.148,"smiles":null,"spectrum_id":"CCMSLIB00017277094","spectrum_index":33178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 25.9797 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.045,"smiles":null,"spectrum_id":"CCMSLIB00017277097","spectrum_index":33179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 242.127 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.272,"smiles":null,"spectrum_id":"CCMSLIB00017277100","spectrum_index":33180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 135.0508 Da; putative annotation: N/A; putative formula: C8H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.101,"smiles":null,"spectrum_id":"CCMSLIB00017277102","spectrum_index":33181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Ile (delta mass: 101.0474 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.233,"smiles":null,"spectrum_id":"CCMSLIB00017277104","spectrum_index":33182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 45.0216 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.181,"smiles":null,"spectrum_id":"CCMSLIB00017277107","spectrum_index":33183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 18.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.196,"smiles":null,"spectrum_id":"CCMSLIB00017277110","spectrum_index":33184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 100.0438 Da; putative annotation: N/A; putative formula: C5H9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.11,"smiles":null,"spectrum_id":"CCMSLIB00017277113","spectrum_index":33185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 454.1452 Da; putative annotation: N/A; putative formula: C25H26O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.294,"smiles":null,"spectrum_id":"CCMSLIB00017277114","spectrum_index":33186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 16.0557 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.106,"smiles":null,"spectrum_id":"CCMSLIB00017277117","spectrum_index":33187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 174.1298 Da; putative annotation: N/A; putative formula: C7H18N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.269,"smiles":null,"spectrum_id":"CCMSLIB00017277120","spectrum_index":33188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 20.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017277122","spectrum_index":33189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 88.0678 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.321,"smiles":null,"spectrum_id":"CCMSLIB00017277124","spectrum_index":33190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal (delta mass: 30.012 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.061,"smiles":null,"spectrum_id":"CCMSLIB00017277127","spectrum_index":33191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 626.2938 Da; putative annotation: N/A; putative formula: C31H46O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.385,"smiles":null,"spectrum_id":"CCMSLIB00017277130","spectrum_index":33192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 780.2652 Da; putative annotation: N/A; putative formula: C30H55O17P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1002.36,"smiles":null,"spectrum_id":"CCMSLIB00017277132","spectrum_index":33193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-5-Hydroxylysine (delta mass: 192.1873 Da; putative annotation: N/A; putative formula: C14H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.295,"smiles":null,"spectrum_id":"CCMSLIB00017277134","spectrum_index":33194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrocinchonine (delta mass: 63.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.274,"smiles":null,"spectrum_id":"CCMSLIB00017277137","spectrum_index":33195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxobenzo[cd]indol-1(2H)-yl)acetic acid (delta mass: 60.0241 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.09,"smiles":null,"spectrum_id":"CCMSLIB00017277140","spectrum_index":33196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 45.0215 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.048,"smiles":null,"spectrum_id":"CCMSLIB00017277142","spectrum_index":33197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 36.0403 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017277144","spectrum_index":33198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(3,4-dimethoxyphenyl)-N-[2-(7-chloro-2-methylindol-3-yl)ethyl]carboxamide CollisionEnergy:205060\"\" (delta mass: 146.0336 Da; putative annotation: N/A; putative formula: C5H10N2O-1S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.165,"smiles":null,"spectrum_id":"CCMSLIB00017277147","spectrum_index":33199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 115.986 Da; putative annotation: N/A; putative formula: C2N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.046,"smiles":null,"spectrum_id":"CCMSLIB00017277150","spectrum_index":33200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 66.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.147,"smiles":null,"spectrum_id":"CCMSLIB00017277152","spectrum_index":33201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 271.0976 Da; putative annotation: N/A; putative formula: C12H18NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.184,"smiles":null,"spectrum_id":"CCMSLIB00017277154","spectrum_index":33202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 209.0537 Da; putative annotation: N/A; putative formula: C6H11NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.119,"smiles":null,"spectrum_id":"CCMSLIB00017277157","spectrum_index":33203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 63.092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.196,"smiles":null,"spectrum_id":"CCMSLIB00017277160","spectrum_index":33204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 162.058 Da; putative annotation: N/A; putative formula: C12H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.169,"smiles":null,"spectrum_id":"CCMSLIB00017277163","spectrum_index":33205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 70.0422 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.129,"smiles":null,"spectrum_id":"CCMSLIB00017277165","spectrum_index":33206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol CollisionEnergy:102040 (delta mass: 145.0547 Da; putative annotation: N/A; putative formula: C2H7N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.13,"smiles":null,"spectrum_id":"CCMSLIB00017277167","spectrum_index":33207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 161.068 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.134,"smiles":null,"spectrum_id":"CCMSLIB00017277170","spectrum_index":33208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 219.1093 Da; putative annotation: N/A; putative formula: C6H9N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.18,"smiles":null,"spectrum_id":"CCMSLIB00017277173","spectrum_index":33209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 102.0424 Da; putative annotation: N/A; putative formula: C3H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.16,"smiles":null,"spectrum_id":"CCMSLIB00017277174","spectrum_index":33210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 75.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.196,"smiles":null,"spectrum_id":"CCMSLIB00017277177","spectrum_index":33211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 83.0046 Da; putative annotation: N/A; putative formula: C2H2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.112,"smiles":null,"spectrum_id":"CCMSLIB00017277180","spectrum_index":33212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 34.8432 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.886,"smiles":null,"spectrum_id":"CCMSLIB00017277182","spectrum_index":33213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 72.0476 Da; putative annotation: N/A; putative formula: C4H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.124,"smiles":null,"spectrum_id":"CCMSLIB00017277184","spectrum_index":33214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 299.1375 Da; putative annotation: N/A; putative formula: C15H25NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.224,"smiles":null,"spectrum_id":"CCMSLIB00017277187","spectrum_index":33215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 342.074 Da; putative annotation: N/A; putative formula: C18H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.134,"smiles":null,"spectrum_id":"CCMSLIB00017277190","spectrum_index":33216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 284.0327 Da; putative annotation: N/A; putative formula: C15H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.103,"smiles":null,"spectrum_id":"CCMSLIB00017277193","spectrum_index":33217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 234.1019 Da; putative annotation: N/A; putative formula: C13H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.214,"smiles":null,"spectrum_id":"CCMSLIB00017277194","spectrum_index":33218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Gln (delta mass: 111.0312 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.192,"smiles":null,"spectrum_id":"CCMSLIB00017277197","spectrum_index":33219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 108.0213 Da; putative annotation: 5-(Hydroxymethyl)-2-furaldehyde; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017277200","spectrum_index":33220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 146.0369 Da; putative annotation: trans-3-Coumaric acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.128,"smiles":null,"spectrum_id":"CCMSLIB00017277201","spectrum_index":33221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 170.1056 Da; putative annotation: Gly-Leu - 30.0 eV; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.229,"smiles":null,"spectrum_id":"CCMSLIB00017277204","spectrum_index":33222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Asp (delta mass: 115.0267 Da; putative annotation: L-Aspartic acid; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.093,"smiles":null,"spectrum_id":"CCMSLIB00017277207","spectrum_index":33223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 129.0426 Da; putative annotation: L-(+)-Glutamic acid - 30.0 eV; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.129,"smiles":null,"spectrum_id":"CCMSLIB00017277210","spectrum_index":33224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 278.2609 Da; putative annotation: Phytomonic acid; putative formula: C19H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.332,"smiles":null,"spectrum_id":"CCMSLIB00017277211","spectrum_index":33225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(phenylmethoxy)-2H-3,4,5,6-tetrahydropyra n-3-yl]acetamide CollisionEnergy:102040\"\" (delta mass: 185.0503 Da; putative annotation: 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one; putative formula: C11H7NO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.194,"smiles":null,"spectrum_id":"CCMSLIB00017277214","spectrum_index":33226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 316.241 Da; putative annotation: 5.beta.-Pregnane-3.alpha.,17-diol-20-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.365,"smiles":null,"spectrum_id":"CCMSLIB00017277217","spectrum_index":33227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 325.1157 Da; putative annotation: Massbank:PR310827 N-Fructosyl tyrosine; putative formula: C15H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.186,"smiles":null,"spectrum_id":"CCMSLIB00017277219","spectrum_index":33228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 186.1227 Da; putative annotation: 3,5-dihydroxydecanoic acid; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.225,"smiles":null,"spectrum_id":"CCMSLIB00017277221","spectrum_index":33229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 212.0837 Da; putative annotation: N/A; putative formula: C14H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017277224","spectrum_index":33230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLIC ACID - 70.00 eV (delta mass: 29.0548 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.11,"smiles":null,"spectrum_id":"CCMSLIB00017277227","spectrum_index":33231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 182.134 Da; putative annotation: N/A; putative formula: C10H19N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.268,"smiles":null,"spectrum_id":"CCMSLIB00017277228","spectrum_index":33232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 175.0479 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.134,"smiles":null,"spectrum_id":"CCMSLIB00017277231","spectrum_index":33233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 278.1315 Da; putative annotation: N/A; putative formula: C12H18N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.28,"smiles":null,"spectrum_id":"CCMSLIB00017277234","spectrum_index":33234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 267.1949 Da; putative annotation: N/A; putative formula: C14H25N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.329,"smiles":null,"spectrum_id":"CCMSLIB00017277237","spectrum_index":33235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 27.0533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.149,"smiles":null,"spectrum_id":"CCMSLIB00017277238","spectrum_index":33236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:205060 (delta mass: 542.4018 Da; putative annotation: N/A; putative formula: C32H54N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":787.497,"smiles":null,"spectrum_id":"CCMSLIB00017277241","spectrum_index":33237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 331.0918 Da; putative annotation: N/A; putative formula: C14H13N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.183,"smiles":null,"spectrum_id":"CCMSLIB00017277244","spectrum_index":33238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 84.0212 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.081,"smiles":null,"spectrum_id":"CCMSLIB00017277245","spectrum_index":33239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 152.1554 Da; putative annotation: N/A; putative formula: C11H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.236,"smiles":null,"spectrum_id":"CCMSLIB00017277248","spectrum_index":33240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 18.0593 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.13,"smiles":null,"spectrum_id":"CCMSLIB00017277251","spectrum_index":33241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 70.0886 Da; putative annotation: N/A; putative formula: C4H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017277252","spectrum_index":33242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoic acid, 4-(7,8,9,10-tetrahydro-5,7,7,10,10-pentamethyl-5H-benzo[e]naphtho[2,3-b][1,4]diazepin-13-yl)- (delta mass: 75.042 Da; putative annotation: N/A; putative formula: CH5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.28,"smiles":null,"spectrum_id":"CCMSLIB00017277255","spectrum_index":33243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nervobscurine (delta mass: 103.0668 Da; putative annotation: N/A; putative formula: C3H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.263,"smiles":null,"spectrum_id":"CCMSLIB00017277258","spectrum_index":33244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 82.0187 Da; putative annotation: N/A; putative formula: C3H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.099,"smiles":null,"spectrum_id":"CCMSLIB00017277260","spectrum_index":33245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 468.1416 Da; putative annotation: N/A; putative formula: C17H28N2O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.259,"smiles":null,"spectrum_id":"CCMSLIB00017277263","spectrum_index":33246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 180.1499 Da; putative annotation: N/A; putative formula: C8H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.273,"smiles":null,"spectrum_id":"CCMSLIB00017277265","spectrum_index":33247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-2-ol (delta mass: 153.0788 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.139,"smiles":null,"spectrum_id":"CCMSLIB00017277268","spectrum_index":33248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 168.0785 Da; putative annotation: N/A; putative formula: C9H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.207,"smiles":null,"spectrum_id":"CCMSLIB00017277271","spectrum_index":33249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 152.0679 Da; putative annotation: N/A; putative formula: C2H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.18,"smiles":null,"spectrum_id":"CCMSLIB00017277273","spectrum_index":33250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 126.0916 Da; putative annotation: N/A; putative formula: C5H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.172,"smiles":null,"spectrum_id":"CCMSLIB00017277276","spectrum_index":33251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 109.0559 Da; putative annotation: N/A; putative formula: C6H7NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.121,"smiles":null,"spectrum_id":"CCMSLIB00017277278","spectrum_index":33252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 244.1701 Da; putative annotation: N/A; putative formula: C12H25N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.241,"smiles":null,"spectrum_id":"CCMSLIB00017277281","spectrum_index":33253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 299.6557 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.742,"smiles":null,"spectrum_id":"CCMSLIB00017277283","spectrum_index":33254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 305.1433 Da; putative annotation: N/A; putative formula: C13H19N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.23,"smiles":null,"spectrum_id":"CCMSLIB00017277286","spectrum_index":33255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 853.4819 Da; putative annotation: N/A; putative formula: C57H63N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1016.54,"smiles":null,"spectrum_id":"CCMSLIB00017277289","spectrum_index":33256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-nitro-1H-indole-2-carboxylate (delta mass: 47.0183 Da; putative annotation: N/A; putative formula: C4HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.09,"smiles":null,"spectrum_id":"CCMSLIB00017277290","spectrum_index":33257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 116.0623 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017277293","spectrum_index":33258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 100.0782 Da; putative annotation: N/A; putative formula: C6H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.181,"smiles":null,"spectrum_id":"CCMSLIB00017277296","spectrum_index":33259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 62.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.128,"smiles":null,"spectrum_id":"CCMSLIB00017277298","spectrum_index":33260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 44.0473 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.191,"smiles":null,"spectrum_id":"CCMSLIB00017277300","spectrum_index":33261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 361.1371 Da; putative annotation: N/A; putative formula: C13H11N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.25,"smiles":null,"spectrum_id":"CCMSLIB00017277303","spectrum_index":33262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutaecarpine (delta mass: 59.0579 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.171,"smiles":null,"spectrum_id":"CCMSLIB00017277306","spectrum_index":33263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 201.0433 Da; putative annotation: N/A; putative formula: C4H7N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.13,"smiles":null,"spectrum_id":"CCMSLIB00017277308","spectrum_index":33264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000501 5-methoxyindole-3-carbaldehyde (delta mass: 16.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.103,"smiles":null,"spectrum_id":"CCMSLIB00017277310","spectrum_index":33265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 260.1932 Da; putative annotation: N/A; putative formula: C21H24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.305,"smiles":null,"spectrum_id":"CCMSLIB00017277313","spectrum_index":33266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 539.2938 Da; putative annotation: N/A; putative formula: C37H37N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.354,"smiles":null,"spectrum_id":"CCMSLIB00017277316","spectrum_index":33267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 18.0136 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.309,"smiles":null,"spectrum_id":"CCMSLIB00017277318","spectrum_index":33268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose - 30.0 eV (delta mass: 341.1281 Da; putative annotation: N/A; putative formula: C5H11N17O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.252,"smiles":null,"spectrum_id":"CCMSLIB00017277320","spectrum_index":33269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 68.0724 Da; putative annotation: N/A; putative formula: C4H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.154,"smiles":null,"spectrum_id":"CCMSLIB00017277323","spectrum_index":33270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Lys (delta mass: 155.0955 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.292,"smiles":null,"spectrum_id":"CCMSLIB00017277326","spectrum_index":33271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2,2,2-trifluoroethanamine (delta mass: 28.0341 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.118,"smiles":null,"spectrum_id":"CCMSLIB00017277328","spectrum_index":33272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 99.0774 Da; putative annotation: N/A; putative formula: C4H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017277331","spectrum_index":33273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 10.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.128,"smiles":null,"spectrum_id":"CCMSLIB00017277333","spectrum_index":33274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 103.0383 Da; putative annotation: N/A; putative formula: C2H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.109,"smiles":null,"spectrum_id":"CCMSLIB00017277336","spectrum_index":33275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380167-01!3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015] (delta mass: 150.0327 Da; putative annotation: N/A; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.187,"smiles":null,"spectrum_id":"CCMSLIB00017277339","spectrum_index":33276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 229.2287 Da; putative annotation: N/A; putative formula: C11H27N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.32,"smiles":null,"spectrum_id":"CCMSLIB00017277340","spectrum_index":33277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 73.0222 Da; putative annotation: N/A; putative formula: CH4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.103,"smiles":null,"spectrum_id":"CCMSLIB00017277343","spectrum_index":33278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 103.162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.363,"smiles":null,"spectrum_id":"CCMSLIB00017277346","spectrum_index":33279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 647.7199 Da; putative annotation: N/A; putative formula: C42H89N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1152.9,"smiles":null,"spectrum_id":"CCMSLIB00017277347","spectrum_index":33280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 283.2865 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.41,"smiles":null,"spectrum_id":"CCMSLIB00017277350","spectrum_index":33281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 14.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.181,"smiles":null,"spectrum_id":"CCMSLIB00017277353","spectrum_index":33282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 216.1145 Da; putative annotation: N/A; putative formula: C8H17N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.195,"smiles":null,"spectrum_id":"CCMSLIB00017277355","spectrum_index":33283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Coumaryl alcohol (delta mass: 126.0831 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.159,"smiles":null,"spectrum_id":"CCMSLIB00017277357","spectrum_index":33284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 95.9961 Da; putative annotation: N/A; putative formula: C3N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.107,"smiles":null,"spectrum_id":"CCMSLIB00017277360","spectrum_index":33285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 517.144 Da; putative annotation: N/A; putative formula: C35H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.209,"smiles":null,"spectrum_id":"CCMSLIB00017277363","spectrum_index":33286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 39.9891 Da; putative annotation: N/A; putative formula: C2HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.116,"smiles":null,"spectrum_id":"CCMSLIB00017277365","spectrum_index":33287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 179.6793 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.75,"smiles":null,"spectrum_id":"CCMSLIB00017277367","spectrum_index":33288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 90.0681 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017277370","spectrum_index":33289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Threoninamide (delta mass: 41.0389 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.12,"smiles":null,"spectrum_id":"CCMSLIB00017277373","spectrum_index":33290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ARABITOL (delta mass: 38.0156 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.091,"smiles":null,"spectrum_id":"CCMSLIB00017277376","spectrum_index":33291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 144.0821 Da; putative annotation: N/A; putative formula: C6H13N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.161,"smiles":null,"spectrum_id":"CCMSLIB00017277377","spectrum_index":33292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 234.1714 Da; putative annotation: N/A; putative formula: C10H18N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.304,"smiles":null,"spectrum_id":"CCMSLIB00017277380","spectrum_index":33293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000511 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 225.1212 Da; putative annotation: N/A; putative formula: C12H21NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.192,"smiles":null,"spectrum_id":"CCMSLIB00017277383","spectrum_index":33294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 133.0371 Da; putative annotation: N/A; putative formula: C5H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.129,"smiles":null,"spectrum_id":"CCMSLIB00017277384","spectrum_index":33295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 16.0059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.087,"smiles":null,"spectrum_id":"CCMSLIB00017277387","spectrum_index":33296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanylleucine (delta mass: 155.0954 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.234,"smiles":null,"spectrum_id":"CCMSLIB00017277390","spectrum_index":33297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 160.0369 Da; putative annotation: N/A; putative formula: C6H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.139,"smiles":null,"spectrum_id":"CCMSLIB00017277393","spectrum_index":33298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-3,4-dimethyl- (delta mass: 128.0849 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.291,"smiles":null,"spectrum_id":"CCMSLIB00017277394","spectrum_index":33299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 58.0385 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.266,"smiles":null,"spectrum_id":"CCMSLIB00017277397","spectrum_index":33300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 30.9806 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.067,"smiles":null,"spectrum_id":"CCMSLIB00017277400","spectrum_index":33301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 117.0751 Da; putative annotation: N/A; putative formula: CH7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.161,"smiles":null,"spectrum_id":"CCMSLIB00017277401","spectrum_index":33302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 46.0166 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.097,"smiles":null,"spectrum_id":"CCMSLIB00017277404","spectrum_index":33303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 763.3862 Da; putative annotation: N/A; putative formula: C34H53N9O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":918.456,"smiles":null,"spectrum_id":"CCMSLIB00017277407","spectrum_index":33304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 213.1199 Da; putative annotation: N/A; putative formula: C11H19NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.218,"smiles":null,"spectrum_id":"CCMSLIB00017277409","spectrum_index":33305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 53.0233 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.177,"smiles":null,"spectrum_id":"CCMSLIB00017277411","spectrum_index":33306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 73.0612 Da; putative annotation: N/A; putative formula: C2H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.143,"smiles":null,"spectrum_id":"CCMSLIB00017277414","spectrum_index":33307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 106.9625 Da; putative annotation: N/A; putative formula: CH4NO-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.075,"smiles":null,"spectrum_id":"CCMSLIB00017277417","spectrum_index":33308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 255.2566 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.327,"smiles":null,"spectrum_id":"CCMSLIB00017277418","spectrum_index":33309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 46.0565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.174,"smiles":null,"spectrum_id":"CCMSLIB00017277421","spectrum_index":33310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 215.2136 Da; putative annotation: N/A; putative formula: C10H25N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.292,"smiles":null,"spectrum_id":"CCMSLIB00017277424","spectrum_index":33311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 163.068 Da; putative annotation: N/A; putative formula: C6H15NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.132,"smiles":null,"spectrum_id":"CCMSLIB00017277427","spectrum_index":33312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 396.1139 Da; putative annotation: N/A; putative formula: C13H24N4O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.155,"smiles":null,"spectrum_id":"CCMSLIB00017277429","spectrum_index":33313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 832.3961 Da; putative annotation: N/A; putative formula: C37H70O14P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1111.5,"smiles":null,"spectrum_id":"CCMSLIB00017277431","spectrum_index":33314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ITOPRIDE HCl (delta mass: 126.1522 Da; putative annotation: N/A; putative formula: C8H18N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.349,"smiles":null,"spectrum_id":"CCMSLIB00017277434","spectrum_index":33315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 362.3458 Da; putative annotation: N/A; putative formula: C25H47O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.422,"smiles":null,"spectrum_id":"CCMSLIB00017277437","spectrum_index":33316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 19.0058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.108,"smiles":null,"spectrum_id":"CCMSLIB00017277439","spectrum_index":33317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 447.1622 Da; putative annotation: N/A; putative formula: C33H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.203,"smiles":null,"spectrum_id":"CCMSLIB00017277442","spectrum_index":33318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 7-fluoro-3-methyl-1H-indole-2-carboxylate (delta mass: 129.1973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.274,"smiles":null,"spectrum_id":"CCMSLIB00017277444","spectrum_index":33319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 644.3504 Da; putative annotation: N/A; putative formula: C28H52N8O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.474,"smiles":null,"spectrum_id":"CCMSLIB00017277447","spectrum_index":33320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 32.9243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.958,"smiles":null,"spectrum_id":"CCMSLIB00017277450","spectrum_index":33321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 43.0138 Da; putative annotation: N/A; putative formula: HN3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.084,"smiles":null,"spectrum_id":"CCMSLIB00017277452","spectrum_index":33322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 179.0783 Da; putative annotation: N/A; putative formula: C3H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.143,"smiles":null,"spectrum_id":"CCMSLIB00017277454","spectrum_index":33323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 22.0358 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.107,"smiles":null,"spectrum_id":"CCMSLIB00017277457","spectrum_index":33324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 52.0313 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.086,"smiles":null,"spectrum_id":"CCMSLIB00017277460","spectrum_index":33325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 225.1056 Da; putative annotation: N/A; putative formula: C9H15N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.259,"smiles":null,"spectrum_id":"CCMSLIB00017277462","spectrum_index":33326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 362.0845 Da; putative annotation: N/A; putative formula: C19H24O-1P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.155,"smiles":null,"spectrum_id":"CCMSLIB00017277464","spectrum_index":33327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 184.1282 Da; putative annotation: N/A; putative formula: C11H20S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.209,"smiles":null,"spectrum_id":"CCMSLIB00017277467","spectrum_index":33328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 298.0479 Da; putative annotation: N/A; putative formula: C9H18N2O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.108,"smiles":null,"spectrum_id":"CCMSLIB00017277470","spectrum_index":33329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 131.0942 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.133,"smiles":null,"spectrum_id":"CCMSLIB00017277472","spectrum_index":33330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 767.4299 Da; putative annotation: N/A; putative formula: C49H57N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":948.501,"smiles":null,"spectrum_id":"CCMSLIB00017277474","spectrum_index":33331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 184.1094 Da; putative annotation: N/A; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.174,"smiles":null,"spectrum_id":"CCMSLIB00017277477","spectrum_index":33332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 46.0053 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.076,"smiles":null,"spectrum_id":"CCMSLIB00017277480","spectrum_index":33333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Amino-5,8-difluorospiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)picolinonitrile (delta mass: 317.1394 Da; putative annotation: N/A; putative formula: C14H24NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.282,"smiles":null,"spectrum_id":"CCMSLIB00017277482","spectrum_index":33334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 70.0412 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.216,"smiles":null,"spectrum_id":"CCMSLIB00017277484","spectrum_index":33335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 281.2222 Da; putative annotation: N/A; putative formula: C14H27N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.288,"smiles":null,"spectrum_id":"CCMSLIB00017277487","spectrum_index":33336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 466.3273 Da; putative annotation: N/A; putative formula: C31H46OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.424,"smiles":null,"spectrum_id":"CCMSLIB00017277490","spectrum_index":33337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 75.0641 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.145,"smiles":null,"spectrum_id":"CCMSLIB00017277491","spectrum_index":33338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one (delta mass: 83.0733 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.144,"smiles":null,"spectrum_id":"CCMSLIB00017277494","spectrum_index":33339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxymorphinan (delta mass: 326.5741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.744,"smiles":null,"spectrum_id":"CCMSLIB00017277497","spectrum_index":33340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 161.2183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.305,"smiles":null,"spectrum_id":"CCMSLIB00017277499","spectrum_index":33341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 494.176 Da; putative annotation: N/A; putative formula: C30H27N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1161.41,"smiles":null,"spectrum_id":"CCMSLIB00017277501","spectrum_index":33342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 110.0439 Da; putative annotation: N/A; putative formula: CH2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.139,"smiles":null,"spectrum_id":"CCMSLIB00017277504","spectrum_index":33343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 418.2208 Da; putative annotation: N/A; putative formula: C23H35N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.328,"smiles":null,"spectrum_id":"CCMSLIB00017277507","spectrum_index":33344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 400.7098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.796,"smiles":null,"spectrum_id":"CCMSLIB00017277510","spectrum_index":33345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(6-Methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-furaldehyde (delta mass: 32.0327 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.081,"smiles":null,"spectrum_id":"CCMSLIB00017277511","spectrum_index":33346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydro-10-phenophosphazinol 10-oxide (delta mass: 43.9803 Da; putative annotation: N/A; putative formula: CHP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.033,"smiles":null,"spectrum_id":"CCMSLIB00017277514","spectrum_index":33347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 200.0901 Da; putative annotation: N/A; putative formula: C9H17N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.244,"smiles":null,"spectrum_id":"CCMSLIB00017277517","spectrum_index":33348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 16.0133 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.089,"smiles":null,"spectrum_id":"CCMSLIB00017277520","spectrum_index":33349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 50.0 eV (delta mass: 117.0577 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.145,"smiles":null,"spectrum_id":"CCMSLIB00017277521","spectrum_index":33350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Ile (delta mass: 71.0371 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.223,"smiles":null,"spectrum_id":"CCMSLIB00017277524","spectrum_index":33351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 989.74 Da; putative annotation: N/A; putative formula: C56H95N9O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1373.89,"smiles":null,"spectrum_id":"CCMSLIB00017277527","spectrum_index":33352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 584.1358 Da; putative annotation: N/A; putative formula: C22H28N6O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":927.259,"smiles":null,"spectrum_id":"CCMSLIB00017277529","spectrum_index":33353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 592.2599 Da; putative annotation: N/A; putative formula: C35H45O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.33,"smiles":null,"spectrum_id":"CCMSLIB00017277532","spectrum_index":33354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU069502 2-Acetamidophenol|N-(2-hydroxyphenyl)acetamide (delta mass: 139.9894 Da; putative annotation: N/A; putative formula: CH4N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.06,"smiles":null,"spectrum_id":"CCMSLIB00017277534","spectrum_index":33355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 341.133 Da; putative annotation: N/A; putative formula: C13H27NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.246,"smiles":null,"spectrum_id":"CCMSLIB00017277537","spectrum_index":33356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 588.233 Da; putative annotation: N/A; putative formula: C40H33N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.351,"smiles":null,"spectrum_id":"CCMSLIB00017277540","spectrum_index":33357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 244.2112 Da; putative annotation: N/A; putative formula: C9H24N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.288,"smiles":null,"spectrum_id":"CCMSLIB00017277542","spectrum_index":33358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.097,"smiles":null,"spectrum_id":"CCMSLIB00017277544","spectrum_index":33359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-6-carboxamide, N-hydroxy-1-[(4-methoxyphenyl)methyl]- (delta mass: 23.0227 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.146,"smiles":null,"spectrum_id":"CCMSLIB00017277547","spectrum_index":33360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 88.0147 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.075,"smiles":null,"spectrum_id":"CCMSLIB00017277549","spectrum_index":33361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 424.2376 Da; putative annotation: N/A; putative formula: C26H28N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.342,"smiles":null,"spectrum_id":"CCMSLIB00017277552","spectrum_index":33362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 24.0364 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.165,"smiles":null,"spectrum_id":"CCMSLIB00017277554","spectrum_index":33363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(4-Fluorophenoxy)phenyl]-N-methylmethanamine (delta mass: 40.9969 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.11,"smiles":null,"spectrum_id":"CCMSLIB00017277557","spectrum_index":33364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385848-01_C19H24N2O_(3alpha,14alpha,16alpha)-14,15-Dihydroeburnamenin-14-ol (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.259,"smiles":null,"spectrum_id":"CCMSLIB00017277560","spectrum_index":33365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 17.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.18,"smiles":null,"spectrum_id":"CCMSLIB00017277563","spectrum_index":33366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 140.195 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.217,"smiles":null,"spectrum_id":"CCMSLIB00017277564","spectrum_index":33367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 337.2746 Da; putative annotation: N/A; putative formula: C18H36N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.346,"smiles":null,"spectrum_id":"CCMSLIB00017277567","spectrum_index":33368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300676 Vincanidine (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.165,"smiles":null,"spectrum_id":"CCMSLIB00017277570","spectrum_index":33369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-6-carboxaldehyde (delta mass: 28.9983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.058,"smiles":null,"spectrum_id":"CCMSLIB00017277573","spectrum_index":33370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Val (delta mass: 78.0142 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.185,"smiles":null,"spectrum_id":"CCMSLIB00017277575","spectrum_index":33371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 432.2104 Da; putative annotation: N/A; putative formula: C19H32N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.281,"smiles":null,"spectrum_id":"CCMSLIB00017277577","spectrum_index":33372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(2-Nitrophenyl)-1,2-ethanediamine (delta mass: 47.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.119,"smiles":null,"spectrum_id":"CCMSLIB00017277580","spectrum_index":33373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 170.0992 Da; putative annotation: N/A; putative formula: C7H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.243,"smiles":null,"spectrum_id":"CCMSLIB00017277583","spectrum_index":33374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 25.0198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.153,"smiles":null,"spectrum_id":"CCMSLIB00017277585","spectrum_index":33375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 62.0359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017277587","spectrum_index":33376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminonicotinic acid (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.066,"smiles":null,"spectrum_id":"CCMSLIB00017277590","spectrum_index":33377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 192.0574 Da; putative annotation: N/A; putative formula: C14H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.207,"smiles":null,"spectrum_id":"CCMSLIB00017277593","spectrum_index":33378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 52.0678 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.154,"smiles":null,"spectrum_id":"CCMSLIB00017277594","spectrum_index":33379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 112.0343 Da; putative annotation: N/A; putative formula: C6H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.122,"smiles":null,"spectrum_id":"CCMSLIB00017277597","spectrum_index":33380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 32.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.123,"smiles":null,"spectrum_id":"CCMSLIB00017277600","spectrum_index":33381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole-1-carboxylic acid, 6-chloro-1,2,3,4-tetrahydro-, ethyl ester (delta mass: 262.0831 Da; putative annotation: N/A; putative formula: C8H15N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.177,"smiles":null,"spectrum_id":"CCMSLIB00017277603","spectrum_index":33382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 141.0628 Da; putative annotation: N/A; putative formula: H3N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.149,"smiles":null,"spectrum_id":"CCMSLIB00017277605","spectrum_index":33383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 71.0369 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.16,"smiles":null,"spectrum_id":"CCMSLIB00017277607","spectrum_index":33384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 322.1057 Da; putative annotation: N/A; putative formula: C16H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.187,"smiles":null,"spectrum_id":"CCMSLIB00017277610","spectrum_index":33385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 18.1045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.258,"smiles":null,"spectrum_id":"CCMSLIB00017277613","spectrum_index":33386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 347.1576 Da; putative annotation: N/A; putative formula: C15H25NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.275,"smiles":null,"spectrum_id":"CCMSLIB00017277615","spectrum_index":33387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-(propylthio)phenylethylamine (delta mass: 39.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.189,"smiles":null,"spectrum_id":"CCMSLIB00017277617","spectrum_index":33388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 114.0792 Da; putative annotation: N/A; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.332,"smiles":null,"spectrum_id":"CCMSLIB00017277620","spectrum_index":33389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 12.9259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.012,"smiles":null,"spectrum_id":"CCMSLIB00017277622","spectrum_index":33390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 152.0477 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.171,"smiles":null,"spectrum_id":"CCMSLIB00017277625","spectrum_index":33391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Glucosamine CollisionEnergy:102040 (delta mass: 259.8028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.9,"smiles":null,"spectrum_id":"CCMSLIB00017277628","spectrum_index":33392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,3,5-Pentamethyl-1,2,3,8-tetrahydro-7H-pyrrolo[3,2-g]quinolin-7-one (delta mass: 36.0238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.189,"smiles":null,"spectrum_id":"CCMSLIB00017277631","spectrum_index":33393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 122.8262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.869,"smiles":null,"spectrum_id":"CCMSLIB00017277632","spectrum_index":33394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 174.124 Da; putative annotation: N/A; putative formula: C5H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.273,"smiles":null,"spectrum_id":"CCMSLIB00017277635","spectrum_index":33395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 286.4419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.596,"smiles":null,"spectrum_id":"CCMSLIB00017277638","spectrum_index":33396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 63.0572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.144,"smiles":null,"spectrum_id":"CCMSLIB00017277641","spectrum_index":33397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Glu (delta mass: 115.0265 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.114,"smiles":null,"spectrum_id":"CCMSLIB00017277642","spectrum_index":33398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169534-02_C14H18O9_Ethanone, 1-[4-(beta-D-glucopyranosyloxy)-2,6-dihydroxyphenyl]- (delta mass: 140.0743 Da; putative annotation: N/A; putative formula: C10H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.177,"smiles":null,"spectrum_id":"CCMSLIB00017277645","spectrum_index":33399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 70.0887 Da; putative annotation: N/A; putative formula: C4H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.164,"smiles":null,"spectrum_id":"CCMSLIB00017277647","spectrum_index":33400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 136.0241 Da; putative annotation: N/A; putative formula: C2H8N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.1,"smiles":null,"spectrum_id":"CCMSLIB00017277649","spectrum_index":33401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 279.1267 Da; putative annotation: N/A; putative formula: C11H17N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.218,"smiles":null,"spectrum_id":"CCMSLIB00017277652","spectrum_index":33402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 114.1061 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.175,"smiles":null,"spectrum_id":"CCMSLIB00017277655","spectrum_index":33403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 324.1057 Da; putative annotation: Palatinose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.229,"smiles":null,"spectrum_id":"CCMSLIB00017277657","spectrum_index":33404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Ile (delta mass: 101.0479 Da; putative annotation: (S)-(+)-4-Amino-3-hydroxybutyric acid; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.218,"smiles":null,"spectrum_id":"CCMSLIB00017277659","spectrum_index":33405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00178646-02!2,4-dihydroxyheptadecyl acetate [IIN-based: Match] (delta mass: 108.0937 Da; putative annotation: Bicyclo[2.2.1]heptane-2-methanol; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.378,"smiles":null,"spectrum_id":"CCMSLIB00017277662","spectrum_index":33406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 293.1071 Da; putative annotation: Massbank:PR311019 Feruloyl dehydrotyramine (isomer of 1655); putative formula: C18H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.178,"smiles":null,"spectrum_id":"CCMSLIB00017277664","spectrum_index":33407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 192.0791 Da; putative annotation: Sinapyl alcohol; putative formula: C11H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.16,"smiles":null,"spectrum_id":"CCMSLIB00017277667","spectrum_index":33408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 150.1038 Da; putative annotation: (+)-trans-Chrysanthemic acid; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.237,"smiles":null,"spectrum_id":"CCMSLIB00017277669","spectrum_index":33409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 230.1518 Da; putative annotation: 2,3-Dihydroxypropyl 9-hydroxynonanoate; putative formula: C12H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.274,"smiles":null,"spectrum_id":"CCMSLIB00017277672","spectrum_index":33410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 148.0164 Da; putative annotation: Phthalic acid; putative formula: C8H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.118,"smiles":null,"spectrum_id":"CCMSLIB00017277675","spectrum_index":33411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 254.0943 Da; putative annotation: 2-Hydroxy-4-methoxy-6-(2-phenylethyl)benzoic acid; putative formula: C16H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017277677","spectrum_index":33412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Glu-Phe from NIST14 (delta mass: 147.0697 Da; putative annotation: L-phenylalanine; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.198,"smiles":null,"spectrum_id":"CCMSLIB00017277679","spectrum_index":33413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 107.0043 Da; putative annotation: N/A; putative formula: C2H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.137,"smiles":null,"spectrum_id":"CCMSLIB00017277682","spectrum_index":33414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 58.0417 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017277685","spectrum_index":33415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 242.071 Da; putative annotation: N/A; putative formula: C11H15O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.226,"smiles":null,"spectrum_id":"CCMSLIB00017277687","spectrum_index":33416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Allylamino)benzoic acid (delta mass: 47.9762 Da; putative annotation: N/A; putative formula: HOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.062,"smiles":null,"spectrum_id":"CCMSLIB00017277689","spectrum_index":33417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 74.0402 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.112,"smiles":null,"spectrum_id":"CCMSLIB00017277692","spectrum_index":33418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 16.0018 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.107,"smiles":null,"spectrum_id":"CCMSLIB00017277695","spectrum_index":33419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 56.0374 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.092,"smiles":null,"spectrum_id":"CCMSLIB00017277696","spectrum_index":33420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 45.0241 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.136,"smiles":null,"spectrum_id":"CCMSLIB00017277699","spectrum_index":33421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 357.2819 Da; putative annotation: N/A; putative formula: C27H35NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.399,"smiles":null,"spectrum_id":"CCMSLIB00017277702","spectrum_index":33422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.117,"smiles":null,"spectrum_id":"CCMSLIB00017277704","spectrum_index":33423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 45.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.118,"smiles":null,"spectrum_id":"CCMSLIB00017277706","spectrum_index":33424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vibriobactin (delta mass: 705.2595 Da; putative annotation: N/A; putative formula: C43H31N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1411.53,"smiles":null,"spectrum_id":"CCMSLIB00017277709","spectrum_index":33425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Leu (delta mass: 97.0171 Da; putative annotation: N/A; putative formula: C4H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.172,"smiles":null,"spectrum_id":"CCMSLIB00017277712","spectrum_index":33426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 233.0906 Da; putative annotation: N/A; putative formula: C10H19NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.182,"smiles":null,"spectrum_id":"CCMSLIB00017277715","spectrum_index":33427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 102.0315 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017277716","spectrum_index":33428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 52.0675 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.18,"smiles":null,"spectrum_id":"CCMSLIB00017277719","spectrum_index":33429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 954.4815 Da; putative annotation: N/A; putative formula: C53H70N4O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1135.55,"smiles":null,"spectrum_id":"CCMSLIB00017277722","spectrum_index":33430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 777.3844 Da; putative annotation: N/A; putative formula: C43H59N3O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.443,"smiles":null,"spectrum_id":"CCMSLIB00017277725","spectrum_index":33431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 67.0429 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.13,"smiles":null,"spectrum_id":"CCMSLIB00017277728","spectrum_index":33432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Propanediol (delta mass: 55.0411 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.101,"smiles":null,"spectrum_id":"CCMSLIB00017277730","spectrum_index":33433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 56.026 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.195,"smiles":null,"spectrum_id":"CCMSLIB00017277732","spectrum_index":33434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 26.9741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.102,"smiles":null,"spectrum_id":"CCMSLIB00017277735","spectrum_index":33435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 70.0423 Da; putative annotation: N/A; putative formula: C4H6O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.16,"smiles":null,"spectrum_id":"CCMSLIB00017277738","spectrum_index":33436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 291.196 Da; putative annotation: N/A; putative formula: C14H30NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.293,"smiles":null,"spectrum_id":"CCMSLIB00017277741","spectrum_index":33437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 228.2087 Da; putative annotation: N/A; putative formula: C14H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.305,"smiles":null,"spectrum_id":"CCMSLIB00017277742","spectrum_index":33438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Gly-Leu (delta mass: 131.0952 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.24,"smiles":null,"spectrum_id":"CCMSLIB00017277745","spectrum_index":33439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 305.0506 Da; putative annotation: N/A; putative formula: C10H15N3O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.174,"smiles":null,"spectrum_id":"CCMSLIB00017277748","spectrum_index":33440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 218.1886 Da; putative annotation: N/A; putative formula: C13H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.29,"smiles":null,"spectrum_id":"CCMSLIB00017277749","spectrum_index":33441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 395.3177 Da; putative annotation: N/A; putative formula: C27H41NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1062.55,"smiles":null,"spectrum_id":"CCMSLIB00017277752","spectrum_index":33442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.081,"smiles":null,"spectrum_id":"CCMSLIB00017277755","spectrum_index":33443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 647.2273 Da; putative annotation: N/A; putative formula: C24H41NO19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.287,"smiles":null,"spectrum_id":"CCMSLIB00017277757","spectrum_index":33444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 61.0313 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.096,"smiles":null,"spectrum_id":"CCMSLIB00017277759","spectrum_index":33445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 239.2344 Da; putative annotation: N/A; putative formula: C14H29N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.42,"smiles":null,"spectrum_id":"CCMSLIB00017277762","spectrum_index":33446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 274.6372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.724,"smiles":null,"spectrum_id":"CCMSLIB00017277765","spectrum_index":33447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 287.6635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.75,"smiles":null,"spectrum_id":"CCMSLIB00017277768","spectrum_index":33448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 307.1617 Da; putative annotation: N/A; putative formula: C10H17N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.248,"smiles":null,"spectrum_id":"CCMSLIB00017277770","spectrum_index":33449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 374.093 Da; putative annotation: N/A; putative formula: C10H22N4O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.134,"smiles":null,"spectrum_id":"CCMSLIB00017277772","spectrum_index":33450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl hydrogen malonate (delta mass: 112.1256 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.175,"smiles":null,"spectrum_id":"CCMSLIB00017277775","spectrum_index":33451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 89.0721 Da; putative annotation: N/A; putative formula: CH7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.174,"smiles":null,"spectrum_id":"CCMSLIB00017277778","spectrum_index":33452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 28.0745 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.182,"smiles":null,"spectrum_id":"CCMSLIB00017277780","spectrum_index":33453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 10.9824 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.074,"smiles":null,"spectrum_id":"CCMSLIB00017277783","spectrum_index":33454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 607.3722 Da; putative annotation: N/A; putative formula: C33H53NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.443,"smiles":null,"spectrum_id":"CCMSLIB00017277785","spectrum_index":33455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 54.0832 Da; putative annotation: N/A; putative formula: C5H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.164,"smiles":null,"spectrum_id":"CCMSLIB00017277788","spectrum_index":33456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 126.0317 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.123,"smiles":null,"spectrum_id":"CCMSLIB00017277791","spectrum_index":33457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 54.0674 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.216,"smiles":null,"spectrum_id":"CCMSLIB00017277793","spectrum_index":33458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 389.2925 Da; putative annotation: N/A; putative formula: C24H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.389,"smiles":null,"spectrum_id":"CCMSLIB00017277796","spectrum_index":33459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 182.0543 Da; putative annotation: N/A; putative formula: C4H10N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.145,"smiles":null,"spectrum_id":"CCMSLIB00017277797","spectrum_index":33460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 58.0432 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.103,"smiles":null,"spectrum_id":"CCMSLIB00017277800","spectrum_index":33461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 466.3926 Da; putative annotation: N/A; putative formula: C31H50N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.52,"smiles":null,"spectrum_id":"CCMSLIB00017277803","spectrum_index":33462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 304.1886 Da; putative annotation: N/A; putative formula: C15H28O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.301,"smiles":null,"spectrum_id":"CCMSLIB00017277806","spectrum_index":33463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1049.5972 Da; putative annotation: N/A; putative formula: C61H83N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1212.66,"smiles":null,"spectrum_id":"CCMSLIB00017277808","spectrum_index":33464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 182.0783 Da; putative annotation: N/A; putative formula: C10H16O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.202,"smiles":null,"spectrum_id":"CCMSLIB00017277810","spectrum_index":33465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:102040 (delta mass: 200.1405 Da; putative annotation: N/A; putative formula: C11H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.221,"smiles":null,"spectrum_id":"CCMSLIB00017277813","spectrum_index":33466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 59.0605 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.194,"smiles":null,"spectrum_id":"CCMSLIB00017277816","spectrum_index":33467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 127.0673 Da; putative annotation: N/A; putative formula: C5H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.18,"smiles":null,"spectrum_id":"CCMSLIB00017277819","spectrum_index":33468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 150.059 Da; putative annotation: N/A; putative formula: C9H11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.118,"smiles":null,"spectrum_id":"CCMSLIB00017277820","spectrum_index":33469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 14.0114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.165,"smiles":null,"spectrum_id":"CCMSLIB00017277823","spectrum_index":33470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 126.0797 Da; putative annotation: N/A; putative formula: C6H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.202,"smiles":null,"spectrum_id":"CCMSLIB00017277826","spectrum_index":33471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 15.9994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.103,"smiles":null,"spectrum_id":"CCMSLIB00017277829","spectrum_index":33472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Methylsulfanyl)-9H-pyrimido[4,5-b]indole (delta mass: 23.0121 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.071,"smiles":null,"spectrum_id":"CCMSLIB00017277832","spectrum_index":33473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 147.0679 Da; putative annotation: N/A; putative formula: C3H10N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.17,"smiles":null,"spectrum_id":"CCMSLIB00017277834","spectrum_index":33474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rupicolin (sordidone) (delta mass: 17.0709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.097,"smiles":null,"spectrum_id":"CCMSLIB00017277836","spectrum_index":33475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-L-phenylalanine (delta mass: 64.0679 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.144,"smiles":null,"spectrum_id":"CCMSLIB00017277839","spectrum_index":33476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 81.0465 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.16,"smiles":null,"spectrum_id":"CCMSLIB00017277842","spectrum_index":33477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 293.1261 Da; putative annotation: N/A; putative formula: C15H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.197,"smiles":null,"spectrum_id":"CCMSLIB00017277844","spectrum_index":33478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 150.9948 Da; putative annotation: N/A; putative formula: C4H9NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.154,"smiles":null,"spectrum_id":"CCMSLIB00017277846","spectrum_index":33479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 271.1048 Da; putative annotation: N/A; putative formula: C16H19NO-1P2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.16,"smiles":null,"spectrum_id":"CCMSLIB00017277849","spectrum_index":33480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 284.0899 Da; putative annotation: N/A; putative formula: C16H17N2O-1PS)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.16,"smiles":null,"spectrum_id":"CCMSLIB00017277852","spectrum_index":33481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 323.1966 Da; putative annotation: N/A; putative formula: C16H21N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.262,"smiles":null,"spectrum_id":"CCMSLIB00017277854","spectrum_index":33482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenoxy-N-(2-pyridinylmethyl)benzamide (delta mass: 90.078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.207,"smiles":null,"spectrum_id":"CCMSLIB00017277857","spectrum_index":33483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 249.1695 Da; putative annotation: N/A; putative formula: C10H23N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.323,"smiles":null,"spectrum_id":"CCMSLIB00017277859","spectrum_index":33484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE10; MS2Dec (delta mass: 171.0488 Da; putative annotation: N/A; putative formula: C6H11N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.13,"smiles":null,"spectrum_id":"CCMSLIB00017277862","spectrum_index":33485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 454.159 Da; putative annotation: N/A; putative formula: C20H26N2O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1121.39,"smiles":null,"spectrum_id":"CCMSLIB00017277865","spectrum_index":33486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 37.002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.161,"smiles":null,"spectrum_id":"CCMSLIB00017277868","spectrum_index":33487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 157.9756 Da; putative annotation: N/A; putative formula: C5H3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.056,"smiles":null,"spectrum_id":"CCMSLIB00017277870","spectrum_index":33488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 168.1177 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.257,"smiles":null,"spectrum_id":"CCMSLIB00017277872","spectrum_index":33489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 27.9378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.034,"smiles":null,"spectrum_id":"CCMSLIB00017277875","spectrum_index":33490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP019001 Phenanzine-1-carboxylic acid|phenazine-1-carboxylic acid (delta mass: 87.0321 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.098,"smiles":null,"spectrum_id":"CCMSLIB00017277878","spectrum_index":33491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 78.0342 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.115,"smiles":null,"spectrum_id":"CCMSLIB00017277880","spectrum_index":33492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Oxomorphine (delta mass: 42.0097 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.133,"smiles":null,"spectrum_id":"CCMSLIB00017277882","spectrum_index":33493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(hydroxymethyl)-2-methyl-2-(5-oxooxolan-2-yl)-3H-chromen-4-one (delta mass: 45.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.159,"smiles":null,"spectrum_id":"CCMSLIB00017277885","spectrum_index":33494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine, 6-sulfate (delta mass: 160.074 Da; putative annotation: N/A; putative formula: C2H9N8O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.117,"smiles":null,"spectrum_id":"CCMSLIB00017277888","spectrum_index":33495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 479.1635 Da; putative annotation: N/A; putative formula: C17H25N11O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.223,"smiles":null,"spectrum_id":"CCMSLIB00017277890","spectrum_index":33496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 281.1375 Da; putative annotation: N/A; putative formula: C13H19N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.234,"smiles":null,"spectrum_id":"CCMSLIB00017277892","spectrum_index":33497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 203.1528 Da; putative annotation: N/A; putative formula: C11H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.218,"smiles":null,"spectrum_id":"CCMSLIB00017277895","spectrum_index":33498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of haplamine (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.133,"smiles":null,"spectrum_id":"CCMSLIB00017277898","spectrum_index":33499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 225.1679 Da; putative annotation: N/A; putative formula: C12H23N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.244,"smiles":null,"spectrum_id":"CCMSLIB00017277900","spectrum_index":33500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 392.1286 Da; putative annotation: N/A; putative formula: C22H21N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.21,"smiles":null,"spectrum_id":"CCMSLIB00017277902","spectrum_index":33501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 9.9967 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.094,"smiles":null,"spectrum_id":"CCMSLIB00017277905","spectrum_index":33502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 19.0406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.101,"smiles":null,"spectrum_id":"CCMSLIB00017277908","spectrum_index":33503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 212.1751 Da; putative annotation: N/A; putative formula: C9H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.262,"smiles":null,"spectrum_id":"CCMSLIB00017277910","spectrum_index":33504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 292.1794 Da; putative annotation: N/A; putative formula: C17H20N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.313,"smiles":null,"spectrum_id":"CCMSLIB00017277913","spectrum_index":33505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 297.1207 Da; putative annotation: N/A; putative formula: C10H27N3O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.191,"smiles":null,"spectrum_id":"CCMSLIB00017277915","spectrum_index":33506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 179.0631 Da; putative annotation: N/A; putative formula: C7H9N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.232,"smiles":null,"spectrum_id":"CCMSLIB00017277918","spectrum_index":33507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 413.1998 Da; putative annotation: N/A; putative formula: C20H27N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.297,"smiles":null,"spectrum_id":"CCMSLIB00017277921","spectrum_index":33508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 28.9815 Da; putative annotation: N/A; putative formula: NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.027,"smiles":null,"spectrum_id":"CCMSLIB00017277922","spectrum_index":33509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylhistamine CollisionEnergy:102040 (delta mass: 78.9843 Da; putative annotation: N/A; putative formula: H2NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.087,"smiles":null,"spectrum_id":"CCMSLIB00017277925","spectrum_index":33510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 46.0741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.14,"smiles":null,"spectrum_id":"CCMSLIB00017277928","spectrum_index":33511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 534.2562 Da; putative annotation: N/A; putative formula: C32H42N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":807.383,"smiles":null,"spectrum_id":"CCMSLIB00017277931","spectrum_index":33512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 195.2069 Da; putative annotation: N/A; putative formula: C12H25N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.268,"smiles":null,"spectrum_id":"CCMSLIB00017277932","spectrum_index":33513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 449.2986 Da; putative annotation: N/A; putative formula: C22H43NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.369,"smiles":null,"spectrum_id":"CCMSLIB00017277935","spectrum_index":33514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 234.0534 Da; putative annotation: N/A; putative formula: C5H10N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.177,"smiles":null,"spectrum_id":"CCMSLIB00017277938","spectrum_index":33515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin Pr-LL (delta mass: 427.2796 Da; putative annotation: N/A; putative formula: C20H37N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.598,"smiles":null,"spectrum_id":"CCMSLIB00017277939","spectrum_index":33516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 196.219 Da; putative annotation: N/A; putative formula: C14H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.284,"smiles":null,"spectrum_id":"CCMSLIB00017277942","spectrum_index":33517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 24.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.144,"smiles":null,"spectrum_id":"CCMSLIB00017277945","spectrum_index":33518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 214.1201 Da; putative annotation: N/A; putative formula: C11H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.185,"smiles":null,"spectrum_id":"CCMSLIB00017277948","spectrum_index":33519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 284.214 Da; putative annotation: N/A; putative formula: C20H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.279,"smiles":null,"spectrum_id":"CCMSLIB00017277949","spectrum_index":33520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 290.8773 Da; putative annotation: N/A; putative formula: C8H5NO-1S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.0,"smiles":null,"spectrum_id":"CCMSLIB00017277952","spectrum_index":33521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-crinamine (delta mass: 196.0778 Da; putative annotation: N/A; putative formula: C8H12N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.216,"smiles":null,"spectrum_id":"CCMSLIB00017277955","spectrum_index":33522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 103.0414 Da; putative annotation: N/A; putative formula: C7H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.18,"smiles":null,"spectrum_id":"CCMSLIB00017277956","spectrum_index":33523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,5,7-trimethyl-6-(piperidylsulfonyl)hydroquinolin-2-one CollisionEnergy:102040\"\" (delta mass: 334.1336 Da; putative annotation: N/A; putative formula: C18H23O4P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.276,"smiles":null,"spectrum_id":"CCMSLIB00017277959","spectrum_index":33524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol (delta mass: 168.0991 Da; putative annotation: N/A; putative formula: C3H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.232,"smiles":null,"spectrum_id":"CCMSLIB00017277962","spectrum_index":33525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 45.0277 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.11,"smiles":null,"spectrum_id":"CCMSLIB00017277965","spectrum_index":33526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 350.0996 Da; putative annotation: N/A; putative formula: C11H19N4O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.197,"smiles":null,"spectrum_id":"CCMSLIB00017277966","spectrum_index":33527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000521341-01!Acridinamine (delta mass: 121.0525 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.144,"smiles":null,"spectrum_id":"CCMSLIB00017277969","spectrum_index":33528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,4-Dinitrophenyl)-L-alanine methyl ester (delta mass: 76.0345 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.107,"smiles":null,"spectrum_id":"CCMSLIB00017277972","spectrum_index":33529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 78.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.19,"smiles":null,"spectrum_id":"CCMSLIB00017277973","spectrum_index":33530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 384.2509 Da; putative annotation: N/A; putative formula: C21H36O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.322,"smiles":null,"spectrum_id":"CCMSLIB00017277976","spectrum_index":33531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00403 Camptothecin (delta mass: 45.9968 Da; putative annotation: N/A; putative formula: CH3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.115,"smiles":null,"spectrum_id":"CCMSLIB00017277979","spectrum_index":33532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 30.0 eV (delta mass: 234.1154 Da; putative annotation: N/A; putative formula: C16H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.218,"smiles":null,"spectrum_id":"CCMSLIB00017277982","spectrum_index":33533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 155.1247 Da; putative annotation: N/A; putative formula: C9H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.223,"smiles":null,"spectrum_id":"CCMSLIB00017277983","spectrum_index":33534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 198.204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.399,"smiles":null,"spectrum_id":"CCMSLIB00017277986","spectrum_index":33535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 165.0461 Da; putative annotation: N/A; putative formula: C5H11NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.175,"smiles":null,"spectrum_id":"CCMSLIB00017277989","spectrum_index":33536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 30.035 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.106,"smiles":null,"spectrum_id":"CCMSLIB00017277990","spectrum_index":33537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 10.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.144,"smiles":null,"spectrum_id":"CCMSLIB00017277993","spectrum_index":33538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 176.0317 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.099,"smiles":null,"spectrum_id":"CCMSLIB00017277996","spectrum_index":33539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 61.9471 Da; putative annotation: N/A; putative formula: P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.984,"smiles":null,"spectrum_id":"CCMSLIB00017277998","spectrum_index":33540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannose 6-phosphate (delta mass: 154.0012 Da; putative annotation: N/A; putative formula: C5H2N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.038,"smiles":null,"spectrum_id":"CCMSLIB00017278001","spectrum_index":33541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 123.9706 Da; putative annotation: N/A; putative formula: C5HO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.057,"smiles":null,"spectrum_id":"CCMSLIB00017278003","spectrum_index":33542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 72.0474 Da; putative annotation: N/A; putative formula: C4H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.147,"smiles":null,"spectrum_id":"CCMSLIB00017278006","spectrum_index":33543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 270.1359 Da; putative annotation: N/A; putative formula: C16H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.222,"smiles":null,"spectrum_id":"CCMSLIB00017278009","spectrum_index":33544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin D (delta mass: 54.0465 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.31,"smiles":null,"spectrum_id":"CCMSLIB00017278010","spectrum_index":33545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 162.0534 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.155,"smiles":null,"spectrum_id":"CCMSLIB00017278013","spectrum_index":33546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 150.0313 Da; putative annotation: N/A; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.065,"smiles":null,"spectrum_id":"CCMSLIB00017278016","spectrum_index":33547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 8.9447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.984,"smiles":null,"spectrum_id":"CCMSLIB00017278019","spectrum_index":33548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Amino-2-methylquinolin-4-ol (delta mass: 62.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.145,"smiles":null,"spectrum_id":"CCMSLIB00017278020","spectrum_index":33549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-ethyl-4-methylhydroquinolin-2-one CollisionEnergy:205060 (delta mass: 158.0224 Da; putative annotation: N/A; putative formula: C7H10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.129,"smiles":null,"spectrum_id":"CCMSLIB00017278023","spectrum_index":33550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-glutamic acid (delta mass: 85.0247 Da; putative annotation: N/A; putative formula: C2H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.08,"smiles":null,"spectrum_id":"CCMSLIB00017278026","spectrum_index":33551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 531.2685 Da; putative annotation: N/A; putative formula: C28H42N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.339,"smiles":null,"spectrum_id":"CCMSLIB00017278028","spectrum_index":33552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 489.1631 Da; putative annotation: N/A; putative formula: C37H19N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.234,"smiles":null,"spectrum_id":"CCMSLIB00017278030","spectrum_index":33553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 118.0613 Da; putative annotation: N/A; putative formula: CH6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.247,"smiles":null,"spectrum_id":"CCMSLIB00017278033","spectrum_index":33554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Fructosyl isoleucine (delta mass: 532.2627 Da; putative annotation: N/A; putative formula: C37H32N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":826.417,"smiles":null,"spectrum_id":"CCMSLIB00017278036","spectrum_index":33555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 132.041 Da; putative annotation: N/A; putative formula: C9H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.147,"smiles":null,"spectrum_id":"CCMSLIB00017278038","spectrum_index":33556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 72.0021 Da; putative annotation: N/A; putative formula: C3H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.039,"smiles":null,"spectrum_id":"CCMSLIB00017278040","spectrum_index":33557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 180.0634 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.16,"smiles":null,"spectrum_id":"CCMSLIB00017278043","spectrum_index":33558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 340.2479 Da; putative annotation: N/A; putative formula: C17H32N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.345,"smiles":null,"spectrum_id":"CCMSLIB00017278046","spectrum_index":33559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 182.0515 Da; putative annotation: N/A; putative formula: C8H10N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.169,"smiles":null,"spectrum_id":"CCMSLIB00017278048","spectrum_index":33560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 71.0738 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.176,"smiles":null,"spectrum_id":"CCMSLIB00017278050","spectrum_index":33561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 463.1494 Da; putative annotation: N/A; putative formula: C24H33NS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":968.326,"smiles":null,"spectrum_id":"CCMSLIB00017278053","spectrum_index":33562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 402.0999 Da; putative annotation: N/A; putative formula: C18H18N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.202,"smiles":null,"spectrum_id":"CCMSLIB00017278056","spectrum_index":33563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-MANNOSAMINE - 30.0 eV (delta mass: 263.6113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.698,"smiles":null,"spectrum_id":"CCMSLIB00017278057","spectrum_index":33564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 227.2257 Da; putative annotation: N/A; putative formula: C14H29NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.375,"smiles":null,"spectrum_id":"CCMSLIB00017278060","spectrum_index":33565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 95.0746 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.244,"smiles":null,"spectrum_id":"CCMSLIB00017278063","spectrum_index":33566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 63.0091 Da; putative annotation: N/A; putative formula: C4HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.08,"smiles":null,"spectrum_id":"CCMSLIB00017278064","spectrum_index":33567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 355.2453 Da; putative annotation: N/A; putative formula: C22H33N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.399,"smiles":null,"spectrum_id":"CCMSLIB00017278067","spectrum_index":33568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 82.026 Da; putative annotation: N/A; putative formula: C5H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017278070","spectrum_index":33569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of harmaline (delta mass: 132.0424 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.16,"smiles":null,"spectrum_id":"CCMSLIB00017278072","spectrum_index":33570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 97.0524 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017278074","spectrum_index":33571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 680.7391 Da; putative annotation: N/A; putative formula: C48H92N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.825,"smiles":null,"spectrum_id":"CCMSLIB00017278077","spectrum_index":33572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mitoridine (delta mass: 32.0334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.209,"smiles":null,"spectrum_id":"CCMSLIB00017278080","spectrum_index":33573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 597.2404 Da; putative annotation: N/A; putative formula: C26H51N3S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.352,"smiles":null,"spectrum_id":"CCMSLIB00017278082","spectrum_index":33574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 300.2083 Da; putative annotation: N/A; putative formula: C14H29N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.362,"smiles":null,"spectrum_id":"CCMSLIB00017278084","spectrum_index":33575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 501.7632 Da; putative annotation: N/A; putative formula: C16H6O-1S10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.823,"smiles":null,"spectrum_id":"CCMSLIB00017278087","spectrum_index":33576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 103.0226 Da; putative annotation: N/A; putative formula: C2H5N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.13,"smiles":null,"spectrum_id":"CCMSLIB00017278090","spectrum_index":33577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 330.8531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.955,"smiles":null,"spectrum_id":"CCMSLIB00017278091","spectrum_index":33578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 276.2165 Da; putative annotation: N/A; putative formula: C12H28N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.303,"smiles":null,"spectrum_id":"CCMSLIB00017278094","spectrum_index":33579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 251.1442 Da; putative annotation: N/A; putative formula: C14H22NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.298,"smiles":null,"spectrum_id":"CCMSLIB00017278097","spectrum_index":33580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.122,"smiles":null,"spectrum_id":"CCMSLIB00017278100","spectrum_index":33581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 728.36 Da; putative annotation: N/A; putative formula: C33H56N6O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":855.399,"smiles":null,"spectrum_id":"CCMSLIB00017278101","spectrum_index":33582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 162.05 Da; putative annotation: N/A; putative formula: C2H6N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.177,"smiles":null,"spectrum_id":"CCMSLIB00017278104","spectrum_index":33583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 63.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.181,"smiles":null,"spectrum_id":"CCMSLIB00017278107","spectrum_index":33584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Trp (delta mass: 99.0689 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.193,"smiles":null,"spectrum_id":"CCMSLIB00017278110","spectrum_index":33585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 78.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.157,"smiles":null,"spectrum_id":"CCMSLIB00017278113","spectrum_index":33586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 90.0834 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017278114","spectrum_index":33587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 14.0123 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.06,"smiles":null,"spectrum_id":"CCMSLIB00017278117","spectrum_index":33588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 85.051 Da; putative annotation: N/A; putative formula: H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.106,"smiles":null,"spectrum_id":"CCMSLIB00017278120","spectrum_index":33589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 7.9568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.064,"smiles":null,"spectrum_id":"CCMSLIB00017278122","spectrum_index":33590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 174.1166 Da; putative annotation: N/A; putative formula: C9H19OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.25,"smiles":null,"spectrum_id":"CCMSLIB00017278124","spectrum_index":33591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 154.0786 Da; putative annotation: N/A; putative formula: C12H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.144,"smiles":null,"spectrum_id":"CCMSLIB00017278127","spectrum_index":33592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 17.9809 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.068,"smiles":null,"spectrum_id":"CCMSLIB00017278130","spectrum_index":33593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy-2-pyridinecarboxylic acid (delta mass: 113.084 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017278133","spectrum_index":33594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 31.0149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.148,"smiles":null,"spectrum_id":"CCMSLIB00017278134","spectrum_index":33595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 102.0895 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.181,"smiles":null,"spectrum_id":"CCMSLIB00017278137","spectrum_index":33596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 84.151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.226,"smiles":null,"spectrum_id":"CCMSLIB00017278140","spectrum_index":33597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 304.079 Da; putative annotation: N/A; putative formula: C12H16O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.15,"smiles":null,"spectrum_id":"CCMSLIB00017278143","spectrum_index":33598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 14.0152 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.201,"smiles":null,"spectrum_id":"CCMSLIB00017278145","spectrum_index":33599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 42.0581 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.227,"smiles":null,"spectrum_id":"CCMSLIB00017278147","spectrum_index":33600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 234.1243 Da; putative annotation: N/A; putative formula: C8H19N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.216,"smiles":null,"spectrum_id":"CCMSLIB00017278150","spectrum_index":33601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 85.0633 Da; putative annotation: N/A; putative formula: C3H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.135,"smiles":null,"spectrum_id":"CCMSLIB00017278153","spectrum_index":33602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 118.0783 Da; putative annotation: N/A; putative formula: C9H10)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017278154","spectrum_index":33603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 160.2179 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.304,"smiles":null,"spectrum_id":"CCMSLIB00017278157","spectrum_index":33604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 113.0854 Da; putative annotation: NORLEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.23,"smiles":null,"spectrum_id":"CCMSLIB00017278160","spectrum_index":33605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 113.0847 Da; putative annotation: NORLEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.255,"smiles":null,"spectrum_id":"CCMSLIB00017278161","spectrum_index":33606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-O-((2E)-3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoyl)hex-2-ulofuranosyl hexopyranoside (delta mass: 108.0205 Da; putative annotation: 5-(Hydroxymethyl)-2-furaldehyde; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.191,"smiles":null,"spectrum_id":"CCMSLIB00017278164","spectrum_index":33607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 136.0524 Da; putative annotation: (3,4-Dihydroxyphenyl)ethanol; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017278167","spectrum_index":33608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 166.0627 Da; putative annotation: 1H-Imidazole-4,5-dicarbohydrazide; putative formula: C5H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.191,"smiles":null,"spectrum_id":"CCMSLIB00017278169","spectrum_index":33609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 210.1365 Da; putative annotation: Leu-Pro; putative formula: C11H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.291,"smiles":null,"spectrum_id":"CCMSLIB00017278171","spectrum_index":33610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 164.047 Da; putative annotation: Methyl 2-hydroxy-4-methoxybenzoate; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.128,"smiles":null,"spectrum_id":"CCMSLIB00017278174","spectrum_index":33611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 320.2364 Da; putative annotation: 8,9-Dihydroxy-5Z,11Z,14Z-eicosatrienoic acid; putative formula: C20H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.369,"smiles":null,"spectrum_id":"CCMSLIB00017278177","spectrum_index":33612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 166.0996 Da; putative annotation: cis-Pinonic acid; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.165,"smiles":null,"spectrum_id":"CCMSLIB00017278179","spectrum_index":33613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 190.1405 Da; putative annotation: 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.221,"smiles":null,"spectrum_id":"CCMSLIB00017278182","spectrum_index":33614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 926.4927 Da; putative annotation: 3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E,6R)-6-[(1R,3R,6S,8R,12S,15R,16R)-13,17-dihydroxy-7,7,12,16-tetramethyl-6-{[(2R)-3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl]oxy}pentacyclo[9.7.0.0,.0,?.0,?]octadecan-15-yl]-2-methylhept-2-enoate; putative formula: C47H74O18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1107.56,"smiles":null,"spectrum_id":"CCMSLIB00017278184","spectrum_index":33615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 248.1407 Da; putative annotation: Strobilactone A; putative formula: C15H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.211,"smiles":null,"spectrum_id":"CCMSLIB00017278187","spectrum_index":33616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 298.1774 Da; putative annotation: (5E)-4,7,8-Trihydroxy-2-(2-hydroxypentyl)-9,9-dimethyl-3,4,7,8-tetrahydro-2H-oxecin-10-one; putative formula: C16H26O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.258,"smiles":null,"spectrum_id":"CCMSLIB00017278189","spectrum_index":33617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tapentadol-.beta.-D-glucuronide (delta mass: 38.0147 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.232,"smiles":null,"spectrum_id":"CCMSLIB00017278192","spectrum_index":33618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 17.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.15,"smiles":null,"spectrum_id":"CCMSLIB00017278195","spectrum_index":33619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methylphenyl)-1H-indole (delta mass: 124.0847 Da; putative annotation: N/A; putative formula: C4H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.197,"smiles":null,"spectrum_id":"CCMSLIB00017278198","spectrum_index":33620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 32.0691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.15,"smiles":null,"spectrum_id":"CCMSLIB00017278199","spectrum_index":33621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 25.9521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.957,"smiles":null,"spectrum_id":"CCMSLIB00017278202","spectrum_index":33622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 56.0612 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.168,"smiles":null,"spectrum_id":"CCMSLIB00017278205","spectrum_index":33623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 46.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.117,"smiles":null,"spectrum_id":"CCMSLIB00017278208","spectrum_index":33624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 403.9852 Da; putative annotation: N/A; putative formula: C3H8N12O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.087,"smiles":null,"spectrum_id":"CCMSLIB00017278211","spectrum_index":33625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putative analog of trichodinA (delta mass: 402.2011 Da; putative annotation: N/A; putative formula: C19H34N2O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.407,"smiles":null,"spectrum_id":"CCMSLIB00017278213","spectrum_index":33626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 192.0998 Da; putative annotation: N/A; putative formula: C8H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.16,"smiles":null,"spectrum_id":"CCMSLIB00017278216","spectrum_index":33627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 193.0468 Da; putative annotation: N/A; putative formula: C4H3N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.202,"smiles":null,"spectrum_id":"CCMSLIB00017278219","spectrum_index":33628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 56.0439 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.14,"smiles":null,"spectrum_id":"CCMSLIB00017278221","spectrum_index":33629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 313.0952 Da; putative annotation: N/A; putative formula: C17H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.192,"smiles":null,"spectrum_id":"CCMSLIB00017278224","spectrum_index":33630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 798.2016 Da; putative annotation: N/A; putative formula: C60H30OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.267,"smiles":null,"spectrum_id":"CCMSLIB00017278227","spectrum_index":33631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 352.1878 Da; putative annotation: N/A; putative formula: C23H30O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.258,"smiles":null,"spectrum_id":"CCMSLIB00017278229","spectrum_index":33632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 38.0154 Da; putative annotation: N/A; putative formula: C3H2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.081,"smiles":null,"spectrum_id":"CCMSLIB00017278232","spectrum_index":33633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 113.0367 Da; putative annotation: N/A; putative formula: C7H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.087,"smiles":null,"spectrum_id":"CCMSLIB00017278235","spectrum_index":33634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(?)-ampicillin - 40.0 eV (delta mass: 178.0417 Da; putative annotation: N/A; putative formula: C13H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.159,"smiles":null,"spectrum_id":"CCMSLIB00017278238","spectrum_index":33635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 12.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.164,"smiles":null,"spectrum_id":"CCMSLIB00017278240","spectrum_index":33636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 104.0724 Da; putative annotation: N/A; putative formula: C7H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017278243","spectrum_index":33637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 123.06 Da; putative annotation: N/A; putative formula: C7H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.12,"smiles":null,"spectrum_id":"CCMSLIB00017278246","spectrum_index":33638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 149.0496 Da; putative annotation: N/A; putative formula: C7H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.205,"smiles":null,"spectrum_id":"CCMSLIB00017278248","spectrum_index":33639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 37.0565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.101,"smiles":null,"spectrum_id":"CCMSLIB00017278251","spectrum_index":33640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 61.0317 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017278253","spectrum_index":33641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 320.3068 Da; putative annotation: N/A; putative formula: C22H40O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":929.578,"smiles":null,"spectrum_id":"CCMSLIB00017278256","spectrum_index":33642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2,3-dihydro-1H-indole (delta mass: 57.0665 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.138,"smiles":null,"spectrum_id":"CCMSLIB00017278259","spectrum_index":33643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 172.1212 Da; putative annotation: N/A; putative formula: C8H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.197,"smiles":null,"spectrum_id":"CCMSLIB00017278261","spectrum_index":33644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Norepinephrine from NIST14 (delta mass: 20.4888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.57,"smiles":null,"spectrum_id":"CCMSLIB00017278264","spectrum_index":33645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"8-[(2,5-dimethylphenyl)methylthio]-9-methylhydropurin-6-one CollisionEnergy:205060\"\" (delta mass: 46.0008 Da; putative annotation: N/A; putative formula: H2N2O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.113,"smiles":null,"spectrum_id":"CCMSLIB00017278267","spectrum_index":33646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 360.1985 Da; putative annotation: N/A; putative formula: C19H28N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.322,"smiles":null,"spectrum_id":"CCMSLIB00017278269","spectrum_index":33647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 300.1536 Da; putative annotation: N/A; putative formula: C13H25N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.24,"smiles":null,"spectrum_id":"CCMSLIB00017278272","spectrum_index":33648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 216.0785 Da; putative annotation: N/A; putative formula: C13H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.149,"smiles":null,"spectrum_id":"CCMSLIB00017278274","spectrum_index":33649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 142.1508 Da; putative annotation: N/A; putative formula: C8H18N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.221,"smiles":null,"spectrum_id":"CCMSLIB00017278277","spectrum_index":33650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 104.0992 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.232,"smiles":null,"spectrum_id":"CCMSLIB00017278280","spectrum_index":33651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.108,"smiles":null,"spectrum_id":"CCMSLIB00017278283","spectrum_index":33652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 209.1082 Da; putative annotation: N/A; putative formula: C10H16N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.179,"smiles":null,"spectrum_id":"CCMSLIB00017278285","spectrum_index":33653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxy-2,2-dimethyl-4-chromanol (delta mass: 101.0884 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.206,"smiles":null,"spectrum_id":"CCMSLIB00017278287","spectrum_index":33654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 70.0413 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.128,"smiles":null,"spectrum_id":"CCMSLIB00017278290","spectrum_index":33655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 72.0184 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.094,"smiles":null,"spectrum_id":"CCMSLIB00017278293","spectrum_index":33656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 60.0932 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.128,"smiles":null,"spectrum_id":"CCMSLIB00017278295","spectrum_index":33657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 439.1414 Da; putative annotation: N/A; putative formula: C20H25NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.212,"smiles":null,"spectrum_id":"CCMSLIB00017278298","spectrum_index":33658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 449.3762 Da; putative annotation: N/A; putative formula: C30H47N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.545,"smiles":null,"spectrum_id":"CCMSLIB00017278301","spectrum_index":33659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 79.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.128,"smiles":null,"spectrum_id":"CCMSLIB00017278304","spectrum_index":33660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00016 Biotin (delta mass: 148.088 Da; putative annotation: N/A; putative formula: C4H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.183,"smiles":null,"spectrum_id":"CCMSLIB00017278306","spectrum_index":33661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 118.0756 Da; putative annotation: N/A; putative formula: C4H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.12,"smiles":null,"spectrum_id":"CCMSLIB00017278308","spectrum_index":33662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(aminocarbonylamino)-3-indol-3-ylpropanoic acid CollisionEnergy:102040 (delta mass: 158.0698 Da; putative annotation: N/A; putative formula: C6H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.173,"smiles":null,"spectrum_id":"CCMSLIB00017278311","spectrum_index":33663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 469.2784 Da; putative annotation: N/A; putative formula: C23H39N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.339,"smiles":null,"spectrum_id":"CCMSLIB00017278314","spectrum_index":33664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 72.11 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.223,"smiles":null,"spectrum_id":"CCMSLIB00017278316","spectrum_index":33665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 31.0784 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.149,"smiles":null,"spectrum_id":"CCMSLIB00017278319","spectrum_index":33666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 350.2045 Da; putative annotation: N/A; putative formula: C17H35O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.263,"smiles":null,"spectrum_id":"CCMSLIB00017278321","spectrum_index":33667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 190.1337 Da; putative annotation: N/A; putative formula: C9H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.192,"smiles":null,"spectrum_id":"CCMSLIB00017278324","spectrum_index":33668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 153.1154 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.295,"smiles":null,"spectrum_id":"CCMSLIB00017278327","spectrum_index":33669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 103.074 Da; putative annotation: N/A; putative formula: C3H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.243,"smiles":null,"spectrum_id":"CCMSLIB00017278329","spectrum_index":33670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 286.1522 Da; putative annotation: N/A; putative formula: C15H27OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.193,"smiles":null,"spectrum_id":"CCMSLIB00017278332","spectrum_index":33671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 737.2592 Da; putative annotation: N/A; putative formula: C41H43N3O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1242.44,"smiles":null,"spectrum_id":"CCMSLIB00017278334","spectrum_index":33672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 213.2451 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.316,"smiles":null,"spectrum_id":"CCMSLIB00017278337","spectrum_index":33673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 328.1154 Da; putative annotation: N/A; putative formula: C15H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.264,"smiles":null,"spectrum_id":"CCMSLIB00017278340","spectrum_index":33674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 118.0453 Da; putative annotation: N/A; putative formula: C5H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.132,"smiles":null,"spectrum_id":"CCMSLIB00017278343","spectrum_index":33675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 60.0207 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.122,"smiles":null,"spectrum_id":"CCMSLIB00017278345","spectrum_index":33676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-[3-(Benzyloxy)benzyl]-1H-tetrazole-1,5-diamine (delta mass: 114.04 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.186,"smiles":null,"spectrum_id":"CCMSLIB00017278348","spectrum_index":33677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 37.9242 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.0,"smiles":null,"spectrum_id":"CCMSLIB00017278350","spectrum_index":33678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piracetam (delta mass: 51.0385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.12,"smiles":null,"spectrum_id":"CCMSLIB00017278353","spectrum_index":33679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Aminobutyl)urea (delta mass: 174.0569 Da; putative annotation: N/A; putative formula: C5H10N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.17,"smiles":null,"spectrum_id":"CCMSLIB00017278356","spectrum_index":33680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 238.2306 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.4,"smiles":null,"spectrum_id":"CCMSLIB00017278359","spectrum_index":33681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 57.0176 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.093,"smiles":null,"spectrum_id":"CCMSLIB00017278361","spectrum_index":33682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 59.9409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.084,"smiles":null,"spectrum_id":"CCMSLIB00017278363","spectrum_index":33683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 141.0767 Da; putative annotation: N/A; putative formula: C3H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.216,"smiles":null,"spectrum_id":"CCMSLIB00017278366","spectrum_index":33684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 163.028 Da; putative annotation: N/A; putative formula: C9HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.13,"smiles":null,"spectrum_id":"CCMSLIB00017278369","spectrum_index":33685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 341.1327 Da; putative annotation: N/A; putative formula: C15H24N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.266,"smiles":null,"spectrum_id":"CCMSLIB00017278372","spectrum_index":33686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 231.0939 Da; putative annotation: N/A; putative formula: C3H9N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.133,"smiles":null,"spectrum_id":"CCMSLIB00017278375","spectrum_index":33687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 172.0476 Da; putative annotation: N/A; putative formula: C8H13PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.134,"smiles":null,"spectrum_id":"CCMSLIB00017278378","spectrum_index":33688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 13.0054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017278379","spectrum_index":33689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycyl-L-4-hydroxyproline (delta mass: 57.0212 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.108,"smiles":null,"spectrum_id":"CCMSLIB00017278382","spectrum_index":33690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 238.2307 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.265,"smiles":null,"spectrum_id":"CCMSLIB00017278385","spectrum_index":33691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 486.2703 Da; putative annotation: N/A; putative formula: C23H34N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.357,"smiles":null,"spectrum_id":"CCMSLIB00017278387","spectrum_index":33692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 54.0433 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.141,"smiles":null,"spectrum_id":"CCMSLIB00017278389","spectrum_index":33693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 9.9337 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.009,"smiles":null,"spectrum_id":"CCMSLIB00017278392","spectrum_index":33694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 12.1703 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.257,"smiles":null,"spectrum_id":"CCMSLIB00017278395","spectrum_index":33695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 89.079 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.184,"smiles":null,"spectrum_id":"CCMSLIB00017278397","spectrum_index":33696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 331.6248 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.711,"smiles":null,"spectrum_id":"CCMSLIB00017278399","spectrum_index":33697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 346.1576 Da; putative annotation: N/A; putative formula: C16H22N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.244,"smiles":null,"spectrum_id":"CCMSLIB00017278402","spectrum_index":33698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE CollisionEnergy:102040 (delta mass: 52.0676 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.164,"smiles":null,"spectrum_id":"CCMSLIB00017278405","spectrum_index":33699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 26.8632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.94,"smiles":null,"spectrum_id":"CCMSLIB00017278407","spectrum_index":33700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 55.9392 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.031,"smiles":null,"spectrum_id":"CCMSLIB00017278410","spectrum_index":33701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 55.055 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.122,"smiles":null,"spectrum_id":"CCMSLIB00017278412","spectrum_index":33702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 704.4251 Da; putative annotation: N/A; putative formula: C31H60N8O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.511,"smiles":null,"spectrum_id":"CCMSLIB00017278415","spectrum_index":33703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 43.0675 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.164,"smiles":null,"spectrum_id":"CCMSLIB00017278418","spectrum_index":33704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Methoxybenzyl)(2-nitrophenyl)methanamine (delta mass: 74.048 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.171,"smiles":null,"spectrum_id":"CCMSLIB00017278420","spectrum_index":33705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic WB (delta mass: 46.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.183,"smiles":null,"spectrum_id":"CCMSLIB00017278423","spectrum_index":33706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 134.0719 Da; putative annotation: N/A; putative formula: C3H11N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.237,"smiles":null,"spectrum_id":"CCMSLIB00017278425","spectrum_index":33707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 105.066 Da; putative annotation: N/A; putative formula: CH7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017278428","spectrum_index":33708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 107.0373 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.108,"smiles":null,"spectrum_id":"CCMSLIB00017278431","spectrum_index":33709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 69.9918 Da; putative annotation: N/A; putative formula: H-2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.104,"smiles":null,"spectrum_id":"CCMSLIB00017278433","spectrum_index":33710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 112.016 Da; putative annotation: N/A; putative formula: C5H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.092,"smiles":null,"spectrum_id":"CCMSLIB00017278436","spectrum_index":33711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Atropine (delta mass: 32.0044 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.18,"smiles":null,"spectrum_id":"CCMSLIB00017278438","spectrum_index":33712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 65.0264 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017278441","spectrum_index":33713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 147.0649 Da; putative annotation: N/A; putative formula: C4H9N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.16,"smiles":null,"spectrum_id":"CCMSLIB00017278444","spectrum_index":33714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 87.0311 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.091,"smiles":null,"spectrum_id":"CCMSLIB00017278445","spectrum_index":33715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Felbinac (delta mass: 43.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.117,"smiles":null,"spectrum_id":"CCMSLIB00017278448","spectrum_index":33716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 635.4388 Da; putative annotation: N/A; putative formula: C41H57N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.51,"smiles":null,"spectrum_id":"CCMSLIB00017278451","spectrum_index":33717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 428.2924 Da; putative annotation: N/A; putative formula: C27H40O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.421,"smiles":null,"spectrum_id":"CCMSLIB00017278454","spectrum_index":33718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 1076.5737 Da; putative annotation: N/A; putative formula: C62H76N8O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1231.64,"smiles":null,"spectrum_id":"CCMSLIB00017278455","spectrum_index":33719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 285.1788 Da; putative annotation: N/A; putative formula: C12H23N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.249,"smiles":null,"spectrum_id":"CCMSLIB00017278458","spectrum_index":33720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine methyl ester (delta mass: 182.1664 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.24,"smiles":null,"spectrum_id":"CCMSLIB00017278461","spectrum_index":33721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 321.9996 Da; putative annotation: N/A; putative formula: C13H11N2O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.06,"smiles":null,"spectrum_id":"CCMSLIB00017278464","spectrum_index":33722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 774.243 Da; putative annotation: N/A; putative formula: C30H46O23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":937.303,"smiles":null,"spectrum_id":"CCMSLIB00017278467","spectrum_index":33723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 66.0085 Da; putative annotation: N/A; putative formula: H-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.185,"smiles":null,"spectrum_id":"CCMSLIB00017278470","spectrum_index":33724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 274.1057 Da; putative annotation: N/A; putative formula: C7H15N8O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.255,"smiles":null,"spectrum_id":"CCMSLIB00017278472","spectrum_index":33725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 54.0258 Da; putative annotation: N/A; putative formula: C2H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.076,"smiles":null,"spectrum_id":"CCMSLIB00017278475","spectrum_index":33726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 105.0785 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.139,"smiles":null,"spectrum_id":"CCMSLIB00017278477","spectrum_index":33727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 115.0264 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.128,"smiles":null,"spectrum_id":"CCMSLIB00017278480","spectrum_index":33728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 30.051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017278483","spectrum_index":33729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.113,"smiles":null,"spectrum_id":"CCMSLIB00017278484","spectrum_index":33730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 517.2894 Da; putative annotation: N/A; putative formula: C36H40NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.36,"smiles":null,"spectrum_id":"CCMSLIB00017278487","spectrum_index":33731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 457.1808 Da; putative annotation: N/A; putative formula: C18H27N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.267,"smiles":null,"spectrum_id":"CCMSLIB00017278490","spectrum_index":33732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 139.0419 Da; putative annotation: N/A; putative formula: C10H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.118,"smiles":null,"spectrum_id":"CCMSLIB00017278493","spectrum_index":33733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 39.0073 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.103,"smiles":null,"spectrum_id":"CCMSLIB00017278495","spectrum_index":33734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 168.123 Da; putative annotation: N/A; putative formula: C5H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.245,"smiles":null,"spectrum_id":"CCMSLIB00017278498","spectrum_index":33735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylbutanoic acid (delta mass: 28.9923 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.079,"smiles":null,"spectrum_id":"CCMSLIB00017278502","spectrum_index":33736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 322.2092 Da; putative annotation: N/A; putative formula: C18H32N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.28,"smiles":null,"spectrum_id":"CCMSLIB00017278503","spectrum_index":33737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 85.0165 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.044,"smiles":null,"spectrum_id":"CCMSLIB00017278506","spectrum_index":33738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 156.1147 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.19,"smiles":null,"spectrum_id":"CCMSLIB00017278509","spectrum_index":33739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 436.1661 Da; putative annotation: N/A; putative formula: C23H25N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.252,"smiles":null,"spectrum_id":"CCMSLIB00017278510","spectrum_index":33740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 230.0428 Da; putative annotation: N/A; putative formula: C9H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.176,"smiles":null,"spectrum_id":"CCMSLIB00017278513","spectrum_index":33741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 505.2745 Da; putative annotation: N/A; putative formula: C31H40NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.345,"smiles":null,"spectrum_id":"CCMSLIB00017278516","spectrum_index":33742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 103.0271 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.049,"smiles":null,"spectrum_id":"CCMSLIB00017278519","spectrum_index":33743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 190.1358 Da; putative annotation: N/A; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.196,"smiles":null,"spectrum_id":"CCMSLIB00017278520","spectrum_index":33744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.108,"smiles":null,"spectrum_id":"CCMSLIB00017278523","spectrum_index":33745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 71.0362 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.096,"smiles":null,"spectrum_id":"CCMSLIB00017278526","spectrum_index":33746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 164.0784 Da; putative annotation: N/A; putative formula: C9H12N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.18,"smiles":null,"spectrum_id":"CCMSLIB00017278529","spectrum_index":33747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 642.4965 Da; putative annotation: N/A; putative formula: C36H58N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":826.593,"smiles":null,"spectrum_id":"CCMSLIB00017278531","spectrum_index":33748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 92.0471 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.216,"smiles":null,"spectrum_id":"CCMSLIB00017278533","spectrum_index":33749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 27.9955 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.124,"smiles":null,"spectrum_id":"CCMSLIB00017278536","spectrum_index":33750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 63.02 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.138,"smiles":null,"spectrum_id":"CCMSLIB00017278538","spectrum_index":33751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4-pyridinecarboxylic acid (delta mass: 30.9944 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.029,"smiles":null,"spectrum_id":"CCMSLIB00017278541","spectrum_index":33752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 172.0847 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.165,"smiles":null,"spectrum_id":"CCMSLIB00017278544","spectrum_index":33753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 55.0421 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.128,"smiles":null,"spectrum_id":"CCMSLIB00017278547","spectrum_index":33754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLPUTRESCINE (delta mass: 98.048 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.166,"smiles":null,"spectrum_id":"CCMSLIB00017278549","spectrum_index":33755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N2-Methyl-L-arginine (delta mass: 69.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.187,"smiles":null,"spectrum_id":"CCMSLIB00017278552","spectrum_index":33756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Quinolinediol; AIF; CE10; CorrDec (delta mass: 158.1292 Da; putative annotation: N/A; putative formula: C5H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.184,"smiles":null,"spectrum_id":"CCMSLIB00017278555","spectrum_index":33757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 122.1522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.332,"smiles":null,"spectrum_id":"CCMSLIB00017278557","spectrum_index":33758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 45.2032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.336,"smiles":null,"spectrum_id":"CCMSLIB00017278559","spectrum_index":33759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-5-pentyl- (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.222,"smiles":null,"spectrum_id":"CCMSLIB00017278562","spectrum_index":33760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 94.0422 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.285,"smiles":null,"spectrum_id":"CCMSLIB00017278565","spectrum_index":33761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 144.0398 Da; putative annotation: N/A; putative formula: C10H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.153,"smiles":null,"spectrum_id":"CCMSLIB00017278568","spectrum_index":33762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 51.9949 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.081,"smiles":null,"spectrum_id":"CCMSLIB00017278571","spectrum_index":33763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01042 Hexahydrocurcumin (delta mass: 174.0678 Da; putative annotation: N/A; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.248,"smiles":null,"spectrum_id":"CCMSLIB00017278574","spectrum_index":33764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 381.2727 Da; putative annotation: N/A; putative formula: C19H35N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.333,"smiles":null,"spectrum_id":"CCMSLIB00017278575","spectrum_index":33765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 71.037 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.134,"smiles":null,"spectrum_id":"CCMSLIB00017278578","spectrum_index":33766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 14.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.132,"smiles":null,"spectrum_id":"CCMSLIB00017278581","spectrum_index":33767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1190.5705 Da; putative annotation: N/A; putative formula: C62H86N4O17S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1353.63,"smiles":null,"spectrum_id":"CCMSLIB00017278583","spectrum_index":33768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 911.4884 Da; putative annotation: N/A; putative formula: C60H61N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.56,"smiles":null,"spectrum_id":"CCMSLIB00017278585","spectrum_index":33769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180232-02!7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one [IIN-based: Match] (delta mass: 56.0256 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.18,"smiles":null,"spectrum_id":"CCMSLIB00017278588","spectrum_index":33770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 87.0581 Da; putative annotation: N/A; putative formula: C4H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.165,"smiles":null,"spectrum_id":"CCMSLIB00017278591","spectrum_index":33771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 35.0158 Da; putative annotation: N/A; putative formula: C3HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.082,"smiles":null,"spectrum_id":"CCMSLIB00017278594","spectrum_index":33772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 102.0318 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.155,"smiles":null,"spectrum_id":"CCMSLIB00017278597","spectrum_index":33773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 269.1494 Da; putative annotation: N/A; putative formula: C11H19N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.204,"smiles":null,"spectrum_id":"CCMSLIB00017278598","spectrum_index":33774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 72.0234 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.11,"smiles":null,"spectrum_id":"CCMSLIB00017278601","spectrum_index":33775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine (delta mass: 518.3508 Da; putative annotation: N/A; putative formula: C33H46N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.5,"smiles":null,"spectrum_id":"CCMSLIB00017278604","spectrum_index":33776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 268.1789 Da; putative annotation: N/A; putative formula: C14H24N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.281,"smiles":null,"spectrum_id":"CCMSLIB00017278607","spectrum_index":33777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 22.9107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.986,"smiles":null,"spectrum_id":"CCMSLIB00017278609","spectrum_index":33778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 104.0473 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.165,"smiles":null,"spectrum_id":"CCMSLIB00017278611","spectrum_index":33779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOSE (delta mass: 226.1665 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.29,"smiles":null,"spectrum_id":"CCMSLIB00017278614","spectrum_index":33780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 179.0812 Da; putative annotation: N/A; putative formula: C7H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.147,"smiles":null,"spectrum_id":"CCMSLIB00017278617","spectrum_index":33781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 34.9318 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.039,"smiles":null,"spectrum_id":"CCMSLIB00017278618","spectrum_index":33782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 99.0321 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.134,"smiles":null,"spectrum_id":"CCMSLIB00017278623","spectrum_index":33783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 374.2832 Da; putative annotation: N/A; putative formula: C25H34N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.364,"smiles":null,"spectrum_id":"CCMSLIB00017278625","spectrum_index":33784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 284.1415 Da; putative annotation: N/A; putative formula: C18H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.238,"smiles":null,"spectrum_id":"CCMSLIB00017278627","spectrum_index":33785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 125.1266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.207,"smiles":null,"spectrum_id":"CCMSLIB00017278630","spectrum_index":33786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-indole-3-carbaldehyde (delta mass: 39.0354 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.111,"smiles":null,"spectrum_id":"CCMSLIB00017278633","spectrum_index":33787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 259.2509 Da; putative annotation: N/A; putative formula: C11H29N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.441,"smiles":null,"spectrum_id":"CCMSLIB00017278634","spectrum_index":33788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 575.5071 Da; putative annotation: N/A; putative formula: C40H65NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.578,"smiles":null,"spectrum_id":"CCMSLIB00017278637","spectrum_index":33789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol CollisionEnergy:102040\"\" (delta mass: 14.0522 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.248,"smiles":null,"spectrum_id":"CCMSLIB00017278640","spectrum_index":33790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 178.0069 Da; putative annotation: N/A; putative formula: C5H2N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.055,"smiles":null,"spectrum_id":"CCMSLIB00017278643","spectrum_index":33791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 74.0384 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.192,"smiles":null,"spectrum_id":"CCMSLIB00017278644","spectrum_index":33792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 23.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.155,"smiles":null,"spectrum_id":"CCMSLIB00017278647","spectrum_index":33793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 115.0272 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.161,"smiles":null,"spectrum_id":"CCMSLIB00017278650","spectrum_index":33794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 172.089 Da; putative annotation: N/A; putative formula: C12H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.16,"smiles":null,"spectrum_id":"CCMSLIB00017278653","spectrum_index":33795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 112.0158 Da; putative annotation: N/A; putative formula: C5H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.213,"smiles":null,"spectrum_id":"CCMSLIB00017278654","spectrum_index":33796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 554.2372 Da; putative annotation: N/A; putative formula: C28H42O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.297,"smiles":null,"spectrum_id":"CCMSLIB00017278657","spectrum_index":33797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 86.0771 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.216,"smiles":null,"spectrum_id":"CCMSLIB00017278660","spectrum_index":33798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 236.2139 Da; putative annotation: N/A; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.322,"smiles":null,"spectrum_id":"CCMSLIB00017278663","spectrum_index":33799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 174.0621 Da; putative annotation: N/A; putative formula: C10H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.097,"smiles":null,"spectrum_id":"CCMSLIB00017278664","spectrum_index":33800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 79.9664 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.005,"smiles":null,"spectrum_id":"CCMSLIB00017278667","spectrum_index":33801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 54.9715 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.988,"smiles":null,"spectrum_id":"CCMSLIB00017278670","spectrum_index":33802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 16.0428 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.14,"smiles":null,"spectrum_id":"CCMSLIB00017278673","spectrum_index":33803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 17.0808 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.276,"smiles":null,"spectrum_id":"CCMSLIB00017278675","spectrum_index":33804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cytosine CollisionEnergy:102040 (delta mass: 44.0495 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.1,"smiles":null,"spectrum_id":"CCMSLIB00017278679","spectrum_index":33805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 136.1253 Da; putative annotation: Geraniol; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.258,"smiles":null,"spectrum_id":"CCMSLIB00017278681","spectrum_index":33806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 141.0786 Da; putative annotation: N-Acetyl-DL-valine; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.175,"smiles":null,"spectrum_id":"CCMSLIB00017278683","spectrum_index":33807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 288.0633 Da; putative annotation: (-)-Gallocatechin; putative formula: C15H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.102,"smiles":null,"spectrum_id":"CCMSLIB00017278686","spectrum_index":33808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 113.0838 Da; putative annotation: Massbank:PR311150 Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.207,"smiles":null,"spectrum_id":"CCMSLIB00017278689","spectrum_index":33809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Phe from NIST14 (delta mass: 165.0793 Da; putative annotation: DL-Normetanephrine; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.198,"smiles":null,"spectrum_id":"CCMSLIB00017278692","spectrum_index":33810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 99.0679 Da; putative annotation: 4-Aminopentanoic acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.128,"smiles":null,"spectrum_id":"CCMSLIB00017278695","spectrum_index":33811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3,5-Dimethoxy-4-hydroxycinnamaldehyde (delta mass: 370.1305 Da; putative annotation: Verbenalin; putative formula: C17H22O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.211,"smiles":null,"spectrum_id":"CCMSLIB00017278698","spectrum_index":33812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 120.0578 Da; putative annotation: 2,3-Dimethylhydroquinone; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017278701","spectrum_index":33813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Allyl-2,6-dimethoxyphenol (delta mass: 194.0943 Da; putative annotation: (2E,4E)-3,5,7-Trimethylocta-2,4-dienedioic acid; putative formula: C11H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.196,"smiles":null,"spectrum_id":"CCMSLIB00017278704","spectrum_index":33814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 356.2206 Da; putative annotation: 4-(4-Hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl)butan-2-yl .beta.-D-glucopyranoside; putative formula: C19H32O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.328,"smiles":null,"spectrum_id":"CCMSLIB00017278706","spectrum_index":33815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 224.0831 Da; putative annotation: Coelonin; putative formula: C15H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.159,"smiles":null,"spectrum_id":"CCMSLIB00017278709","spectrum_index":33816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 119.0734 Da; putative annotation: 2-Methoxy-3-methylaniline; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.15,"smiles":null,"spectrum_id":"CCMSLIB00017278712","spectrum_index":33817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yohimbic acid (delta mass: 17.024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.21,"smiles":null,"spectrum_id":"CCMSLIB00017278714","spectrum_index":33818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE10; MS2Dec (delta mass: 283.0688 Da; putative annotation: N/A; putative formula: C12H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.15,"smiles":null,"spectrum_id":"CCMSLIB00017278717","spectrum_index":33819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 147.0898 Da; putative annotation: N/A; putative formula: C6H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017278720","spectrum_index":33820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 80.0624 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017278722","spectrum_index":33821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 113.0812 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.21,"smiles":null,"spectrum_id":"CCMSLIB00017278725","spectrum_index":33822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 16.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017278728","spectrum_index":33823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 310.0883 Da; putative annotation: N/A; putative formula: C16H22S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.169,"smiles":null,"spectrum_id":"CCMSLIB00017278731","spectrum_index":33824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 66.9924 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.055,"smiles":null,"spectrum_id":"CCMSLIB00017278733","spectrum_index":33825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 32.0243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.1,"smiles":null,"spectrum_id":"CCMSLIB00017278736","spectrum_index":33826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Ala (delta mass: 225.0749 Da; putative annotation: N/A; putative formula: C9H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.204,"smiles":null,"spectrum_id":"CCMSLIB00017278739","spectrum_index":33827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carmoxirole (delta mass: 56.0103 Da; putative annotation: N/A; putative formula: C3H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.217,"smiles":null,"spectrum_id":"CCMSLIB00017278741","spectrum_index":33828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zilpaterol (delta mass: 217.1221 Da; putative annotation: N/A; putative formula: C12H15N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.277,"smiles":null,"spectrum_id":"CCMSLIB00017278744","spectrum_index":33829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 857.5136 Da; putative annotation: N/A; putative formula: C44H75NO15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1050.58,"smiles":null,"spectrum_id":"CCMSLIB00017278747","spectrum_index":33830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 67.9356 Da; putative annotation: N/A; putative formula: C2H-2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.007,"smiles":null,"spectrum_id":"CCMSLIB00017278750","spectrum_index":33831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-1H-indole-2-carbaldehyde (delta mass: 27.0192 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.99,"smiles":null,"spectrum_id":"CCMSLIB00017278752","spectrum_index":33832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 112.0162 Da; putative annotation: N/A; putative formula: C5H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.055,"smiles":null,"spectrum_id":"CCMSLIB00017278754","spectrum_index":33833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mycophenolic acid IV (delta mass: 330.1833 Da; putative annotation: N/A; putative formula: C20H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.379,"smiles":null,"spectrum_id":"CCMSLIB00017278757","spectrum_index":33834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 90.0228 Da; putative annotation: N/A; putative formula: C3H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.083,"smiles":null,"spectrum_id":"CCMSLIB00017278760","spectrum_index":33835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 188.1626 Da; putative annotation: N/A; putative formula: C8H20N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.286,"smiles":null,"spectrum_id":"CCMSLIB00017278763","spectrum_index":33836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 216.0985 Da; putative annotation: N/A; putative formula: C7H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.169,"smiles":null,"spectrum_id":"CCMSLIB00017278766","spectrum_index":33837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 293.163 Da; putative annotation: N/A; putative formula: C16H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.234,"smiles":null,"spectrum_id":"CCMSLIB00017278767","spectrum_index":33838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 45.0198 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.07,"smiles":null,"spectrum_id":"CCMSLIB00017278770","spectrum_index":33839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 15.0184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.099,"smiles":null,"spectrum_id":"CCMSLIB00017278773","spectrum_index":33840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 133.0931 Da; putative annotation: N/A; putative formula: C3H11N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.273,"smiles":null,"spectrum_id":"CCMSLIB00017278776","spectrum_index":33841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 61.9458 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.011,"smiles":null,"spectrum_id":"CCMSLIB00017278778","spectrum_index":33842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 151.0638 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.161,"smiles":null,"spectrum_id":"CCMSLIB00017278781","spectrum_index":33843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (delta mass: 81.0042 Da; putative annotation: N/A; putative formula: C4H3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.148,"smiles":null,"spectrum_id":"CCMSLIB00017278784","spectrum_index":33844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 368.111 Da; putative annotation: N/A; putative formula: C20H21N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.202,"smiles":null,"spectrum_id":"CCMSLIB00017278787","spectrum_index":33845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxo-1,2-dihydro-quinoline-3,4-dicarboxylic acid (delta mass: 86.1453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.185,"smiles":null,"spectrum_id":"CCMSLIB00017278790","spectrum_index":33846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 286.1675 Da; putative annotation: N/A; putative formula: C11H23N6OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.293,"smiles":null,"spectrum_id":"CCMSLIB00017278792","spectrum_index":33847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 70.0459 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.185,"smiles":null,"spectrum_id":"CCMSLIB00017278795","spectrum_index":33848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA000903 PHIP|1-methyl-6-phenylimidazo[4,5-b]pyridin-2-amine (delta mass: 33.0375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.151,"smiles":null,"spectrum_id":"CCMSLIB00017278798","spectrum_index":33849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 667.3933 Da; putative annotation: N/A; putative formula: C35H57NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":862.452,"smiles":null,"spectrum_id":"CCMSLIB00017278801","spectrum_index":33850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 78.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.207,"smiles":null,"spectrum_id":"CCMSLIB00017278804","spectrum_index":33851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 97.9682 Da; putative annotation: N/A; putative formula: CH-2N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.039,"smiles":null,"spectrum_id":"CCMSLIB00017278805","spectrum_index":33852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 224.1198 Da; putative annotation: N/A; putative formula: C16H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.19,"smiles":null,"spectrum_id":"CCMSLIB00017278808","spectrum_index":33853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 120.0462 Da; putative annotation: N/A; putative formula: C2H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.118,"smiles":null,"spectrum_id":"CCMSLIB00017278811","spectrum_index":33854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 210.1015 Da; putative annotation: N/A; putative formula: C11H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.214,"smiles":null,"spectrum_id":"CCMSLIB00017278813","spectrum_index":33855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 11.0223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.151,"smiles":null,"spectrum_id":"CCMSLIB00017278815","spectrum_index":33856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 334.1215 Da; putative annotation: N/A; putative formula: C22H22O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.218,"smiles":null,"spectrum_id":"CCMSLIB00017278818","spectrum_index":33857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 106.078 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017278821","spectrum_index":33858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 81.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.222,"smiles":null,"spectrum_id":"CCMSLIB00017278823","spectrum_index":33859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 469.4492 Da; putative annotation: N/A; putative formula: C29H59NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.509,"smiles":null,"spectrum_id":"CCMSLIB00017278826","spectrum_index":33860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 12.033 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017278829","spectrum_index":33861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 146.0683 Da; putative annotation: N/A; putative formula: C7H15O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.14,"smiles":null,"spectrum_id":"CCMSLIB00017278832","spectrum_index":33862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.038,"smiles":null,"spectrum_id":"CCMSLIB00017278834","spectrum_index":33863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 119.0367 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.074,"smiles":null,"spectrum_id":"CCMSLIB00017278837","spectrum_index":33864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 42.0508 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.159,"smiles":null,"spectrum_id":"CCMSLIB00017278840","spectrum_index":33865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 157.038 Da; putative annotation: N/A; putative formula: C7H11NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.161,"smiles":null,"spectrum_id":"CCMSLIB00017278842","spectrum_index":33866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 95.0733 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.228,"smiles":null,"spectrum_id":"CCMSLIB00017278845","spectrum_index":33867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 97.0328 Da; putative annotation: N/A; putative formula: C8H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.109,"smiles":null,"spectrum_id":"CCMSLIB00017278847","spectrum_index":33868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 123.0884 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.195,"smiles":null,"spectrum_id":"CCMSLIB00017278850","spectrum_index":33869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 98.0003 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.06,"smiles":null,"spectrum_id":"CCMSLIB00017278853","spectrum_index":33870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ala (delta mass: 111.0321 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.13,"smiles":null,"spectrum_id":"CCMSLIB00017278856","spectrum_index":33871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 36.012 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.198,"smiles":null,"spectrum_id":"CCMSLIB00017278858","spectrum_index":33872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 160.0533 Da; putative annotation: N/A; putative formula: C3H8N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.223,"smiles":null,"spectrum_id":"CCMSLIB00017278860","spectrum_index":33873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 107.0371 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.214,"smiles":null,"spectrum_id":"CCMSLIB00017278863","spectrum_index":33874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[5-[Acetyl(hydroxy)amino]pentylcarbamoyl]-5-[3-[acetyl(hydroxy)amino]propylamino]-3-hydroxy-5-oxopentanoic acid (delta mass: 43.9637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.188,"smiles":null,"spectrum_id":"CCMSLIB00017278866","spectrum_index":33875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 75.0692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.15,"smiles":null,"spectrum_id":"CCMSLIB00017278867","spectrum_index":33876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 98.048 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.134,"smiles":null,"spectrum_id":"CCMSLIB00017278871","spectrum_index":33877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 241.1551 Da; putative annotation: N/A; putative formula: C10H19N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.259,"smiles":null,"spectrum_id":"CCMSLIB00017278873","spectrum_index":33878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 171.126 Da; putative annotation: N/A; putative formula: C9H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.191,"smiles":null,"spectrum_id":"CCMSLIB00017278876","spectrum_index":33879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 254.0997 Da; putative annotation: N/A; putative formula: C6H20N6O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.217,"smiles":null,"spectrum_id":"CCMSLIB00017278879","spectrum_index":33880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 68.9572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.017,"smiles":null,"spectrum_id":"CCMSLIB00017278882","spectrum_index":33881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 31.9884 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.059,"smiles":null,"spectrum_id":"CCMSLIB00017278883","spectrum_index":33882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 76.0521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017278886","spectrum_index":33883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 47.0622 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.159,"smiles":null,"spectrum_id":"CCMSLIB00017278889","spectrum_index":33884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 18.0096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.058,"smiles":null,"spectrum_id":"CCMSLIB00017278892","spectrum_index":33885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 156.0421 Da; putative annotation: N/A; putative formula: C7H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.118,"smiles":null,"spectrum_id":"CCMSLIB00017278895","spectrum_index":33886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 123.1107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.191,"smiles":null,"spectrum_id":"CCMSLIB00017278897","spectrum_index":33887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 62.0509 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.139,"smiles":null,"spectrum_id":"CCMSLIB00017278899","spectrum_index":33888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline CollisionEnergy:102040\"\" (delta mass: 18.0111 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.16,"smiles":null,"spectrum_id":"CCMSLIB00017278902","spectrum_index":33889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 316.2407 Da; putative annotation: N/A; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.364,"smiles":null,"spectrum_id":"CCMSLIB00017278905","spectrum_index":33890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 48.029 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.116,"smiles":null,"spectrum_id":"CCMSLIB00017278907","spectrum_index":33891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 253.9968 Da; putative annotation: N/A; putative formula: C14H9O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.057,"smiles":null,"spectrum_id":"CCMSLIB00017278910","spectrum_index":33892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005923 Tetrahydropapaveroline|1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 18.1167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.24,"smiles":null,"spectrum_id":"CCMSLIB00017278912","spectrum_index":33893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 125.0214 Da; putative annotation: N/A; putative formula: C4H3N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.103,"smiles":null,"spectrum_id":"CCMSLIB00017278915","spectrum_index":33894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 548.2407 Da; putative annotation: N/A; putative formula: C32H36O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1157.51,"smiles":null,"spectrum_id":"CCMSLIB00017278918","spectrum_index":33895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 230.1607 Da; putative annotation: N/A; putative formula: C7H18N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.247,"smiles":null,"spectrum_id":"CCMSLIB00017278919","spectrum_index":33896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 43.9676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.038,"smiles":null,"spectrum_id":"CCMSLIB00017278922","spectrum_index":33897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005843 Cinchonine|(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl)-quinolin-4-ylmethanol (delta mass: 91.1088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.289,"smiles":null,"spectrum_id":"CCMSLIB00017278925","spectrum_index":33898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 451.1498 Da; putative annotation: N/A; putative formula: C23H25N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.21,"smiles":null,"spectrum_id":"CCMSLIB00017278928","spectrum_index":33899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 184.0721 Da; putative annotation: N/A; putative formula: C13H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.174,"smiles":null,"spectrum_id":"CCMSLIB00017278930","spectrum_index":33900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 579.1934 Da; putative annotation: N/A; putative formula: C24H33N7O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.274,"smiles":null,"spectrum_id":"CCMSLIB00017278932","spectrum_index":33901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 392.1319 Da; putative annotation: N/A; putative formula: C16H24O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.192,"smiles":null,"spectrum_id":"CCMSLIB00017278935","spectrum_index":33902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 128.0265 Da; putative annotation: N/A; putative formula: C9H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.181,"smiles":null,"spectrum_id":"CCMSLIB00017278938","spectrum_index":33903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Amino-5,8-difluorospiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)picolinonitrile (delta mass: 165.1064 Da; putative annotation: N/A; putative formula: C10H16NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.249,"smiles":null,"spectrum_id":"CCMSLIB00017278939","spectrum_index":33904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 106.0416 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.154,"smiles":null,"spectrum_id":"CCMSLIB00017278942","spectrum_index":33905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 17.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.13,"smiles":null,"spectrum_id":"CCMSLIB00017278945","spectrum_index":33906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 417.3104 Da; putative annotation: N/A; putative formula: C23H39N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.381,"smiles":null,"spectrum_id":"CCMSLIB00017278947","spectrum_index":33907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Idebenone (delta mass: 27.9993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.216,"smiles":null,"spectrum_id":"CCMSLIB00017278950","spectrum_index":33908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYLTYRAMINE (delta mass: 159.0879 Da; putative annotation: N/A; putative formula: C3H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.195,"smiles":null,"spectrum_id":"CCMSLIB00017278952","spectrum_index":33909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clusiacitran A (delta mass: 82.063 Da; putative annotation: N/A; putative formula: C3H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.238,"smiles":null,"spectrum_id":"CCMSLIB00017278955","spectrum_index":33910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 108.0576 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.17,"smiles":null,"spectrum_id":"CCMSLIB00017278958","spectrum_index":33911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 69.058 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017278960","spectrum_index":33912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 177.0996 Da; putative annotation: N/A; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.17,"smiles":null,"spectrum_id":"CCMSLIB00017278962","spectrum_index":33913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-MANNOSE 6-PHOSPHATE - 20.0 eV (delta mass: 205.9916 Da; putative annotation: N/A; putative formula: C5H7N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.029,"smiles":null,"spectrum_id":"CCMSLIB00017278965","spectrum_index":33914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Diethyl-1,3,4,9-tetrahydro-4-oxo-pyrano[3,4-b]indole-1-acetic acid methyl ester (delta mass: 90.0314 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.186,"smiles":null,"spectrum_id":"CCMSLIB00017278968","spectrum_index":33915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 114.0315 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.097,"smiles":null,"spectrum_id":"CCMSLIB00017278971","spectrum_index":33916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 80.0628 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.123,"smiles":null,"spectrum_id":"CCMSLIB00017278974","spectrum_index":33917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 95.926 Da; putative annotation: N/A; putative formula: HPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.028,"smiles":null,"spectrum_id":"CCMSLIB00017278975","spectrum_index":33918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 330.2198 Da; putative annotation: N/A; putative formula: C21H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.343,"smiles":null,"spectrum_id":"CCMSLIB00017278978","spectrum_index":33919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 479.1794 Da; putative annotation: N/A; putative formula: C26H30N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.25,"smiles":null,"spectrum_id":"CCMSLIB00017278981","spectrum_index":33920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butylthiourea (delta mass: 91.1062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.186,"smiles":null,"spectrum_id":"CCMSLIB00017278984","spectrum_index":33921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 413.1671 Da; putative annotation: N/A; putative formula: C16H19N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.269,"smiles":null,"spectrum_id":"CCMSLIB00017278986","spectrum_index":33922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 314.4348 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.5,"smiles":null,"spectrum_id":"CCMSLIB00017278988","spectrum_index":33923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 77.0739 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.161,"smiles":null,"spectrum_id":"CCMSLIB00017278991","spectrum_index":33924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 55.0421 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.113,"smiles":null,"spectrum_id":"CCMSLIB00017278994","spectrum_index":33925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 562.3398 Da; putative annotation: N/A; putative formula: C28H47N6O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.436,"smiles":null,"spectrum_id":"CCMSLIB00017278997","spectrum_index":33926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 206.0427 Da; putative annotation: N/A; putative formula: C7H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.129,"smiles":null,"spectrum_id":"CCMSLIB00017278999","spectrum_index":33927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methoxycarbonyl)but-3-enoic acid (delta mass: 86.0007 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.05,"smiles":null,"spectrum_id":"CCMSLIB00017279001","spectrum_index":33928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 60.0234 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017279004","spectrum_index":33929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CITRULLINE (delta mass: 115.0256 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.129,"smiles":null,"spectrum_id":"CCMSLIB00017279007","spectrum_index":33930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 78.0818 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.324,"smiles":null,"spectrum_id":"CCMSLIB00017279009","spectrum_index":33931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 82.0784 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.18,"smiles":null,"spectrum_id":"CCMSLIB00017279011","spectrum_index":33932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 142.2431 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.34,"smiles":null,"spectrum_id":"CCMSLIB00017279014","spectrum_index":33933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 128.0325 Da; putative annotation: N/A; putative formula: C3H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.197,"smiles":null,"spectrum_id":"CCMSLIB00017279017","spectrum_index":33934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3R)-2-(((S)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(1-benzylpiperidin-4-yl)-3-methylpentanamide (delta mass: 33.0231 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.403,"smiles":null,"spectrum_id":"CCMSLIB00017279020","spectrum_index":33935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005843 Cinchonine|(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl)-quinolin-4-ylmethanol (delta mass: 327.36 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.541,"smiles":null,"spectrum_id":"CCMSLIB00017279021","spectrum_index":33936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 193.0846 Da; putative annotation: N/A; putative formula: C9H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.165,"smiles":null,"spectrum_id":"CCMSLIB00017279024","spectrum_index":33937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 708.412 Da; putative annotation: N/A; putative formula: C56H52O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1051.54,"smiles":null,"spectrum_id":"CCMSLIB00017279027","spectrum_index":33938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 51.9947 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017279030","spectrum_index":33939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Longicaulenone (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.19,"smiles":null,"spectrum_id":"CCMSLIB00017279031","spectrum_index":33940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(4-Fluorophenyl)-1H-indole (delta mass: 17.0326 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.12,"smiles":null,"spectrum_id":"CCMSLIB00017279034","spectrum_index":33941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 27.9954 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.149,"smiles":null,"spectrum_id":"CCMSLIB00017279037","spectrum_index":33942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutaecarpine (delta mass: 85.124 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.237,"smiles":null,"spectrum_id":"CCMSLIB00017279040","spectrum_index":33943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 42.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.211,"smiles":null,"spectrum_id":"CCMSLIB00017279041","spectrum_index":33944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 41.063 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.113,"smiles":null,"spectrum_id":"CCMSLIB00017279044","spectrum_index":33945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 95.0378 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017279047","spectrum_index":33946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 456.2488 Da; putative annotation: N/A; putative formula: C20H41O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.309,"smiles":null,"spectrum_id":"CCMSLIB00017279048","spectrum_index":33947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 168.2642 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.413,"smiles":null,"spectrum_id":"CCMSLIB00017279051","spectrum_index":33948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 83.0404 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.174,"smiles":null,"spectrum_id":"CCMSLIB00017279054","spectrum_index":33949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 139.0644 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.156,"smiles":null,"spectrum_id":"CCMSLIB00017279057","spectrum_index":33950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 163.031 Da; putative annotation: N/A; putative formula: C5H11NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.185,"smiles":null,"spectrum_id":"CCMSLIB00017279058","spectrum_index":33951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 15.9975 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.137,"smiles":null,"spectrum_id":"CCMSLIB00017279061","spectrum_index":33952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 176.0685 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.176,"smiles":null,"spectrum_id":"CCMSLIB00017279064","spectrum_index":33953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 27.0762 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.163,"smiles":null,"spectrum_id":"CCMSLIB00017279066","spectrum_index":33954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 24.0363 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.096,"smiles":null,"spectrum_id":"CCMSLIB00017279069","spectrum_index":33955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 81.1026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.207,"smiles":null,"spectrum_id":"CCMSLIB00017279071","spectrum_index":33956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 311.101 Da; putative annotation: N/A; putative formula: C17H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.182,"smiles":null,"spectrum_id":"CCMSLIB00017279074","spectrum_index":33957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 147.076 Da; putative annotation: N/A; putative formula: C3H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.215,"smiles":null,"spectrum_id":"CCMSLIB00017279077","spectrum_index":33958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 32.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.123,"smiles":null,"spectrum_id":"CCMSLIB00017279079","spectrum_index":33959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-HYDANTOIN (delta mass: 59.009 Da; putative annotation: N/A; putative formula: HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.059,"smiles":null,"spectrum_id":"CCMSLIB00017279081","spectrum_index":33960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385672-01!(E)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)hept-4-en-3-one (delta mass: 106.0837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.227,"smiles":null,"spectrum_id":"CCMSLIB00017279084","spectrum_index":33961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 193.0589 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.171,"smiles":null,"spectrum_id":"CCMSLIB00017279087","spectrum_index":33962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 235.2385 Da; putative annotation: N/A; putative formula: C15H29N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.33,"smiles":null,"spectrum_id":"CCMSLIB00017279089","spectrum_index":33963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 181.1367 Da; putative annotation: N/A; putative formula: C11H20NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.316,"smiles":null,"spectrum_id":"CCMSLIB00017279092","spectrum_index":33964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 44.0536 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.129,"smiles":null,"spectrum_id":"CCMSLIB00017279094","spectrum_index":33965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.149,"smiles":null,"spectrum_id":"CCMSLIB00017279097","spectrum_index":33966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 343.1637 Da; putative annotation: N/A; putative formula: C19H26N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.224,"smiles":null,"spectrum_id":"CCMSLIB00017279100","spectrum_index":33967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 103.9753 Da; putative annotation: N/A; putative formula: C3H4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.109,"smiles":null,"spectrum_id":"CCMSLIB00017279102","spectrum_index":33968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 311.1011 Da; putative annotation: N/A; putative formula: C7H17N7O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.172,"smiles":null,"spectrum_id":"CCMSLIB00017279105","spectrum_index":33969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 131.0676 Da; putative annotation: N/A; putative formula: C4H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.164,"smiles":null,"spectrum_id":"CCMSLIB00017279108","spectrum_index":33970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 44.0456 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.117,"smiles":null,"spectrum_id":"CCMSLIB00017279111","spectrum_index":33971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 103.9896 Da; putative annotation: N/A; putative formula: C6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.102,"smiles":null,"spectrum_id":"CCMSLIB00017279114","spectrum_index":33972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 17.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.143,"smiles":null,"spectrum_id":"CCMSLIB00017279116","spectrum_index":33973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 145.1088 Da; putative annotation: N/A; putative formula: C3H11N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.148,"smiles":null,"spectrum_id":"CCMSLIB00017279119","spectrum_index":33974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 96.0671 Da; putative annotation: N/A; putative formula: C5H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.2,"smiles":null,"spectrum_id":"CCMSLIB00017279122","spectrum_index":33975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 99.0683 Da; putative annotation: DL-Norvaline; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.16,"smiles":null,"spectrum_id":"CCMSLIB00017279124","spectrum_index":33976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl] 3,4,5-trihydroxybenzoate (delta mass: 146.037 Da; putative annotation: 3-Coumaric acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.155,"smiles":null,"spectrum_id":"CCMSLIB00017279127","spectrum_index":33977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 101.0483 Da; putative annotation: N-Methyl-L-serine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.135,"smiles":null,"spectrum_id":"CCMSLIB00017279130","spectrum_index":33978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lauryldiethanolamine (delta mass: 87.0675 Da; putative annotation: DIETHANOLAMINE; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.342,"smiles":null,"spectrum_id":"CCMSLIB00017279132","spectrum_index":33979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 113.0842 Da; putative annotation: L-Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017279135","spectrum_index":33980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 158.0188 Da; putative annotation: Vitamin C; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.079,"smiles":null,"spectrum_id":"CCMSLIB00017279138","spectrum_index":33981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 136.0524 Da; putative annotation: 2-Hydroxy-3-methoxybenzenemethanol; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017279140","spectrum_index":33982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 156.0905 Da; putative annotation: N-epsilon-Formyl-L-lysine; putative formula: C7H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.162,"smiles":null,"spectrum_id":"CCMSLIB00017279143","spectrum_index":33983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510502 Tyramine|4-(2-aminoethyl)phenol (delta mass: 126.08 Da; putative annotation: 4-Aminopiperidine-4-carboxylic acid; putative formula: C6H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.171,"smiles":null,"spectrum_id":"CCMSLIB00017279146","spectrum_index":33984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 165.0791 Da; putative annotation: (-)-Epinephrine; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.16,"smiles":null,"spectrum_id":"CCMSLIB00017279147","spectrum_index":33985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 206.105 Da; putative annotation: Massbank:EQ267007 Atenolol-desisopropyl|4-(3-Amino-2-hydroxypropoxy)phenylacetamide; putative formula: C11H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.17,"smiles":null,"spectrum_id":"CCMSLIB00017279150","spectrum_index":33986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 283.287 Da; putative annotation: D-erythro-Sphinganine; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.358,"smiles":null,"spectrum_id":"CCMSLIB00017279152","spectrum_index":33987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 288.0842 Da; putative annotation: 2-(2-Oxo-2-(quinolin-3-ylamino)ethyl)benzoic acid; putative formula: C18H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017279155","spectrum_index":33988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lauryldiethanolamine (delta mass: 38.0523 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.326,"smiles":null,"spectrum_id":"CCMSLIB00017279157","spectrum_index":33989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 114.0902 Da; putative annotation: N/A; putative formula: C4H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.187,"smiles":null,"spectrum_id":"CCMSLIB00017279159","spectrum_index":33990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethylene glycol (delta mass: 56.0631 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.133,"smiles":null,"spectrum_id":"CCMSLIB00017279162","spectrum_index":33991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 424.2552 Da; putative annotation: N/A; putative formula: C34H32O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.368,"smiles":null,"spectrum_id":"CCMSLIB00017279165","spectrum_index":33992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSAMINE (delta mass: 26.0161 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.103,"smiles":null,"spectrum_id":"CCMSLIB00017279167","spectrum_index":33993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 309.1786 Da; putative annotation: N/A; putative formula: C13H27NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.327,"smiles":null,"spectrum_id":"CCMSLIB00017279169","spectrum_index":33994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 439.1692 Da; putative annotation: N/A; putative formula: C23H21N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.245,"smiles":null,"spectrum_id":"CCMSLIB00017279172","spectrum_index":33995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 208.0944 Da; putative annotation: N/A; putative formula: C8H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.228,"smiles":null,"spectrum_id":"CCMSLIB00017279174","spectrum_index":33996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 416.3653 Da; putative annotation: N/A; putative formula: C28H48O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.436,"smiles":null,"spectrum_id":"CCMSLIB00017279177","spectrum_index":33997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 627.2174 Da; putative annotation: N/A; putative formula: C39H34NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.256,"smiles":null,"spectrum_id":"CCMSLIB00017279180","spectrum_index":33998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1134.7153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1356.81,"smiles":null,"spectrum_id":"CCMSLIB00017279182","spectrum_index":33999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 340.1065 Da; putative annotation: N/A; putative formula: C10H22N4O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.203,"smiles":null,"spectrum_id":"CCMSLIB00017279184","spectrum_index":34000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 714.3976 Da; putative annotation: N/A; putative formula: C53H50N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.495,"smiles":null,"spectrum_id":"CCMSLIB00017279187","spectrum_index":34001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 893.478 Da; putative annotation: N/A; putative formula: C39H71N7O14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1056.54,"smiles":null,"spectrum_id":"CCMSLIB00017279190","spectrum_index":34002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 62.0217 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.084,"smiles":null,"spectrum_id":"CCMSLIB00017279192","spectrum_index":34003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 198.0935 Da; putative annotation: N/A; putative formula: C8H14N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.284,"smiles":null,"spectrum_id":"CCMSLIB00017279195","spectrum_index":34004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 327.2225 Da; putative annotation: N/A; putative formula: C18H33NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.45,"smiles":null,"spectrum_id":"CCMSLIB00017279196","spectrum_index":34005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 281.2717 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.395,"smiles":null,"spectrum_id":"CCMSLIB00017279199","spectrum_index":34006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 114.0247 Da; putative annotation: N/A; putative formula: C4H6N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.111,"smiles":null,"spectrum_id":"CCMSLIB00017279202","spectrum_index":34007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Asp (delta mass: 157.0374 Da; putative annotation: N/A; putative formula: C6H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.125,"smiles":null,"spectrum_id":"CCMSLIB00017279204","spectrum_index":34008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 929.4981 Da; putative annotation: N/A; putative formula: C44H63N15O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.56,"smiles":null,"spectrum_id":"CCMSLIB00017279206","spectrum_index":34009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 315.0999 Da; putative annotation: N/A; putative formula: C10H23NO6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.239,"smiles":null,"spectrum_id":"CCMSLIB00017279209","spectrum_index":34010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-1-methyl-1H-indole-2-carboxylic acid (delta mass: 172.1485 Da; putative annotation: N/A; putative formula: C9H21N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.18,"smiles":null,"spectrum_id":"CCMSLIB00017279212","spectrum_index":34011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 265.1262 Da; putative annotation: N/A; putative formula: C11H24NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.212,"smiles":null,"spectrum_id":"CCMSLIB00017279214","spectrum_index":34012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 302.1586 Da; putative annotation: N/A; putative formula: C22H23O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.245,"smiles":null,"spectrum_id":"CCMSLIB00017279216","spectrum_index":34013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Thr (delta mass: 534.2283 Da; putative annotation: N/A; putative formula: C30H35N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.321,"smiles":null,"spectrum_id":"CCMSLIB00017279219","spectrum_index":34014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-2-phenylpropan-1-amine (delta mass: 130.012 Da; putative annotation: N/A; putative formula: C4H7N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.14,"smiles":null,"spectrum_id":"CCMSLIB00017279222","spectrum_index":34015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 117.0055 Da; putative annotation: N/A; putative formula: C3H3NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.071,"smiles":null,"spectrum_id":"CCMSLIB00017279223","spectrum_index":34016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 149.0469 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.128,"smiles":null,"spectrum_id":"CCMSLIB00017279227","spectrum_index":34017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:UF408304 4-Aminoantipyrin|4-amino-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one (delta mass: 45.0224 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.135,"smiles":null,"spectrum_id":"CCMSLIB00017279230","spectrum_index":34018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine ethyl ester (delta mass: 32.0256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.169,"smiles":null,"spectrum_id":"CCMSLIB00017279232","spectrum_index":34019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 334.2248 Da; putative annotation: N/A; putative formula: C21H35O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.29,"smiles":null,"spectrum_id":"CCMSLIB00017279235","spectrum_index":34020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 119.0579 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.165,"smiles":null,"spectrum_id":"CCMSLIB00017279238","spectrum_index":34021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 175.045 Da; putative annotation: N/A; putative formula: C2H5N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.11,"smiles":null,"spectrum_id":"CCMSLIB00017279241","spectrum_index":34022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 63.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.181,"smiles":null,"spectrum_id":"CCMSLIB00017279243","spectrum_index":34023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Thr (delta mass: 57.021 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.155,"smiles":null,"spectrum_id":"CCMSLIB00017279245","spectrum_index":34024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 119.0244 Da; putative annotation: N/A; putative formula: C2H6N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.09,"smiles":null,"spectrum_id":"CCMSLIB00017279248","spectrum_index":34025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dovitinib (delta mass: 88.0181 Da; putative annotation: N/A; putative formula: C4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.202,"smiles":null,"spectrum_id":"CCMSLIB00017279251","spectrum_index":34026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 153.8322 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.101,"smiles":null,"spectrum_id":"CCMSLIB00017279254","spectrum_index":34027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cys-Gly-Lys (delta mass: 83.0703 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.214,"smiles":null,"spectrum_id":"CCMSLIB00017279257","spectrum_index":34028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLPUTRESCINE (delta mass: 53.063 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.181,"smiles":null,"spectrum_id":"CCMSLIB00017279259","spectrum_index":34029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fluvastatin (delta mass: 162.0585 Da; putative annotation: N/A; putative formula: C4H12N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.25,"smiles":null,"spectrum_id":"CCMSLIB00017279261","spectrum_index":34030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 400.1215 Da; putative annotation: N/A; putative formula: C14H24O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.208,"smiles":null,"spectrum_id":"CCMSLIB00017279264","spectrum_index":34031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 84.1167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.25,"smiles":null,"spectrum_id":"CCMSLIB00017279267","spectrum_index":34032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 144.0451 Da; putative annotation: N/A; putative formula: C5H9N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.184,"smiles":null,"spectrum_id":"CCMSLIB00017279270","spectrum_index":34033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 296.0696 Da; putative annotation: N/A; putative formula: C11H25O-1P5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.14,"smiles":null,"spectrum_id":"CCMSLIB00017279273","spectrum_index":34034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 486.1523 Da; putative annotation: N/A; putative formula: C23H22N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.302,"smiles":null,"spectrum_id":"CCMSLIB00017279275","spectrum_index":34035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 54.1879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.264,"smiles":null,"spectrum_id":"CCMSLIB00017279278","spectrum_index":34036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 280.2117 Da; putative annotation: N/A; putative formula: C6H25N12O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.365,"smiles":null,"spectrum_id":"CCMSLIB00017279281","spectrum_index":34037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 190.1711 Da; putative annotation: N/A; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.236,"smiles":null,"spectrum_id":"CCMSLIB00017279283","spectrum_index":34038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 59.0553 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.121,"smiles":null,"spectrum_id":"CCMSLIB00017279286","spectrum_index":34039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 296.2716 Da; putative annotation: N/A; putative formula: C19H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.309,"smiles":null,"spectrum_id":"CCMSLIB00017279289","spectrum_index":34040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Grevillic acid (delta mass: 41.02 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.07,"smiles":null,"spectrum_id":"CCMSLIB00017279291","spectrum_index":34041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 345.2068 Da; putative annotation: N/A; putative formula: C17H32NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.347,"smiles":null,"spectrum_id":"CCMSLIB00017279294","spectrum_index":34042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 173.0957 Da; putative annotation: N/A; putative formula: C10H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.156,"smiles":null,"spectrum_id":"CCMSLIB00017279297","spectrum_index":34043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2-methylpyridine (delta mass: 316.1083 Da; putative annotation: N/A; putative formula: C15H25OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.168,"smiles":null,"spectrum_id":"CCMSLIB00017279300","spectrum_index":34044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 104.0586 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.228,"smiles":null,"spectrum_id":"CCMSLIB00017279303","spectrum_index":34045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 38.9087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.0,"smiles":null,"spectrum_id":"CCMSLIB00017279305","spectrum_index":34046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 96.0517 Da; putative annotation: N/A; putative formula: C6H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.165,"smiles":null,"spectrum_id":"CCMSLIB00017279308","spectrum_index":34047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 144.0575 Da; putative annotation: N/A; putative formula: C10H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.123,"smiles":null,"spectrum_id":"CCMSLIB00017279310","spectrum_index":34048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 66.9623 Da; putative annotation: N/A; putative formula: C2H-2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.059,"smiles":null,"spectrum_id":"CCMSLIB00017279313","spectrum_index":34049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 61.0259 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.102,"smiles":null,"spectrum_id":"CCMSLIB00017279315","spectrum_index":34050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 192.0693 Da; putative annotation: N/A; putative formula: C13H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.131,"smiles":null,"spectrum_id":"CCMSLIB00017279317","spectrum_index":34051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 359.1755 Da; putative annotation: N/A; putative formula: C14H21N11O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.262,"smiles":null,"spectrum_id":"CCMSLIB00017279320","spectrum_index":34052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 71.0581 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.154,"smiles":null,"spectrum_id":"CCMSLIB00017279323","spectrum_index":34053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 90.031 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.164,"smiles":null,"spectrum_id":"CCMSLIB00017279324","spectrum_index":34054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 179.6801 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.717,"smiles":null,"spectrum_id":"CCMSLIB00017279327","spectrum_index":34055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 28.0686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.128,"smiles":null,"spectrum_id":"CCMSLIB00017279330","spectrum_index":34056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 301.3375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.434,"smiles":null,"spectrum_id":"CCMSLIB00017279332","spectrum_index":34057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 226.1202 Da; putative annotation: N/A; putative formula: C12H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.196,"smiles":null,"spectrum_id":"CCMSLIB00017279335","spectrum_index":34058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 784.4043 Da; putative annotation: N/A; putative formula: C44H64O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":965.475,"smiles":null,"spectrum_id":"CCMSLIB00017279337","spectrum_index":34059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 197.1625 Da; putative annotation: N/A; putative formula: C9H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.202,"smiles":null,"spectrum_id":"CCMSLIB00017279339","spectrum_index":34060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 188.9657 Da; putative annotation: N/A; putative formula: C3H-1N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.977,"smiles":null,"spectrum_id":"CCMSLIB00017279342","spectrum_index":34061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 273.192 Da; putative annotation: N/A; putative formula: C18H27NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.278,"smiles":null,"spectrum_id":"CCMSLIB00017279345","spectrum_index":34062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-indole-3-carbaldehyde (delta mass: 31.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.118,"smiles":null,"spectrum_id":"CCMSLIB00017279346","spectrum_index":34063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 118.0633 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.186,"smiles":null,"spectrum_id":"CCMSLIB00017279349","spectrum_index":34064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 24.2134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.362,"smiles":null,"spectrum_id":"CCMSLIB00017279352","spectrum_index":34065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-9H-pyrido[2,3-b]indole (AalphaC) (delta mass: 38.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.098,"smiles":null,"spectrum_id":"CCMSLIB00017279355","spectrum_index":34066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 59.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.122,"smiles":null,"spectrum_id":"CCMSLIB00017279358","spectrum_index":34067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 152.1194 Da; putative annotation: N/A; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.247,"smiles":null,"spectrum_id":"CCMSLIB00017279360","spectrum_index":34068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 296.1523 Da; putative annotation: N/A; putative formula: C18H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.27,"smiles":null,"spectrum_id":"CCMSLIB00017279362","spectrum_index":34069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 308.3196 Da; putative annotation: N/A; putative formula: C20H40N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.453,"smiles":null,"spectrum_id":"CCMSLIB00017279366","spectrum_index":34070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 96.0864 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.225,"smiles":null,"spectrum_id":"CCMSLIB00017279368","spectrum_index":34071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 60.0402 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.167,"smiles":null,"spectrum_id":"CCMSLIB00017279371","spectrum_index":34072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 32.0236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.193,"smiles":null,"spectrum_id":"CCMSLIB00017279374","spectrum_index":34073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 73.0528 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.144,"smiles":null,"spectrum_id":"CCMSLIB00017279376","spectrum_index":34074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 42.0467 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017279378","spectrum_index":34075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 982.516 Da; putative annotation: N/A; putative formula: C52H78N4O10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1163.59,"smiles":null,"spectrum_id":"CCMSLIB00017279381","spectrum_index":34076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 509.2123 Da; putative annotation: N/A; putative formula: C22H31N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":734.324,"smiles":null,"spectrum_id":"CCMSLIB00017279384","spectrum_index":34077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00918 Demethoxycurcumin (delta mass: 390.1533 Da; putative annotation: N/A; putative formula: C18H30O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":729.276,"smiles":null,"spectrum_id":"CCMSLIB00017279385","spectrum_index":34078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 11.0727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.137,"smiles":null,"spectrum_id":"CCMSLIB00017279388","spectrum_index":34079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 146.059 Da; putative annotation: N/A; putative formula: C7H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.161,"smiles":null,"spectrum_id":"CCMSLIB00017279391","spectrum_index":34080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 47.0396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.12,"smiles":null,"spectrum_id":"CCMSLIB00017279394","spectrum_index":34081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 138.0574 Da; putative annotation: N/A; putative formula: C10H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.176,"smiles":null,"spectrum_id":"CCMSLIB00017279395","spectrum_index":34082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 40.0 eV (delta mass: 195.0103 Da; putative annotation: N/A; putative formula: C7H5N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.097,"smiles":null,"spectrum_id":"CCMSLIB00017279398","spectrum_index":34083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 115.9171 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.003,"smiles":null,"spectrum_id":"CCMSLIB00017279401","spectrum_index":34084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 292.2639 Da; putative annotation: N/A; putative formula: C17H32N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.314,"smiles":null,"spectrum_id":"CCMSLIB00017279404","spectrum_index":34085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole-3-acetic acid CollisionEnergy:102040 (delta mass: 61.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017279405","spectrum_index":34086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 388.1119 Da; putative annotation: N/A; putative formula: C18H29OPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.151,"smiles":null,"spectrum_id":"CCMSLIB00017279408","spectrum_index":34087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine - 40.0 eV (delta mass: 83.0182 Da; putative annotation: N/A; putative formula: C4H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.069,"smiles":null,"spectrum_id":"CCMSLIB00017279411","spectrum_index":34088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 27.9943 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.07,"smiles":null,"spectrum_id":"CCMSLIB00017279414","spectrum_index":34089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 157.0855 Da; putative annotation: N/A; putative formula: C6H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.261,"smiles":null,"spectrum_id":"CCMSLIB00017279417","spectrum_index":34090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 69.0816 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.157,"smiles":null,"spectrum_id":"CCMSLIB00017279418","spectrum_index":34091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 457.1438 Da; putative annotation: N/A; putative formula: C30H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.214,"smiles":null,"spectrum_id":"CCMSLIB00017279421","spectrum_index":34092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 120.0409 Da; putative annotation: N/A; putative formula: C8H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.101,"smiles":null,"spectrum_id":"CCMSLIB00017279424","spectrum_index":34093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 43.9987 Da; putative annotation: N/A; putative formula: N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.048,"smiles":null,"spectrum_id":"CCMSLIB00017279427","spectrum_index":34094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 74.037 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.171,"smiles":null,"spectrum_id":"CCMSLIB00017279430","spectrum_index":34095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 111.069 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.108,"smiles":null,"spectrum_id":"CCMSLIB00017279433","spectrum_index":34096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005923 Tetrahydropapaveroline|1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 182.0973 Da; putative annotation: N/A; putative formula: C9H15N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.22,"smiles":null,"spectrum_id":"CCMSLIB00017279434","spectrum_index":34097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 297.2653 Da; putative annotation: N/A; putative formula: C18H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.389,"smiles":null,"spectrum_id":"CCMSLIB00017279438","spectrum_index":34098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 248.054 Da; putative annotation: N/A; putative formula: C10H16O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.219,"smiles":null,"spectrum_id":"CCMSLIB00017279440","spectrum_index":34099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 19.0157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.17,"smiles":null,"spectrum_id":"CCMSLIB00017279443","spectrum_index":34100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Felbinac (delta mass: 23.0007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017279446","spectrum_index":34101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1112.5356 Da; putative annotation: N/A; putative formula: C55H84O23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1305.61,"smiles":null,"spectrum_id":"CCMSLIB00017279448","spectrum_index":34102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 397.1968 Da; putative annotation: N/A; putative formula: C18H31N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.373,"smiles":null,"spectrum_id":"CCMSLIB00017279451","spectrum_index":34103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 200.1049 Da; putative annotation: N/A; putative formula: C10H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.171,"smiles":null,"spectrum_id":"CCMSLIB00017279454","spectrum_index":34104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 557.0015 Da; putative annotation: N/A; putative formula: C28H11N7O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.099,"smiles":null,"spectrum_id":"CCMSLIB00017279457","spectrum_index":34105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 130.0842 Da; putative annotation: N/A; putative formula: C4H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.171,"smiles":null,"spectrum_id":"CCMSLIB00017279459","spectrum_index":34106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 14.015 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.164,"smiles":null,"spectrum_id":"CCMSLIB00017279462","spectrum_index":34107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 771.8569 Da; putative annotation: N/A; putative formula: C12H20O26S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1081.97,"smiles":null,"spectrum_id":"CCMSLIB00017279465","spectrum_index":34108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 239.1527 Da; putative annotation: N/A; putative formula: C13H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.223,"smiles":null,"spectrum_id":"CCMSLIB00017279468","spectrum_index":34109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 202.2083 Da; putative annotation: N/A; putative formula: C16H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.398,"smiles":null,"spectrum_id":"CCMSLIB00017279471","spectrum_index":34110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 154.8559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.922,"smiles":null,"spectrum_id":"CCMSLIB00017279472","spectrum_index":34111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 136.0411 Da; putative annotation: N/A; putative formula: C5H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017279475","spectrum_index":34112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 32.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.118,"smiles":null,"spectrum_id":"CCMSLIB00017279478","spectrum_index":34113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 171.1262 Da; putative annotation: N/A; putative formula: C9H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.432,"smiles":null,"spectrum_id":"CCMSLIB00017279481","spectrum_index":34114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 32.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.106,"smiles":null,"spectrum_id":"CCMSLIB00017279482","spectrum_index":34115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 107.0276 Da; putative annotation: N/A; putative formula: C6H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.124,"smiles":null,"spectrum_id":"CCMSLIB00017279485","spectrum_index":34116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 86.0699 Da; putative annotation: N/A; putative formula: CH6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.155,"smiles":null,"spectrum_id":"CCMSLIB00017279488","spectrum_index":34117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 124.0734 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.227,"smiles":null,"spectrum_id":"CCMSLIB00017279491","spectrum_index":34118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 240.0724 Da; putative annotation: N/A; putative formula: C14H12N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.113,"smiles":null,"spectrum_id":"CCMSLIB00017279492","spectrum_index":34119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 392.736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.796,"smiles":null,"spectrum_id":"CCMSLIB00017279495","spectrum_index":34120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 256.0951 Da; putative annotation: N/A; putative formula: C12H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.161,"smiles":null,"spectrum_id":"CCMSLIB00017279498","spectrum_index":34121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 384.2375 Da; putative annotation: N/A; putative formula: C18H32N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.34,"smiles":null,"spectrum_id":"CCMSLIB00017279501","spectrum_index":34122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 46.0062 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.077,"smiles":null,"spectrum_id":"CCMSLIB00017279504","spectrum_index":34123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 132.0867 Da; putative annotation: N/A; putative formula: CH8N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.209,"smiles":null,"spectrum_id":"CCMSLIB00017279507","spectrum_index":34124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 1223.8287 Da; putative annotation: N/A; putative formula: C81H105N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1361.92,"smiles":null,"spectrum_id":"CCMSLIB00017279509","spectrum_index":34125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 1044.3962 Da; putative annotation: N/A; putative formula: C64H52N8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1387.52,"smiles":null,"spectrum_id":"CCMSLIB00017279512","spectrum_index":34126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 1253.8114 Da; putative annotation: N/A; putative formula: C96H103NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1391.9,"smiles":null,"spectrum_id":"CCMSLIB00017279515","spectrum_index":34127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 157.0111 Da; putative annotation: N/A; putative formula: C6H8NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.098,"smiles":null,"spectrum_id":"CCMSLIB00017279518","spectrum_index":34128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.108,"smiles":null,"spectrum_id":"CCMSLIB00017279521","spectrum_index":34129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 35.0733 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.139,"smiles":null,"spectrum_id":"CCMSLIB00017279524","spectrum_index":34130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Keto-1-methyl-3H-imidazo[4,5-b]pyridin-6-yl)benzamide (delta mass: 88.0085 Da; putative annotation: N/A; putative formula: C3H5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.112,"smiles":null,"spectrum_id":"CCMSLIB00017279527","spectrum_index":34131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 208.1921 Da; putative annotation: N/A; putative formula: C13H24N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.269,"smiles":null,"spectrum_id":"CCMSLIB00017279530","spectrum_index":34132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 255.1621 Da; putative annotation: N/A; putative formula: C17H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.242,"smiles":null,"spectrum_id":"CCMSLIB00017279532","spectrum_index":34133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chelidonin (delta mass: 24.0357 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.169,"smiles":null,"spectrum_id":"CCMSLIB00017279535","spectrum_index":34134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 17.1194 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.284,"smiles":null,"spectrum_id":"CCMSLIB00017279538","spectrum_index":34135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 330.1169 Da; putative annotation: N/A; putative formula: C14H23N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.165,"smiles":null,"spectrum_id":"CCMSLIB00017279541","spectrum_index":34136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 6.3307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.5,"smiles":null,"spectrum_id":"CCMSLIB00017279544","spectrum_index":34137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 331.182 Da; putative annotation: N/A; putative formula: C16H29NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.263,"smiles":null,"spectrum_id":"CCMSLIB00017279547","spectrum_index":34138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 16.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.128,"smiles":null,"spectrum_id":"CCMSLIB00017279549","spectrum_index":34139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 54.0073 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.05,"smiles":null,"spectrum_id":"CCMSLIB00017279551","spectrum_index":34140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 26.0169 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.082,"smiles":null,"spectrum_id":"CCMSLIB00017279554","spectrum_index":34141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 88.0676 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017279557","spectrum_index":34142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 68.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.155,"smiles":null,"spectrum_id":"CCMSLIB00017279558","spectrum_index":34143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 148.0537 Da; putative annotation: 3,4'-Dihydroxypropiophenone; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.14,"smiles":null,"spectrum_id":"CCMSLIB00017279561","spectrum_index":34144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 954.305 Da; putative annotation: .alpha.-Cyclodextrin; putative formula: C36H58O29)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1297.43,"smiles":null,"spectrum_id":"CCMSLIB00017279564","spectrum_index":34145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 212.083 Da; putative annotation: 2-Acetyl-5-(tetrahydroxybutyl)imidazole; putative formula: C9H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.159,"smiles":null,"spectrum_id":"CCMSLIB00017279567","spectrum_index":34146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 208.0859 Da; putative annotation: PyroGlu-Pro; putative formula: C10H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.167,"smiles":null,"spectrum_id":"CCMSLIB00017279569","spectrum_index":34147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 148.088 Da; putative annotation: 5-Hydroxyadamantan-2-one; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.159,"smiles":null,"spectrum_id":"CCMSLIB00017279572","spectrum_index":34148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304055 p-Coumaraldehyde (delta mass: 432.1434 Da; putative annotation: [(1S)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl benzoate; putative formula: C22H24O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.203,"smiles":null,"spectrum_id":"CCMSLIB00017279574","spectrum_index":34149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 226.0997 Da; putative annotation: [2-(Benzyloxy)-3-methoxyphenyl]methanol; putative formula: C15H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017279577","spectrum_index":34150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 116.0827 Da; putative annotation: 1,1,1-Tris(hydroxymethyl)propane; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.232,"smiles":null,"spectrum_id":"CCMSLIB00017279580","spectrum_index":34151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 162.0518 Da; putative annotation: Spectral Match to D-(+)-Mannose from NIST14; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.138,"smiles":null,"spectrum_id":"CCMSLIB00017279582","spectrum_index":34152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 158.0214 Da; putative annotation: Vitamin C - 30.0 eV; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.097,"smiles":null,"spectrum_id":"CCMSLIB00017279584","spectrum_index":34153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 157.0527 Da; putative annotation: 7-Amino-4-methylcoumarin; putative formula: C10H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.139,"smiles":null,"spectrum_id":"CCMSLIB00017279587","spectrum_index":34154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 15.0149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.122,"smiles":null,"spectrum_id":"CCMSLIB00017279590","spectrum_index":34155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 106.026 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.175,"smiles":null,"spectrum_id":"CCMSLIB00017279592","spectrum_index":34156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 14.0244 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017279596","spectrum_index":34157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-(trifluoromethyl)benzo[c][1,8]naphthyridin-6(5H)-one (delta mass: 127.1318 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.206,"smiles":null,"spectrum_id":"CCMSLIB00017279598","spectrum_index":34158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 40.4817 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.573,"smiles":null,"spectrum_id":"CCMSLIB00017279600","spectrum_index":34159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 453.1846 Da; putative annotation: N/A; putative formula: C18H31NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.26,"smiles":null,"spectrum_id":"CCMSLIB00017279603","spectrum_index":34160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 90.1659 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.279,"smiles":null,"spectrum_id":"CCMSLIB00017279606","spectrum_index":34161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GLUCOSAMINE (delta mass: 260.2147 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.301,"smiles":null,"spectrum_id":"CCMSLIB00017279607","spectrum_index":34162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 81.151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.19,"smiles":null,"spectrum_id":"CCMSLIB00017279610","spectrum_index":34163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(5-Nitro-1H-indol-3-yl)ethan-1-one (delta mass: 18.0692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.13,"smiles":null,"spectrum_id":"CCMSLIB00017279613","spectrum_index":34164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 269.1259 Da; putative annotation: N/A; putative formula: C13H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.197,"smiles":null,"spectrum_id":"CCMSLIB00017279616","spectrum_index":34165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 193.1104 Da; putative annotation: N/A; putative formula: C11H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.207,"smiles":null,"spectrum_id":"CCMSLIB00017279619","spectrum_index":34166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 12.9938 Da; putative annotation: N/A; putative formula: C22H32N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.081,"smiles":null,"spectrum_id":"CCMSLIB00017279620","spectrum_index":34167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 188.0456 Da; putative annotation: N/A; putative formula: C5H9N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.116,"smiles":null,"spectrum_id":"CCMSLIB00017279623","spectrum_index":34168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 166.0996 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.217,"smiles":null,"spectrum_id":"CCMSLIB00017279626","spectrum_index":34169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,4,6-Trihydroxyacetophenone\"\" (delta mass: 45.058 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017279629","spectrum_index":34170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 252.0248 Da; putative annotation: N/A; putative formula: C9H11N4O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.095,"smiles":null,"spectrum_id":"CCMSLIB00017279631","spectrum_index":34171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 278.0573 Da; putative annotation: N/A; putative formula: C9H14N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.149,"smiles":null,"spectrum_id":"CCMSLIB00017279633","spectrum_index":34172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 43.9797 Da; putative annotation: N/A; putative formula: CHP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.124,"smiles":null,"spectrum_id":"CCMSLIB00017279636","spectrum_index":34173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 17.979 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.092,"smiles":null,"spectrum_id":"CCMSLIB00017279639","spectrum_index":34174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 241.2615 Da; putative annotation: N/A; putative formula: C13H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.332,"smiles":null,"spectrum_id":"CCMSLIB00017279642","spectrum_index":34175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 202.133 Da; putative annotation: N/A; putative formula: C10H14N6O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.22,"smiles":null,"spectrum_id":"CCMSLIB00017279643","spectrum_index":34176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 81.0805 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.129,"smiles":null,"spectrum_id":"CCMSLIB00017279646","spectrum_index":34177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 482.2725 Da; putative annotation: N/A; putative formula: C22H42O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.353,"smiles":null,"spectrum_id":"CCMSLIB00017279649","spectrum_index":34178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.141,"smiles":null,"spectrum_id":"CCMSLIB00017279652","spectrum_index":34179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 425.1112 Da; putative annotation: N/A; putative formula: C15H27N3O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.171,"smiles":null,"spectrum_id":"CCMSLIB00017279653","spectrum_index":34180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 216.1765 Da; putative annotation: N/A; putative formula: C10H24N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.315,"smiles":null,"spectrum_id":"CCMSLIB00017279656","spectrum_index":34181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 262.0932 Da; putative annotation: N/A; putative formula: C17H14N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.227,"smiles":null,"spectrum_id":"CCMSLIB00017279659","spectrum_index":34182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluorotryptamine (delta mass: 210.0728 Da; putative annotation: N/A; putative formula: C11H16P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.171,"smiles":null,"spectrum_id":"CCMSLIB00017279662","spectrum_index":34183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100147 Indole-3-acetaldehyde (delta mass: 176.0314 Da; putative annotation: N/A; putative formula: C10H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.107,"smiles":null,"spectrum_id":"CCMSLIB00017279664","spectrum_index":34184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 299.6464 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.733,"smiles":null,"spectrum_id":"CCMSLIB00017279666","spectrum_index":34185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 302.169 Da; putative annotation: N/A; putative formula: C13H27N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.26,"smiles":null,"spectrum_id":"CCMSLIB00017279669","spectrum_index":34186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE (delta mass: 68.7943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.886,"smiles":null,"spectrum_id":"CCMSLIB00017279672","spectrum_index":34187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(9H-Carbazol-9-yl)propanoic acid (delta mass: 288.1833 Da; putative annotation: N/A; putative formula: C17H24N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.285,"smiles":null,"spectrum_id":"CCMSLIB00017279673","spectrum_index":34188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 176.0269 Da; putative annotation: N/A; putative formula: C6H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.097,"smiles":null,"spectrum_id":"CCMSLIB00017279676","spectrum_index":34189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Indolinone (delta mass: 58.04 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017279679","spectrum_index":34190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 78.0498 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017279682","spectrum_index":34191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 98.0378 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.176,"smiles":null,"spectrum_id":"CCMSLIB00017279685","spectrum_index":34192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 55.0557 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.143,"smiles":null,"spectrum_id":"CCMSLIB00017279688","spectrum_index":34193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luciferin (delta mass: 51.0087 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.014,"smiles":null,"spectrum_id":"CCMSLIB00017279690","spectrum_index":34194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 182.1273 Da; putative annotation: N/A; putative formula: C7H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.208,"smiles":null,"spectrum_id":"CCMSLIB00017279693","spectrum_index":34195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 159.09 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.182,"smiles":null,"spectrum_id":"CCMSLIB00017279695","spectrum_index":34196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 412.2081 Da; putative annotation: N/A; putative formula: C18H32N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.268,"smiles":null,"spectrum_id":"CCMSLIB00017279699","spectrum_index":34197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 155.0589 Da; putative annotation: N/A; putative formula: C7H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.119,"smiles":null,"spectrum_id":"CCMSLIB00017279702","spectrum_index":34198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 140.104 Da; putative annotation: N/A; putative formula: C9H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.273,"smiles":null,"spectrum_id":"CCMSLIB00017279705","spectrum_index":34199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 106.0783 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017279708","spectrum_index":34200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Val (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.187,"smiles":null,"spectrum_id":"CCMSLIB00017279710","spectrum_index":34201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin D (delta mass: 159.0153 Da; putative annotation: N/A; putative formula: C9H5NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.201,"smiles":null,"spectrum_id":"CCMSLIB00017279713","spectrum_index":34202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ascorbic acid 6-palmitate (delta mass: 271.1273 Da; putative annotation: N/A; putative formula: C12H22N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.396,"smiles":null,"spectrum_id":"CCMSLIB00017279716","spectrum_index":34203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 283.1468 Da; putative annotation: N/A; putative formula: C12H21N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.286,"smiles":null,"spectrum_id":"CCMSLIB00017279719","spectrum_index":34204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 391.1503 Da; putative annotation: N/A; putative formula: C18H17N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.21,"smiles":null,"spectrum_id":"CCMSLIB00017279720","spectrum_index":34205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 273.0699 Da; putative annotation: N/A; putative formula: C10H16N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.209,"smiles":null,"spectrum_id":"CCMSLIB00017279723","spectrum_index":34206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 154.0327 Da; putative annotation: N/A; putative formula: C11H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.186,"smiles":null,"spectrum_id":"CCMSLIB00017279726","spectrum_index":34207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 178.1207 Da; putative annotation: N/A; putative formula: C9H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.244,"smiles":null,"spectrum_id":"CCMSLIB00017279729","spectrum_index":34208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 345.2395 Da; putative annotation: N/A; putative formula: C16H27N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.508,"smiles":null,"spectrum_id":"CCMSLIB00017279730","spectrum_index":34209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 230.1595 Da; putative annotation: N/A; putative formula: C16H23O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.235,"smiles":null,"spectrum_id":"CCMSLIB00017279733","spectrum_index":34210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 158.022 Da; putative annotation: N/A; putative formula: C7H10S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.14,"smiles":null,"spectrum_id":"CCMSLIB00017279736","spectrum_index":34211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 695.299 Da; putative annotation: N/A; putative formula: C35H45N5O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":889.417,"smiles":null,"spectrum_id":"CCMSLIB00017279739","spectrum_index":34212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 499.2298 Da; putative annotation: N/A; putative formula: C38H29N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.369,"smiles":null,"spectrum_id":"CCMSLIB00017279742","spectrum_index":34213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 65.0263 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.123,"smiles":null,"spectrum_id":"CCMSLIB00017279743","spectrum_index":34214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 123.9818 Da; putative annotation: N/A; putative formula: C4HN2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.062,"smiles":null,"spectrum_id":"CCMSLIB00017279746","spectrum_index":34215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 149.0658 Da; putative annotation: N/A; putative formula: C9H8FN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.131,"smiles":null,"spectrum_id":"CCMSLIB00017279749","spectrum_index":34216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 78.0384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.172,"smiles":null,"spectrum_id":"CCMSLIB00017279751","spectrum_index":34217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 121.0161 Da; putative annotation: N/A; putative formula: C6H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.097,"smiles":null,"spectrum_id":"CCMSLIB00017279753","spectrum_index":34218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 451.9682 Da; putative annotation: N/A; putative formula: C23H8N4O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":767.127,"smiles":null,"spectrum_id":"CCMSLIB00017279756","spectrum_index":34219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 530.1393 Da; putative annotation: N/A; putative formula: C22H30N2O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.21,"smiles":null,"spectrum_id":"CCMSLIB00017279759","spectrum_index":34220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 329.2299 Da; putative annotation: N/A; putative formula: C20H31N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.325,"smiles":null,"spectrum_id":"CCMSLIB00017279762","spectrum_index":34221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE30; MS2Dec (delta mass: 43.0247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.085,"smiles":null,"spectrum_id":"CCMSLIB00017279763","spectrum_index":34222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-His (delta mass: 147.0684 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.167,"smiles":null,"spectrum_id":"CCMSLIB00017279766","spectrum_index":34223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 191.2768 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.348,"smiles":null,"spectrum_id":"CCMSLIB00017279769","spectrum_index":34224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 79.9666 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.037,"smiles":null,"spectrum_id":"CCMSLIB00017279770","spectrum_index":34225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 58.0419 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.133,"smiles":null,"spectrum_id":"CCMSLIB00017279773","spectrum_index":34226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 57.9835 Da; putative annotation: N/A; putative formula: C5H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.142,"smiles":null,"spectrum_id":"CCMSLIB00017279776","spectrum_index":34227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 243.1344 Da; putative annotation: N/A; putative formula: C10H13N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.238,"smiles":null,"spectrum_id":"CCMSLIB00017279779","spectrum_index":34228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 72.046 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.341,"smiles":null,"spectrum_id":"CCMSLIB00017279781","spectrum_index":34229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 73.0522 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.112,"smiles":null,"spectrum_id":"CCMSLIB00017279784","spectrum_index":34230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 20.1202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.322,"smiles":null,"spectrum_id":"CCMSLIB00017279786","spectrum_index":34231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-Ile (delta mass: 113.0849 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.25,"smiles":null,"spectrum_id":"CCMSLIB00017279789","spectrum_index":34232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cannabinol (delta mass: 134.0576 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.258,"smiles":null,"spectrum_id":"CCMSLIB00017279792","spectrum_index":34233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 191.0365 Da; putative annotation: N/A; putative formula: C5H9N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.113,"smiles":null,"spectrum_id":"CCMSLIB00017279795","spectrum_index":34234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 55.0601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.147,"smiles":null,"spectrum_id":"CCMSLIB00017279797","spectrum_index":34235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 139.0643 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.14,"smiles":null,"spectrum_id":"CCMSLIB00017279799","spectrum_index":34236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:KNA00327 Tyramine|2-(p-Hydroxyphenyl)ethylamine (delta mass: 20.9468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.038,"smiles":null,"spectrum_id":"CCMSLIB00017279802","spectrum_index":34237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 127.0624 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.164,"smiles":null,"spectrum_id":"CCMSLIB00017279805","spectrum_index":34238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 322.1482 Da; putative annotation: N/A; putative formula: C13H27N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.234,"smiles":null,"spectrum_id":"CCMSLIB00017279807","spectrum_index":34239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 306.119 Da; putative annotation: N/A; putative formula: C19H18N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.221,"smiles":null,"spectrum_id":"CCMSLIB00017279810","spectrum_index":34240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 675.3588 Da; putative annotation: N/A; putative formula: C32H49N7O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.419,"smiles":null,"spectrum_id":"CCMSLIB00017279813","spectrum_index":34241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 157.0374 Da; putative annotation: N/A; putative formula: C6H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.124,"smiles":null,"spectrum_id":"CCMSLIB00017279815","spectrum_index":34242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 75.0712 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.16,"smiles":null,"spectrum_id":"CCMSLIB00017279818","spectrum_index":34243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Amino-4,4-dimethylpentanoic acid (delta mass: 98.0734 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.191,"smiles":null,"spectrum_id":"CCMSLIB00017279821","spectrum_index":34244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 111.0269 Da; putative annotation: N/A; putative formula: C4H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.108,"smiles":null,"spectrum_id":"CCMSLIB00017279823","spectrum_index":34245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 193.0694 Da; putative annotation: N/A; putative formula: C7H16NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.161,"smiles":null,"spectrum_id":"CCMSLIB00017279825","spectrum_index":34246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 232.1148 Da; putative annotation: N/A; putative formula: C12H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.18,"smiles":null,"spectrum_id":"CCMSLIB00017279828","spectrum_index":34247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 25.0537 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.14,"smiles":null,"spectrum_id":"CCMSLIB00017279831","spectrum_index":34248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 141.031 Da; putative annotation: N/A; putative formula: C8H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.128,"smiles":null,"spectrum_id":"CCMSLIB00017279833","spectrum_index":34249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"methyl 3-[(2-(2-1,2,3,4-tetrahydroisoquinolyl)acetylamino)methyl]benzoate CollisionEnergy:205060\"\" (delta mass: 165.0749 Da; putative annotation: N/A; putative formula: C4H11N3O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.245,"smiles":null,"spectrum_id":"CCMSLIB00017279835","spectrum_index":34250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 344.1771 Da; putative annotation: N/A; putative formula: C16H28N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.284,"smiles":null,"spectrum_id":"CCMSLIB00017279838","spectrum_index":34251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 339.1179 Da; putative annotation: N/A; putative formula: C13H17N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.189,"smiles":null,"spectrum_id":"CCMSLIB00017279841","spectrum_index":34252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin E (delta mass: 34.0205 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017279844","spectrum_index":34253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 46.0601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.139,"smiles":null,"spectrum_id":"CCMSLIB00017279846","spectrum_index":34254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 224.177 Da; putative annotation: N/A; putative formula: C14H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.273,"smiles":null,"spectrum_id":"CCMSLIB00017279848","spectrum_index":34255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 170.0933 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.195,"smiles":null,"spectrum_id":"CCMSLIB00017279851","spectrum_index":34256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 147.2778 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.422,"smiles":null,"spectrum_id":"CCMSLIB00017279854","spectrum_index":34257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 41.0994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.17,"smiles":null,"spectrum_id":"CCMSLIB00017279857","spectrum_index":34258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 492.1853 Da; putative annotation: N/A; putative formula: C22H36O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.297,"smiles":null,"spectrum_id":"CCMSLIB00017279859","spectrum_index":34259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 787.362 Da; putative annotation: N/A; putative formula: C43H65NO2S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":938.422,"smiles":null,"spectrum_id":"CCMSLIB00017279862","spectrum_index":34260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-hydroxyquinoline (delta mass: 9.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.081,"smiles":null,"spectrum_id":"CCMSLIB00017279865","spectrum_index":34261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 17.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.14,"smiles":null,"spectrum_id":"CCMSLIB00017279867","spectrum_index":34262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 900.583 Da; putative annotation: N/A; putative formula: C42H80N10O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1055.65,"smiles":null,"spectrum_id":"CCMSLIB00017279870","spectrum_index":34263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 774.3178 Da; putative annotation: N/A; putative formula: C44H55O6PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":981.404,"smiles":null,"spectrum_id":"CCMSLIB00017279873","spectrum_index":34264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 143.1927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.289,"smiles":null,"spectrum_id":"CCMSLIB00017279876","spectrum_index":34265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-beta-D-galactosamine - 40.0 eV (delta mass: 144.0421 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.139,"smiles":null,"spectrum_id":"CCMSLIB00017279878","spectrum_index":34266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 56.0376 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.124,"smiles":null,"spectrum_id":"CCMSLIB00017279881","spectrum_index":34267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 103.0423 Da; putative annotation: N/A; putative formula: C7H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.092,"smiles":null,"spectrum_id":"CCMSLIB00017279883","spectrum_index":34268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 115.8868 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.926,"smiles":null,"spectrum_id":"CCMSLIB00017279886","spectrum_index":34269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 294.2209 Da; putative annotation: N/A; putative formula: C19H26N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.271,"smiles":null,"spectrum_id":"CCMSLIB00017279888","spectrum_index":34270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 81.0576 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.139,"smiles":null,"spectrum_id":"CCMSLIB00017279891","spectrum_index":34271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 10.9927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.1,"smiles":null,"spectrum_id":"CCMSLIB00017279894","spectrum_index":34272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 102.0313 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.128,"smiles":null,"spectrum_id":"CCMSLIB00017279896","spectrum_index":34273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 130.0623 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.128,"smiles":null,"spectrum_id":"CCMSLIB00017279899","spectrum_index":34274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 92.0264 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.124,"smiles":null,"spectrum_id":"CCMSLIB00017279902","spectrum_index":34275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 647.24 Da; putative annotation: N/A; putative formula: C30H29N15OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1314.47,"smiles":null,"spectrum_id":"CCMSLIB00017279904","spectrum_index":34276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 45.1306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.305,"smiles":null,"spectrum_id":"CCMSLIB00017279906","spectrum_index":34277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 302.2818 Da; putative annotation: N/A; putative formula: C19H34N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.321,"smiles":null,"spectrum_id":"CCMSLIB00017279909","spectrum_index":34278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 45.9905 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.102,"smiles":null,"spectrum_id":"CCMSLIB00017279912","spectrum_index":34279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 66.0094 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.159,"smiles":null,"spectrum_id":"CCMSLIB00017279913","spectrum_index":34280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 116.0625 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.128,"smiles":null,"spectrum_id":"CCMSLIB00017279916","spectrum_index":34281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 739.3843 Da; putative annotation: N/A; putative formula: C44H57N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.455,"smiles":null,"spectrum_id":"CCMSLIB00017279919","spectrum_index":34282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydropertusaric (delta mass: 17.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.289,"smiles":null,"spectrum_id":"CCMSLIB00017279922","spectrum_index":34283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 252.1725 Da; putative annotation: N/A; putative formula: C15H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.243,"smiles":null,"spectrum_id":"CCMSLIB00017279925","spectrum_index":34284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 242.1499 Da; putative annotation: N/A; putative formula: C17H22O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.21,"smiles":null,"spectrum_id":"CCMSLIB00017279927","spectrum_index":34285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 115.0998 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.196,"smiles":null,"spectrum_id":"CCMSLIB00017279929","spectrum_index":34286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 120.0318 Da; putative annotation: N/A; putative formula: C6H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.113,"smiles":null,"spectrum_id":"CCMSLIB00017279932","spectrum_index":34287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-1-yl)propanamide (delta mass: 129.0336 Da; putative annotation: N/A; putative formula: C5H8NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.136,"smiles":null,"spectrum_id":"CCMSLIB00017279935","spectrum_index":34288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 194.0469 Da; putative annotation: N/A; putative formula: C6H15N2O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017279938","spectrum_index":34289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one (delta mass: 76.0355 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.106,"smiles":null,"spectrum_id":"CCMSLIB00017279940","spectrum_index":34290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1096.5462 Da; putative annotation: N/A; putative formula: C69H72N6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1289.62,"smiles":null,"spectrum_id":"CCMSLIB00017279942","spectrum_index":34291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexamethylene\u00a0bisacetamide (delta mass: 45.0096 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.169,"smiles":null,"spectrum_id":"CCMSLIB00017279945","spectrum_index":34292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 160.073 Da; putative annotation: N/A; putative formula: C7H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.153,"smiles":null,"spectrum_id":"CCMSLIB00017279948","spectrum_index":34293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.155,"smiles":null,"spectrum_id":"CCMSLIB00017279951","spectrum_index":34294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 63.0114 Da; putative annotation: N/A; putative formula: C4HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.093,"smiles":null,"spectrum_id":"CCMSLIB00017279952","spectrum_index":34295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 71.9763 Da; putative annotation: N/A; putative formula: C2HOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.047,"smiles":null,"spectrum_id":"CCMSLIB00017279955","spectrum_index":34296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminophenylboronic acid (delta mass: 30.9959 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.068,"smiles":null,"spectrum_id":"CCMSLIB00017279958","spectrum_index":34297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Isopropyl-1H-benzimidazole-2-thiol (delta mass: 56.0689 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017279961","spectrum_index":34298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 124.0776 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017279962","spectrum_index":34299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.112,"smiles":null,"spectrum_id":"CCMSLIB00017279965","spectrum_index":34300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 37.0316 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017279968","spectrum_index":34301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:UA006001 L-(+)-Ergothioneine|L-Ergothioneine|5-[(2S)-2-Carboxy-2-(trimethylazaniumyl)ethyl]-1H-imidazole-2-thiolate (delta mass: 19.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017279970","spectrum_index":34302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 71.0737 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.134,"smiles":null,"spectrum_id":"CCMSLIB00017279972","spectrum_index":34303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 594.479 Da; putative annotation: N/A; putative formula: C37H63N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.576,"smiles":null,"spectrum_id":"CCMSLIB00017279975","spectrum_index":34304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 73.0406 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.132,"smiles":null,"spectrum_id":"CCMSLIB00017279978","spectrum_index":34305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 83.0292 Da; putative annotation: N/A; putative formula: C4H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.106,"smiles":null,"spectrum_id":"CCMSLIB00017279980","spectrum_index":34306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 82.0189 Da; putative annotation: N/A; putative formula: C8H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.084,"smiles":null,"spectrum_id":"CCMSLIB00017279983","spectrum_index":34307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 165.8382 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.898,"smiles":null,"spectrum_id":"CCMSLIB00017279985","spectrum_index":34308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 567.3263 Da; putative annotation: N/A; putative formula: C27H53NO7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.381,"smiles":null,"spectrum_id":"CCMSLIB00017279988","spectrum_index":34309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 41.0416 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017279990","spectrum_index":34310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 68.0629 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.212,"smiles":null,"spectrum_id":"CCMSLIB00017279992","spectrum_index":34311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 382.7256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.796,"smiles":null,"spectrum_id":"CCMSLIB00017279995","spectrum_index":34312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE10; MS2Dec (delta mass: 185.0288 Da; putative annotation: N/A; putative formula: C5H8N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.11,"smiles":null,"spectrum_id":"CCMSLIB00017279998","spectrum_index":34313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 162.918 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.955,"smiles":null,"spectrum_id":"CCMSLIB00017280001","spectrum_index":34314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of C18Octadecanoyl-L-Carnitine (delta mass: 77.9604 Da; putative annotation: N/A; putative formula: CH2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.334,"smiles":null,"spectrum_id":"CCMSLIB00017280002","spectrum_index":34315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 704.3619 Da; putative annotation: N/A; putative formula: C34H56O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":859.432,"smiles":null,"spectrum_id":"CCMSLIB00017280005","spectrum_index":34316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 71.0804 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.182,"smiles":null,"spectrum_id":"CCMSLIB00017280008","spectrum_index":34317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 70.0244 Da; putative annotation: N/A; putative formula: C4H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.111,"smiles":null,"spectrum_id":"CCMSLIB00017280011","spectrum_index":34318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Nitroso-6-quinolinol (delta mass: 60.0655 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.116,"smiles":null,"spectrum_id":"CCMSLIB00017280014","spectrum_index":34319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 108.0338 Da; putative annotation: N/A; putative formula: C5H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.106,"smiles":null,"spectrum_id":"CCMSLIB00017280015","spectrum_index":34320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 164.0363 Da; putative annotation: N/A; putative formula: C3H8N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017280018","spectrum_index":34321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 146.0987 Da; putative annotation: N/A; putative formula: C5H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.186,"smiles":null,"spectrum_id":"CCMSLIB00017280021","spectrum_index":34322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 85.0524 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.144,"smiles":null,"spectrum_id":"CCMSLIB00017280024","spectrum_index":34323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxy-1H-indole-3-carbaldehyde (delta mass: 43.9895 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.06,"smiles":null,"spectrum_id":"CCMSLIB00017280025","spectrum_index":34324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 686.3162 Da; putative annotation: N/A; putative formula: C44H47O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.408,"smiles":null,"spectrum_id":"CCMSLIB00017280028","spectrum_index":34325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 401.2319 Da; putative annotation: N/A; putative formula: C23H35N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.334,"smiles":null,"spectrum_id":"CCMSLIB00017280031","spectrum_index":34326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 89.0477 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.192,"smiles":null,"spectrum_id":"CCMSLIB00017280033","spectrum_index":34327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 59.0357 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.094,"smiles":null,"spectrum_id":"CCMSLIB00017280035","spectrum_index":34328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 69.0137 Da; putative annotation: N/A; putative formula: C3H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.054,"smiles":null,"spectrum_id":"CCMSLIB00017280038","spectrum_index":34329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 44.9186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.969,"smiles":null,"spectrum_id":"CCMSLIB00017280042","spectrum_index":34330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 192.0028 Da; putative annotation: N/A; putative formula: C5H8N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.1,"smiles":null,"spectrum_id":"CCMSLIB00017280044","spectrum_index":34331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 437.2073 Da; putative annotation: N/A; putative formula: C24H31N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.278,"smiles":null,"spectrum_id":"CCMSLIB00017280047","spectrum_index":34332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 365.5107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.581,"smiles":null,"spectrum_id":"CCMSLIB00017280050","spectrum_index":34333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxy_ cinnamic acid (delta mass: 78.0344 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.126,"smiles":null,"spectrum_id":"CCMSLIB00017280052","spectrum_index":34334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 177.0626 Da; putative annotation: N/A; putative formula: C3H3N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.175,"smiles":null,"spectrum_id":"CCMSLIB00017280055","spectrum_index":34335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 71.0356 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.127,"smiles":null,"spectrum_id":"CCMSLIB00017280057","spectrum_index":34336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 175.157 Da; putative annotation: N/A; putative formula: C5H17N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.264,"smiles":null,"spectrum_id":"CCMSLIB00017280060","spectrum_index":34337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Ile (delta mass: 147.0695 Da; putative annotation: Phenylalanine; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.24,"smiles":null,"spectrum_id":"CCMSLIB00017280063","spectrum_index":34338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 120.0589 Da; putative annotation: 2-(3-Hydroxyphenyl)ethanol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.147,"smiles":null,"spectrum_id":"CCMSLIB00017280066","spectrum_index":34339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 162.0521 Da; putative annotation: 2-(Hydroxymethyl)-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one; putative formula: C7H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.123,"smiles":null,"spectrum_id":"CCMSLIB00017280069","spectrum_index":34340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanylleucine (delta mass: 184.1212 Da; putative annotation: Ala-Ile; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.26,"smiles":null,"spectrum_id":"CCMSLIB00017280071","spectrum_index":34341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 240.0789 Da; putative annotation: Rhapontigenin; putative formula: C15H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.155,"smiles":null,"spectrum_id":"CCMSLIB00017280074","spectrum_index":34342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 250.1562 Da; putative annotation: 1(4H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-4,6-dihydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-; putative formula: C15H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.237,"smiles":null,"spectrum_id":"CCMSLIB00017280076","spectrum_index":34343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 120.0326 Da; putative annotation: 2-Aminonicotinic acid; putative formula: C6H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.192,"smiles":null,"spectrum_id":"CCMSLIB00017280079","spectrum_index":34344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 171.1145 Da; putative annotation: NG-Amino-L-arginine; putative formula: C6H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017280082","spectrum_index":34345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 164.0474 Da; putative annotation: 2,4-Dihydroxy-3,6-dimethylbenzoic acid; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.123,"smiles":null,"spectrum_id":"CCMSLIB00017280085","spectrum_index":34346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 70.0419 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017280086","spectrum_index":34347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 329.1556 Da; putative annotation: N/A; putative formula: C10H19N9O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.263,"smiles":null,"spectrum_id":"CCMSLIB00017280089","spectrum_index":34348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 14.9666 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.042,"smiles":null,"spectrum_id":"CCMSLIB00017280092","spectrum_index":34349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 342.1163 Da; putative annotation: N/A; putative formula: C12H22O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.181,"smiles":null,"spectrum_id":"CCMSLIB00017280095","spectrum_index":34350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 153.0312 Da; putative annotation: N/A; putative formula: C2H8N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.159,"smiles":null,"spectrum_id":"CCMSLIB00017280096","spectrum_index":34351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 36.0364 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.179,"smiles":null,"spectrum_id":"CCMSLIB00017280099","spectrum_index":34352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 67.042 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.102,"smiles":null,"spectrum_id":"CCMSLIB00017280102","spectrum_index":34353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 238.0891 Da; putative annotation: N/A; putative formula: C10H14N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.154,"smiles":null,"spectrum_id":"CCMSLIB00017280104","spectrum_index":34354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 34.0483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.14,"smiles":null,"spectrum_id":"CCMSLIB00017280106","spectrum_index":34355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110103 Terbutaline|5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol (delta mass: 150.1148 Da; putative annotation: N/A; putative formula: C9H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.259,"smiles":null,"spectrum_id":"CCMSLIB00017280109","spectrum_index":34356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 58.0061 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.145,"smiles":null,"spectrum_id":"CCMSLIB00017280112","spectrum_index":34357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 16.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.101,"smiles":null,"spectrum_id":"CCMSLIB00017280114","spectrum_index":34358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-5-HYDROXYTRYPTAMINE (delta mass: 134.0218 Da; putative annotation: N/A; putative formula: C4H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.135,"smiles":null,"spectrum_id":"CCMSLIB00017280116","spectrum_index":34359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 491.1797 Da; putative annotation: N/A; putative formula: C27H30N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.26,"smiles":null,"spectrum_id":"CCMSLIB00017280119","spectrum_index":34360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 76.03 Da; putative annotation: N/A; putative formula: H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.069,"smiles":null,"spectrum_id":"CCMSLIB00017280122","spectrum_index":34361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pistillarin (delta mass: 79.9587 Da; putative annotation: N/A; putative formula: H2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.156,"smiles":null,"spectrum_id":"CCMSLIB00017280123","spectrum_index":34362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 114.0314 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.113,"smiles":null,"spectrum_id":"CCMSLIB00017280126","spectrum_index":34363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 206.2043 Da; putative annotation: N/A; putative formula: C15H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.317,"smiles":null,"spectrum_id":"CCMSLIB00017280129","spectrum_index":34364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 343.1991 Da; putative annotation: N/A; putative formula: C17H29NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.27,"smiles":null,"spectrum_id":"CCMSLIB00017280132","spectrum_index":34365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000616 1H-indole-3-carboxylic acid (delta mass: 104.0622 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.117,"smiles":null,"spectrum_id":"CCMSLIB00017280133","spectrum_index":34366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of E-N-Deoxyfructosyllysine (delta mass: 324.1053 Da; putative annotation: N/A; putative formula: C10H16N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.271,"smiles":null,"spectrum_id":"CCMSLIB00017280136","spectrum_index":34367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannose 6-phosphate (delta mass: 292.2401 Da; putative annotation: N/A; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.277,"smiles":null,"spectrum_id":"CCMSLIB00017280139","spectrum_index":34368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 413.0831 Da; putative annotation: N/A; putative formula: C15H11N9O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.143,"smiles":null,"spectrum_id":"CCMSLIB00017280142","spectrum_index":34369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 117.0047 Da; putative annotation: N/A; putative formula: C7H3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.06,"smiles":null,"spectrum_id":"CCMSLIB00017280143","spectrum_index":34370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine 5'-triphosphate (delta mass: 132.0405 Da; putative annotation: N/A; putative formula: C9H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.044,"smiles":null,"spectrum_id":"CCMSLIB00017280146","spectrum_index":34371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 9.9851 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.077,"smiles":null,"spectrum_id":"CCMSLIB00017280149","spectrum_index":34372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2,5-Dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzoic acid (delta mass: 61.0205 Da; putative annotation: N/A; putative formula: H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.117,"smiles":null,"spectrum_id":"CCMSLIB00017280152","spectrum_index":34373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 691.4291 Da; putative annotation: N/A; putative formula: C51H53N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":854.489,"smiles":null,"spectrum_id":"CCMSLIB00017280154","spectrum_index":34374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Brasiliamide E (delta mass: 42.0115 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.208,"smiles":null,"spectrum_id":"CCMSLIB00017280157","spectrum_index":34375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 200.1437 Da; putative annotation: N/A; putative formula: C10H21N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.192,"smiles":null,"spectrum_id":"CCMSLIB00017280159","spectrum_index":34376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 143.0379 Da; putative annotation: N/A; putative formula: C2H5N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.13,"smiles":null,"spectrum_id":"CCMSLIB00017280162","spectrum_index":34377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 107.9954 Da; putative annotation: N/A; putative formula: C4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.082,"smiles":null,"spectrum_id":"CCMSLIB00017280165","spectrum_index":34378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 81.0211 Da; putative annotation: N/A; putative formula: C4H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.092,"smiles":null,"spectrum_id":"CCMSLIB00017280168","spectrum_index":34379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 283.162 Da; putative annotation: N/A; putative formula: C8H17N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.217,"smiles":null,"spectrum_id":"CCMSLIB00017280169","spectrum_index":34380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 124.0739 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.176,"smiles":null,"spectrum_id":"CCMSLIB00017280174","spectrum_index":34381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 214.0845 Da; putative annotation: N/A; putative formula: C10H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.218,"smiles":null,"spectrum_id":"CCMSLIB00017280175","spectrum_index":34382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 31.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.149,"smiles":null,"spectrum_id":"CCMSLIB00017280178","spectrum_index":34383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 162.0413 Da; putative annotation: N/A; putative formula: C2H7N6OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.112,"smiles":null,"spectrum_id":"CCMSLIB00017280181","spectrum_index":34384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Thienyl)-1H-imidazole (delta mass: 31.02 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.052,"smiles":null,"spectrum_id":"CCMSLIB00017280184","spectrum_index":34385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 828.3987 Da; putative annotation: N/A; putative formula: C43H64N4O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":979.459,"smiles":null,"spectrum_id":"CCMSLIB00017280187","spectrum_index":34386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 118.0326 Da; putative annotation: N/A; putative formula: C8H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.091,"smiles":null,"spectrum_id":"CCMSLIB00017280188","spectrum_index":34387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 27.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.133,"smiles":null,"spectrum_id":"CCMSLIB00017280191","spectrum_index":34388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 98.0388 Da; putative annotation: N/A; putative formula: C4H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.13,"smiles":null,"spectrum_id":"CCMSLIB00017280192","spectrum_index":34389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 115.0266 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.224,"smiles":null,"spectrum_id":"CCMSLIB00017280195","spectrum_index":34390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-8-(phenacylthio)-3,7-dihydropurin-6-one (delta mass: 121.1244 Da; putative annotation: N/A; putative formula: C9H15NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.195,"smiles":null,"spectrum_id":"CCMSLIB00017280196","spectrum_index":34391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 1.9719 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.074,"smiles":null,"spectrum_id":"CCMSLIB00017280199","spectrum_index":34392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-indol-3-yl)ethanamine (delta mass: 301.4657 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.573,"smiles":null,"spectrum_id":"CCMSLIB00017280202","spectrum_index":34393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 116.0625 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017280203","spectrum_index":34394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 809.2729 Da; putative annotation: N/A; putative formula: C42H43N5O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1314.45,"smiles":null,"spectrum_id":"CCMSLIB00017280206","spectrum_index":34395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 38.0157 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.076,"smiles":null,"spectrum_id":"CCMSLIB00017280207","spectrum_index":34396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 213.2453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.316,"smiles":null,"spectrum_id":"CCMSLIB00017280210","spectrum_index":34397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 84.166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.226,"smiles":null,"spectrum_id":"CCMSLIB00017280213","spectrum_index":34398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 110.1525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.248,"smiles":null,"spectrum_id":"CCMSLIB00017280214","spectrum_index":34399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 154.0995 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.201,"smiles":null,"spectrum_id":"CCMSLIB00017280217","spectrum_index":34400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 122.0363 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.102,"smiles":null,"spectrum_id":"CCMSLIB00017280220","spectrum_index":34401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 214.0482 Da; putative annotation: N/A; putative formula: C10H14OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.15,"smiles":null,"spectrum_id":"CCMSLIB00017280221","spectrum_index":34402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 106.0709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.163,"smiles":null,"spectrum_id":"CCMSLIB00017280224","spectrum_index":34403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 142.0743 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.161,"smiles":null,"spectrum_id":"CCMSLIB00017280227","spectrum_index":34404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 506.3023 Da; putative annotation: N/A; putative formula: C26H43N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.389,"smiles":null,"spectrum_id":"CCMSLIB00017280230","spectrum_index":34405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 527.1831 Da; putative annotation: N/A; putative formula: C25H37NO5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.243,"smiles":null,"spectrum_id":"CCMSLIB00017280231","spectrum_index":34406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-3-(2,4,6-trimethylphenyl)propanoic acid (delta mass: 86.0514 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.185,"smiles":null,"spectrum_id":"CCMSLIB00017280234","spectrum_index":34407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 443.376 Da; putative annotation: N/A; putative formula: C29H49NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.447,"smiles":null,"spectrum_id":"CCMSLIB00017280235","spectrum_index":34408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 234.0684 Da; putative annotation: N/A; putative formula: C11H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.129,"smiles":null,"spectrum_id":"CCMSLIB00017280238","spectrum_index":34409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 145.152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.239,"smiles":null,"spectrum_id":"CCMSLIB00017280240","spectrum_index":34410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Cyclohexylamino)acetic acid (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.112,"smiles":null,"spectrum_id":"CCMSLIB00017280242","spectrum_index":34411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 23.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.104,"smiles":null,"spectrum_id":"CCMSLIB00017280245","spectrum_index":34412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.226,"smiles":null,"spectrum_id":"CCMSLIB00017280247","spectrum_index":34413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP011101 Methyl trans-cinnamic acid|4-Methylcinnamic acid|(E)-3-(4-methylphenyl)prop-2-enoic acid (delta mass: 320.0879 Da; putative annotation: N/A; putative formula: C13H16N6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.163,"smiles":null,"spectrum_id":"CCMSLIB00017280249","spectrum_index":34414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101905 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 44.0181 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.104,"smiles":null,"spectrum_id":"CCMSLIB00017280252","spectrum_index":34415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 102.0683 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.222,"smiles":null,"spectrum_id":"CCMSLIB00017280255","spectrum_index":34416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU099405 8-Hydroxyquinoline|quinolin-8-ol (delta mass: 27.9964 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.056,"smiles":null,"spectrum_id":"CCMSLIB00017280258","spectrum_index":34417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 18.0098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.091,"smiles":null,"spectrum_id":"CCMSLIB00017280260","spectrum_index":34418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 341.7086 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.795,"smiles":null,"spectrum_id":"CCMSLIB00017280262","spectrum_index":34419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 191.0549 Da; putative annotation: N/A; putative formula: C6H13N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.152,"smiles":null,"spectrum_id":"CCMSLIB00017280265","spectrum_index":34420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 89.0533 Da; putative annotation: N/A; putative formula: C2H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.14,"smiles":null,"spectrum_id":"CCMSLIB00017280268","spectrum_index":34421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 72.0317 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.128,"smiles":null,"spectrum_id":"CCMSLIB00017280269","spectrum_index":34422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 40.0 eV (delta mass: 425.2311 Da; putative annotation: N/A; putative formula: C24H31N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.328,"smiles":null,"spectrum_id":"CCMSLIB00017280272","spectrum_index":34423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 29.0347 Da; putative annotation: N/A; putative formula: H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.147,"smiles":null,"spectrum_id":"CCMSLIB00017280275","spectrum_index":34424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Penten-1-ol, 5-phenyl-, (4E)- (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.164,"smiles":null,"spectrum_id":"CCMSLIB00017280276","spectrum_index":34425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 225.169 Da; putative annotation: N/A; putative formula: C9H19N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.244,"smiles":null,"spectrum_id":"CCMSLIB00017280279","spectrum_index":34426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrocinchonine (delta mass: 72.0201 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.216,"smiles":null,"spectrum_id":"CCMSLIB00017280282","spectrum_index":34427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 12.007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.094,"smiles":null,"spectrum_id":"CCMSLIB00017280285","spectrum_index":34428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Felbinac (delta mass: 28.009 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.1,"smiles":null,"spectrum_id":"CCMSLIB00017280286","spectrum_index":34429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 40.0312 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.201,"smiles":null,"spectrum_id":"CCMSLIB00017280289","spectrum_index":34430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 396.3062 Da; putative annotation: N/A; putative formula: C27H40O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1063.54,"smiles":null,"spectrum_id":"CCMSLIB00017280292","spectrum_index":34431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 512.353 Da; putative annotation: N/A; putative formula: C31H49N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1017.53,"smiles":null,"spectrum_id":"CCMSLIB00017280293","spectrum_index":34432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 397.2511 Da; putative annotation: N/A; putative formula: C19H35N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.322,"smiles":null,"spectrum_id":"CCMSLIB00017280296","spectrum_index":34433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 301.6983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.822,"smiles":null,"spectrum_id":"CCMSLIB00017280299","spectrum_index":34434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 234.1098 Da; putative annotation: N/A; putative formula: C10H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.207,"smiles":null,"spectrum_id":"CCMSLIB00017280300","spectrum_index":34435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 746.1854 Da; putative annotation: N/A; putative formula: C52H22N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":927.256,"smiles":null,"spectrum_id":"CCMSLIB00017280303","spectrum_index":34436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 21.9844 Da; putative annotation: N/A; putative formula: C2H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017280306","spectrum_index":34437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM823401 N-Butylbenzenesulfonamide (delta mass: 41.033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.123,"smiles":null,"spectrum_id":"CCMSLIB00017280309","spectrum_index":34438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 283.1483 Da; putative annotation: N/A; putative formula: C18H22NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.24,"smiles":null,"spectrum_id":"CCMSLIB00017280310","spectrum_index":34439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 216.1504 Da; putative annotation: N/A; putative formula: C15H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.221,"smiles":null,"spectrum_id":"CCMSLIB00017280313","spectrum_index":34440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 41.063 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.144,"smiles":null,"spectrum_id":"CCMSLIB00017280316","spectrum_index":34441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 146.0579 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.145,"smiles":null,"spectrum_id":"CCMSLIB00017280317","spectrum_index":34442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 210.0916 Da; putative annotation: N/A; putative formula: C10H15N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.245,"smiles":null,"spectrum_id":"CCMSLIB00017280320","spectrum_index":34443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of o-Phenylenediamine (delta mass: 44.0616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.138,"smiles":null,"spectrum_id":"CCMSLIB00017280323","spectrum_index":34444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine CollisionEnergy:102040 (delta mass: 130.8257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.912,"smiles":null,"spectrum_id":"CCMSLIB00017280325","spectrum_index":34445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 723.3535 Da; putative annotation: N/A; putative formula: C51H49NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":878.424,"smiles":null,"spectrum_id":"CCMSLIB00017280328","spectrum_index":34446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 242.203 Da; putative annotation: N/A; putative formula: C18H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.29,"smiles":null,"spectrum_id":"CCMSLIB00017280330","spectrum_index":34447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 170.0465 Da; putative annotation: N/A; putative formula: C4H7N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.165,"smiles":null,"spectrum_id":"CCMSLIB00017280333","spectrum_index":34448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 717.4461 Da; putative annotation: N/A; putative formula: C51H60NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.517,"smiles":null,"spectrum_id":"CCMSLIB00017280335","spectrum_index":34449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 51.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.138,"smiles":null,"spectrum_id":"CCMSLIB00017280337","spectrum_index":34450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 872.2194 Da; putative annotation: N/A; putative formula: C47H44N4O5S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1035.28,"smiles":null,"spectrum_id":"CCMSLIB00017280340","spectrum_index":34451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 18.0836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017280343","spectrum_index":34452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 150.083 Da; putative annotation: N/A; putative formula: C13H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.149,"smiles":null,"spectrum_id":"CCMSLIB00017280344","spectrum_index":34453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-glutamic acid (delta mass: 168.1148 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.17,"smiles":null,"spectrum_id":"CCMSLIB00017280347","spectrum_index":34454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 216.1725 Da; putative annotation: N/A; putative formula: C12H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.238,"smiles":null,"spectrum_id":"CCMSLIB00017280350","spectrum_index":34455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 38.0911 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.204,"smiles":null,"spectrum_id":"CCMSLIB00017280352","spectrum_index":34456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 73.879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.95,"smiles":null,"spectrum_id":"CCMSLIB00017280354","spectrum_index":34457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 178.0417 Da; putative annotation: N/A; putative formula: C13H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.191,"smiles":null,"spectrum_id":"CCMSLIB00017280357","spectrum_index":34458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 15.9948 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.087,"smiles":null,"spectrum_id":"CCMSLIB00017280360","spectrum_index":34459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 193.0592 Da; putative annotation: N/A; putative formula: C7H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.218,"smiles":null,"spectrum_id":"CCMSLIB00017280361","spectrum_index":34460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 653.2215 Da; putative annotation: N/A; putative formula: C45H27N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1320.45,"smiles":null,"spectrum_id":"CCMSLIB00017280364","spectrum_index":34461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 38.0517 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.237,"smiles":null,"spectrum_id":"CCMSLIB00017280367","spectrum_index":34462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 174.0478 Da; putative annotation: N/A; putative formula: C6H12N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.187,"smiles":null,"spectrum_id":"CCMSLIB00017280368","spectrum_index":34463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 123.0672 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.159,"smiles":null,"spectrum_id":"CCMSLIB00017280371","spectrum_index":34464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 61.9462 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.048,"smiles":null,"spectrum_id":"CCMSLIB00017280374","spectrum_index":34465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 121.0187 Da; putative annotation: N/A; putative formula: C5H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.152,"smiles":null,"spectrum_id":"CCMSLIB00017280376","spectrum_index":34466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Formyltryptophan (delta mass: 83.0368 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.129,"smiles":null,"spectrum_id":"CCMSLIB00017280378","spectrum_index":34467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 28.0157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.159,"smiles":null,"spectrum_id":"CCMSLIB00017280381","spectrum_index":34468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017280383","spectrum_index":34469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 28.0316 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.129,"smiles":null,"spectrum_id":"CCMSLIB00017280385","spectrum_index":34470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 61.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.207,"smiles":null,"spectrum_id":"CCMSLIB00017280388","spectrum_index":34471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 10.0207 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.196,"smiles":null,"spectrum_id":"CCMSLIB00017280391","spectrum_index":34472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[3-(2-Carboxyethyl)-4-methylpyrrol-2-methylidenyl]-2-indolinone (delta mass: 304.1423 Da; putative annotation: N/A; putative formula: C16H20N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.266,"smiles":null,"spectrum_id":"CCMSLIB00017280393","spectrum_index":34473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 11.0161 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.134,"smiles":null,"spectrum_id":"CCMSLIB00017280395","spectrum_index":34474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 207.1107 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.207,"smiles":null,"spectrum_id":"CCMSLIB00017280398","spectrum_index":34475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 62.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017280401","spectrum_index":34476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 380.1682 Da; putative annotation: N/A; putative formula: C16H28O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.239,"smiles":null,"spectrum_id":"CCMSLIB00017280403","spectrum_index":34477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-methoxyphenyl)propylamine CollisionEnergy:205060 (delta mass: 46.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.164,"smiles":null,"spectrum_id":"CCMSLIB00017280405","spectrum_index":34478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-4,4,6a,9,12b-pentamethyl-3,4,4a,6,6a,12,12a,12b-octahydro-2H,11H-benzo[f]pyrano[2,3-b]chromene-1,11(5H)-dione (delta mass: 53.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.248,"smiles":null,"spectrum_id":"CCMSLIB00017280408","spectrum_index":34479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 758.5772 Da; putative annotation: N/A; putative formula: C40H78N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":980.674,"smiles":null,"spectrum_id":"CCMSLIB00017280411","spectrum_index":34480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 62.0257 Da; putative annotation: N/A; putative formula: C4H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017280413","spectrum_index":34481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 152.1202 Da; putative annotation: N/A; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.191,"smiles":null,"spectrum_id":"CCMSLIB00017280416","spectrum_index":34482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 885.4726 Da; putative annotation: N/A; putative formula: C58H67N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1066.54,"smiles":null,"spectrum_id":"CCMSLIB00017280419","spectrum_index":34483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 318.0184 Da; putative annotation: N/A; putative formula: C9H19O4PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.105,"smiles":null,"spectrum_id":"CCMSLIB00017280421","spectrum_index":34484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 243.0894 Da; putative annotation: N/A; putative formula: C14H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.165,"smiles":null,"spectrum_id":"CCMSLIB00017280424","spectrum_index":34485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galanthamine (delta mass: 57.0284 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.188,"smiles":null,"spectrum_id":"CCMSLIB00017280426","spectrum_index":34486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 119.0735 Da; putative annotation: N/A; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.17,"smiles":null,"spectrum_id":"CCMSLIB00017280429","spectrum_index":34487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 239.0792 Da; putative annotation: N/A; putative formula: C11H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.176,"smiles":null,"spectrum_id":"CCMSLIB00017280432","spectrum_index":34488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 54.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.1,"smiles":null,"spectrum_id":"CCMSLIB00017280434","spectrum_index":34489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyluridine (delta mass: 9.9872 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.08,"smiles":null,"spectrum_id":"CCMSLIB00017280436","spectrum_index":34490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 86.0522 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017280439","spectrum_index":34491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 221.2507 Da; putative annotation: N/A; putative formula: C16H31NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.337,"smiles":null,"spectrum_id":"CCMSLIB00017280442","spectrum_index":34492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 26.9812 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.146,"smiles":null,"spectrum_id":"CCMSLIB00017280443","spectrum_index":34493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 138.1403 Da; putative annotation: N/A; putative formula: C10H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.227,"smiles":null,"spectrum_id":"CCMSLIB00017280446","spectrum_index":34494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(4-Fluorophenoxy)phenyl]-N-methylmethanamine (delta mass: 31.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017280449","spectrum_index":34495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 147.0685 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.218,"smiles":null,"spectrum_id":"CCMSLIB00017280450","spectrum_index":34496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 313.1167 Da; putative annotation: N/A; putative formula: C17H20N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.187,"smiles":null,"spectrum_id":"CCMSLIB00017280453","spectrum_index":34497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 169.1107 Da; putative annotation: N/A; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.186,"smiles":null,"spectrum_id":"CCMSLIB00017280456","spectrum_index":34498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 129.0432 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.156,"smiles":null,"spectrum_id":"CCMSLIB00017280457","spectrum_index":34499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Quinolinone, 3-bromo-8-methoxy-2-methyl- (delta mass: 29.0848 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.082,"smiles":null,"spectrum_id":"CCMSLIB00017280460","spectrum_index":34500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ticarcillin (delta mass: 35.0405 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.093,"smiles":null,"spectrum_id":"CCMSLIB00017280461","spectrum_index":34501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 520.9522 Da; putative annotation: N/A; putative formula: C25H15NS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.0,"smiles":null,"spectrum_id":"CCMSLIB00017280464","spectrum_index":34502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-(5-Fluoropentyl)-1H-indazole-3-carbonyl)-L-valine (delta mass: 391.3196 Da; putative annotation: N/A; putative formula: C23H41N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.507,"smiles":null,"spectrum_id":"CCMSLIB00017280467","spectrum_index":34503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 181.1828 Da; putative annotation: N/A; putative formula: C12H23N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.248,"smiles":null,"spectrum_id":"CCMSLIB00017280468","spectrum_index":34504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 64.0276 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.094,"smiles":null,"spectrum_id":"CCMSLIB00017280471","spectrum_index":34505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-5-carboxamide (delta mass: 29.0051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.076,"smiles":null,"spectrum_id":"CCMSLIB00017280474","spectrum_index":34506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lansoprazole (delta mass: 265.031 Da; putative annotation: N/A; putative formula: C14H7N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.114,"smiles":null,"spectrum_id":"CCMSLIB00017280475","spectrum_index":34507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 56.0779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.154,"smiles":null,"spectrum_id":"CCMSLIB00017280478","spectrum_index":34508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 397.2335 Da; putative annotation: N/A; putative formula: C19H35N5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.346,"smiles":null,"spectrum_id":"CCMSLIB00017280480","spectrum_index":34509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 905.5508 Da; putative annotation: N/A; putative formula: C63H67N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1086.62,"smiles":null,"spectrum_id":"CCMSLIB00017280482","spectrum_index":34510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 228.0631 Da; putative annotation: N/A; putative formula: C10H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.16,"smiles":null,"spectrum_id":"CCMSLIB00017280485","spectrum_index":34511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C4:0 (delta mass: 70.0417 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.249,"smiles":null,"spectrum_id":"CCMSLIB00017280487","spectrum_index":34512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 51.9976 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.102,"smiles":null,"spectrum_id":"CCMSLIB00017280489","spectrum_index":34513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 486.1903 Da; putative annotation: N/A; putative formula: C27H26N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":767.344,"smiles":null,"spectrum_id":"CCMSLIB00017280492","spectrum_index":34514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-arginine (delta mass: 161.0483 Da; putative annotation: N/A; putative formula: C9H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.178,"smiles":null,"spectrum_id":"CCMSLIB00017280495","spectrum_index":34515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 9.8928 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.984,"smiles":null,"spectrum_id":"CCMSLIB00017280498","spectrum_index":34516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100009 (R)-(-)-Phenylephrine|Neo-Synephrine|Metasympatol|Visadron|Mesaton|Mezaton|Metaoxedrine|m-Sympatol|m-Oxedrine|(R)-(?)-1-(3-Hydroxyphenyl)-2-methylaminoethanol|L-(3-Hydroxyphenyl)-N-methylethanolamine (delta mass: 151.0873 Da; putative annotation: N/A; putative formula: C6H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.189,"smiles":null,"spectrum_id":"CCMSLIB00017280499","spectrum_index":34517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Asp (delta mass: 157.0372 Da; putative annotation: N-Acetyl-L-aspartic acid; putative formula: C6H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.125,"smiles":null,"spectrum_id":"CCMSLIB00017280502","spectrum_index":34518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methylphenyl)-1H-indole (delta mass: 237.0375 Da; putative annotation: 2-(4-Chlorophenyl)-1H-indole-3-carbaldehyde; putative formula: C15H8ClN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.15,"smiles":null,"spectrum_id":"CCMSLIB00017280505","spectrum_index":34519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Pyridinyl)ethanol (delta mass: 114.0579 Da; putative annotation: 1H-Indol-2-amine; putative formula: C8H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.134,"smiles":null,"spectrum_id":"CCMSLIB00017280506","spectrum_index":34520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 268.0377 Da; putative annotation: 7,8,3',4'-Tetrahydroxyflavone; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.161,"smiles":null,"spectrum_id":"CCMSLIB00017280509","spectrum_index":34521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 132.0212 Da; putative annotation: 6-hydroxybenzofuran-3(2H)-one; putative formula: C8H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.102,"smiles":null,"spectrum_id":"CCMSLIB00017280512","spectrum_index":34522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 177.0637 Da; putative annotation: D-Glucosaminic acid; putative formula: C6H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.124,"smiles":null,"spectrum_id":"CCMSLIB00017280514","spectrum_index":34523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine CollisionEnergy:102040 (delta mass: 157.0526 Da; putative annotation: INDOLEACETIC ACID; putative formula: C10H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.149,"smiles":null,"spectrum_id":"CCMSLIB00017280516","spectrum_index":34524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 113.8288 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.894,"smiles":null,"spectrum_id":"CCMSLIB00017280519","spectrum_index":34525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 122.0394 Da; putative annotation: N/A; putative formula: C6H7N2O-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.11,"smiles":null,"spectrum_id":"CCMSLIB00017280522","spectrum_index":34526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 58.1036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017280523","spectrum_index":34527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 156.0691 Da; putative annotation: N/A; putative formula: C10H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.166,"smiles":null,"spectrum_id":"CCMSLIB00017280526","spectrum_index":34528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-methoxyphenyl)propylamine CollisionEnergy:102040 (delta mass: 184.1215 Da; putative annotation: N/A; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.244,"smiles":null,"spectrum_id":"CCMSLIB00017280528","spectrum_index":34529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 434.3026 Da; putative annotation: N/A; putative formula: C26H42O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.39,"smiles":null,"spectrum_id":"CCMSLIB00017280530","spectrum_index":34530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 317.2054 Da; putative annotation: N/A; putative formula: C15H32N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.276,"smiles":null,"spectrum_id":"CCMSLIB00017280533","spectrum_index":34531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 80.0698 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.165,"smiles":null,"spectrum_id":"CCMSLIB00017280535","spectrum_index":34532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 142.0416 Da; putative annotation: N/A; putative formula: C10H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.102,"smiles":null,"spectrum_id":"CCMSLIB00017280538","spectrum_index":34533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 202.063 Da; putative annotation: N/A; putative formula: C12H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.123,"smiles":null,"spectrum_id":"CCMSLIB00017280540","spectrum_index":34534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatinine (delta mass: 312.2298 Da; putative annotation: N/A; putative formula: C18H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.296,"smiles":null,"spectrum_id":"CCMSLIB00017280543","spectrum_index":34535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 18.0952 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.2,"smiles":null,"spectrum_id":"CCMSLIB00017280546","spectrum_index":34536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 11-[(3-Hydroxypropyl)amino]-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile (delta mass: 18.0547 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.21,"smiles":null,"spectrum_id":"CCMSLIB00017280549","spectrum_index":34537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 159.0796 Da; putative annotation: N/A; putative formula: C9H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.208,"smiles":null,"spectrum_id":"CCMSLIB00017280551","spectrum_index":34538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 32.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017280553","spectrum_index":34539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 617.2135 Da; putative annotation: N/A; putative formula: C32H27N9O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.274,"smiles":null,"spectrum_id":"CCMSLIB00017280556","spectrum_index":34540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 74.0249 Da; putative annotation: N/A; putative formula: C5H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.132,"smiles":null,"spectrum_id":"CCMSLIB00017280558","spectrum_index":34541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 273.148 Da; putative annotation: N/A; putative formula: C15H19N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.25,"smiles":null,"spectrum_id":"CCMSLIB00017280560","spectrum_index":34542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 65.0263 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.123,"smiles":null,"spectrum_id":"CCMSLIB00017280563","spectrum_index":34543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 15.9947 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.055,"smiles":null,"spectrum_id":"CCMSLIB00017280566","spectrum_index":34544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 147.0431 Da; putative annotation: N/A; putative formula: C7H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.124,"smiles":null,"spectrum_id":"CCMSLIB00017280569","spectrum_index":34545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Imidazol-1-ylmethyl)benzoic acid (delta mass: 96.0459 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.127,"smiles":null,"spectrum_id":"CCMSLIB00017280570","spectrum_index":34546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 55.0068 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.087,"smiles":null,"spectrum_id":"CCMSLIB00017280573","spectrum_index":34547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 44.0191 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.11,"smiles":null,"spectrum_id":"CCMSLIB00017280576","spectrum_index":34548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 373.1961 Da; putative annotation: N/A; putative formula: C15H27N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.283,"smiles":null,"spectrum_id":"CCMSLIB00017280577","spectrum_index":34549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 852.894 Da; putative annotation: N/A; putative formula: C60H117O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1074.99,"smiles":null,"spectrum_id":"CCMSLIB00017280580","spectrum_index":34550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 819.3007 Da; putative annotation: N/A; putative formula: C32H53NO23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":982.361,"smiles":null,"spectrum_id":"CCMSLIB00017280583","spectrum_index":34551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 204.093 Da; putative annotation: N/A; putative formula: C10H13N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.19,"smiles":null,"spectrum_id":"CCMSLIB00017280584","spectrum_index":34552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 269.6825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.769,"smiles":null,"spectrum_id":"CCMSLIB00017280587","spectrum_index":34553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 90.0832 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.242,"smiles":null,"spectrum_id":"CCMSLIB00017280588","spectrum_index":34554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 14.0267 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.087,"smiles":null,"spectrum_id":"CCMSLIB00017280591","spectrum_index":34555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 17.44 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017280594","spectrum_index":34556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 176.0946 Da; putative annotation: N/A; putative formula: C10H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.17,"smiles":null,"spectrum_id":"CCMSLIB00017280595","spectrum_index":34557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 138.0826 Da; putative annotation: N/A; putative formula: C12H10O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.138,"smiles":null,"spectrum_id":"CCMSLIB00017280598","spectrum_index":34558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 125.0829 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.18,"smiles":null,"spectrum_id":"CCMSLIB00017280601","spectrum_index":34559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 138.0022 Da; putative annotation: N/A; putative formula: H2N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.114,"smiles":null,"spectrum_id":"CCMSLIB00017280603","spectrum_index":34560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 142.0639 Da; putative annotation: N/A; putative formula: C8H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.156,"smiles":null,"spectrum_id":"CCMSLIB00017280605","spectrum_index":34561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etoformin (delta mass: 40.0456 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.217,"smiles":null,"spectrum_id":"CCMSLIB00017280608","spectrum_index":34562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 7.9679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.065,"smiles":null,"spectrum_id":"CCMSLIB00017280610","spectrum_index":34563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 332.135 Da; putative annotation: N/A; putative formula: C21H20N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.211,"smiles":null,"spectrum_id":"CCMSLIB00017280612","spectrum_index":34564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 306.1039 Da; putative annotation: N/A; putative formula: C15H18N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.185,"smiles":null,"spectrum_id":"CCMSLIB00017280615","spectrum_index":34565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tapentadol (delta mass: 15.9951 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.18,"smiles":null,"spectrum_id":"CCMSLIB00017280617","spectrum_index":34566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cassythicine (delta mass: 377.1225 Da; putative annotation: N/A; putative formula: C17H19N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.261,"smiles":null,"spectrum_id":"CCMSLIB00017280619","spectrum_index":34567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 615.3978 Da; putative annotation: N/A; putative formula: C45H49N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.526,"smiles":null,"spectrum_id":"CCMSLIB00017280622","spectrum_index":34568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 234.096 Da; putative annotation: N/A; putative formula: C17H15O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.25,"smiles":null,"spectrum_id":"CCMSLIB00017280625","spectrum_index":34569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 198.1617 Da; putative annotation: N/A; putative formula: C12H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.232,"smiles":null,"spectrum_id":"CCMSLIB00017280626","spectrum_index":34570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 289.0842 Da; putative annotation: N/A; putative formula: C14H15N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.218,"smiles":null,"spectrum_id":"CCMSLIB00017280629","spectrum_index":34571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 226.1061 Da; putative annotation: N/A; putative formula: C11H19N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.255,"smiles":null,"spectrum_id":"CCMSLIB00017280632","spectrum_index":34572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 92.0622 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017280633","spectrum_index":34573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 52.0675 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.226,"smiles":null,"spectrum_id":"CCMSLIB00017280636","spectrum_index":34574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)(3-fluorophenyl)amine (delta mass: 137.0541 Da; putative annotation: N/A; putative formula: CH7N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.184,"smiles":null,"spectrum_id":"CCMSLIB00017280639","spectrum_index":34575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine hydrochloride (delta mass: 134.0695 Da; putative annotation: N/A; putative formula: C4H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.148,"smiles":null,"spectrum_id":"CCMSLIB00017280640","spectrum_index":34576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (1S,2S,16E)-16-ethylidene-2-(hydroxymethyl)-4,14-diazatetracyclo[12.2.2.0,.0?,?]octadeca-3(11),5,7,9-tetraene-2-carboxylate (delta mass: 13.0137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.215,"smiles":null,"spectrum_id":"CCMSLIB00017280643","spectrum_index":34577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 94.0284 Da; putative annotation: N/A; putative formula: C3H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.136,"smiles":null,"spectrum_id":"CCMSLIB00017280646","spectrum_index":34578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of phenylethanolamine - 40.0 eV (delta mass: 8.8886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.98,"smiles":null,"spectrum_id":"CCMSLIB00017280647","spectrum_index":34579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 194.0099 Da; putative annotation: N/A; putative formula: C6H14O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.07,"smiles":null,"spectrum_id":"CCMSLIB00017280650","spectrum_index":34580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4,6-difluoro-1H-indole-2-carboxylate (delta mass: 16.9982 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.05,"smiles":null,"spectrum_id":"CCMSLIB00017280653","spectrum_index":34581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 307.1997 Da; putative annotation: N/A; putative formula: C14H29NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.302,"smiles":null,"spectrum_id":"CCMSLIB00017280654","spectrum_index":34582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 381.2537 Da; putative annotation: N/A; putative formula: C14H37N7OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.324,"smiles":null,"spectrum_id":"CCMSLIB00017280657","spectrum_index":34583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 333.3229 Da; putative annotation: N/A; putative formula: C20H39N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.425,"smiles":null,"spectrum_id":"CCMSLIB00017280660","spectrum_index":34584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 60.0433 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.339,"smiles":null,"spectrum_id":"CCMSLIB00017280661","spectrum_index":34585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 86.0477 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.197,"smiles":null,"spectrum_id":"CCMSLIB00017280664","spectrum_index":34586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol CollisionEnergy:102040 (delta mass: 8.9375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.013,"smiles":null,"spectrum_id":"CCMSLIB00017280666","spectrum_index":34587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 17.9196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.0,"smiles":null,"spectrum_id":"CCMSLIB00017280668","spectrum_index":34588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 63.9731 Da; putative annotation: N/A; putative formula: HO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.06,"smiles":null,"spectrum_id":"CCMSLIB00017280671","spectrum_index":34589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 28.0192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017280672","spectrum_index":34590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 50.0267 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.107,"smiles":null,"spectrum_id":"CCMSLIB00017280675","spectrum_index":34591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Cyclohexylmethyl)ethanamine (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.18,"smiles":null,"spectrum_id":"CCMSLIB00017280678","spectrum_index":34592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N,N'-DIACETYL-1,6-DIAMINOHEXANE\"\" (delta mass: 278.2609 Da; putative annotation: N/A; putative formula: C19H34O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.421,"smiles":null,"spectrum_id":"CCMSLIB00017280679","spectrum_index":34593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 224.1133 Da; putative annotation: N/A; putative formula: C7H12N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.175,"smiles":null,"spectrum_id":"CCMSLIB00017280682","spectrum_index":34594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371101 Imazaquin|2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)quinoline-3-carboxylic acid (delta mass: 180.0732 Da; putative annotation: N/A; putative formula: C2H4N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.207,"smiles":null,"spectrum_id":"CCMSLIB00017280684","spectrum_index":34595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 191.0399 Da; putative annotation: N/A; putative formula: C2H5N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.105,"smiles":null,"spectrum_id":"CCMSLIB00017280686","spectrum_index":34596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 128.0472 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.129,"smiles":null,"spectrum_id":"CCMSLIB00017280689","spectrum_index":34597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 89.0249 Da; putative annotation: N/A; putative formula: H4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.097,"smiles":null,"spectrum_id":"CCMSLIB00017280691","spectrum_index":34598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 26.9833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.049,"smiles":null,"spectrum_id":"CCMSLIB00017280693","spectrum_index":34599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 303.1109 Da; putative annotation: N/A; putative formula: C16H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.281,"smiles":null,"spectrum_id":"CCMSLIB00017280696","spectrum_index":34600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 114.0169 Da; putative annotation: N/A; putative formula: C2H2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.088,"smiles":null,"spectrum_id":"CCMSLIB00017280698","spectrum_index":34601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 26.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.087,"smiles":null,"spectrum_id":"CCMSLIB00017280700","spectrum_index":34602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 486.227 Da; putative annotation: N/A; putative formula: C28H30N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.313,"smiles":null,"spectrum_id":"CCMSLIB00017280703","spectrum_index":34603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 35.0354 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.101,"smiles":null,"spectrum_id":"CCMSLIB00017280705","spectrum_index":34604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 27.9453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.042,"smiles":null,"spectrum_id":"CCMSLIB00017280707","spectrum_index":34605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 12.0241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.11,"smiles":null,"spectrum_id":"CCMSLIB00017280710","spectrum_index":34606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 2.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.151,"smiles":null,"spectrum_id":"CCMSLIB00017280712","spectrum_index":34607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 22.0201 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.031,"smiles":null,"spectrum_id":"CCMSLIB00017280714","spectrum_index":34608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine (delta mass: 65.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.164,"smiles":null,"spectrum_id":"CCMSLIB00017280717","spectrum_index":34609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 471.1903 Da; putative annotation: N/A; putative formula: C26H33NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":855.34,"smiles":null,"spectrum_id":"CCMSLIB00017280719","spectrum_index":34610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 367.053 Da; putative annotation: N/A; putative formula: C20H9N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.124,"smiles":null,"spectrum_id":"CCMSLIB00017280721","spectrum_index":34611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 73.0634 Da; putative annotation: N/A; putative formula: C2H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.197,"smiles":null,"spectrum_id":"CCMSLIB00017280724","spectrum_index":34612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 190.1424 Da; putative annotation: N/A; putative formula: C7H18N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.302,"smiles":null,"spectrum_id":"CCMSLIB00017280726","spectrum_index":34613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 156.0633 Da; putative annotation: N/A; putative formula: C8H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017280728","spectrum_index":34614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 299.1935 Da; putative annotation: N/A; putative formula: C16H31NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.326,"smiles":null,"spectrum_id":"CCMSLIB00017280731","spectrum_index":34615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 78.0356 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.185,"smiles":null,"spectrum_id":"CCMSLIB00017280733","spectrum_index":34616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 80.0263 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017280736","spectrum_index":34617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citromycetin (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.045,"smiles":null,"spectrum_id":"CCMSLIB00017280739","spectrum_index":34618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005782 Harmane|1-methyl-9H-pyrido[3,4-b]indole (delta mass: 43.0016 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.093,"smiles":null,"spectrum_id":"CCMSLIB00017280741","spectrum_index":34619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 114.0466 Da; putative annotation: N/A; putative formula: C9H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.18,"smiles":null,"spectrum_id":"CCMSLIB00017280744","spectrum_index":34620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 128.0234 Da; putative annotation: N/A; putative formula: C5N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.11,"smiles":null,"spectrum_id":"CCMSLIB00017280746","spectrum_index":34621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 89.0471 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.107,"smiles":null,"spectrum_id":"CCMSLIB00017280749","spectrum_index":34622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 30.9601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.151,"smiles":null,"spectrum_id":"CCMSLIB00017280752","spectrum_index":34623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltotriose from NIST14 (delta mass: 316.2402 Da; putative annotation: N/A; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":821.417,"smiles":null,"spectrum_id":"CCMSLIB00017280755","spectrum_index":34624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000501 5-methoxyindole-3-carbaldehyde (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.065,"smiles":null,"spectrum_id":"CCMSLIB00017280756","spectrum_index":34625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 181.1122 Da; putative annotation: N/A; putative formula: C9H16N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.219,"smiles":null,"spectrum_id":"CCMSLIB00017280759","spectrum_index":34626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 163.0712 Da; putative annotation: N/A; putative formula: C4H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.21,"smiles":null,"spectrum_id":"CCMSLIB00017280762","spectrum_index":34627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 60.0 eV (delta mass: 115.8974 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.0,"smiles":null,"spectrum_id":"CCMSLIB00017280764","spectrum_index":34628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Glu Phe from METLIN (delta mass: 97.0537 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.182,"smiles":null,"spectrum_id":"CCMSLIB00017280766","spectrum_index":34629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.26,"smiles":null,"spectrum_id":"CCMSLIB00017280769","spectrum_index":34630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzenamine, 3-(1H-imidazol-1-ylmethyl)- (delta mass: 50.0242 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.127,"smiles":null,"spectrum_id":"CCMSLIB00017280772","spectrum_index":34631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 81.0578 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017280774","spectrum_index":34632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 72.0366 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.154,"smiles":null,"spectrum_id":"CCMSLIB00017280776","spectrum_index":34633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 102.0399 Da; putative annotation: N/A; putative formula: C3H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.116,"smiles":null,"spectrum_id":"CCMSLIB00017280779","spectrum_index":34634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 428.3665 Da; putative annotation: N/A; putative formula: C29H48O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.462,"smiles":null,"spectrum_id":"CCMSLIB00017280782","spectrum_index":34635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 59.0192 Da; putative annotation: N/A; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.107,"smiles":null,"spectrum_id":"CCMSLIB00017280783","spectrum_index":34636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 179.0784 Da; putative annotation: N/A; putative formula: C3H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.144,"smiles":null,"spectrum_id":"CCMSLIB00017280786","spectrum_index":34637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 35.007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.118,"smiles":null,"spectrum_id":"CCMSLIB00017280788","spectrum_index":34638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine CollisionEnergy:102040 (delta mass: 126.0347 Da; putative annotation: N/A; putative formula: C5H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.131,"smiles":null,"spectrum_id":"CCMSLIB00017280791","spectrum_index":34639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 128.0425 Da; putative annotation: N/A; putative formula: C5H8N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.118,"smiles":null,"spectrum_id":"CCMSLIB00017280793","spectrum_index":34640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 259.1419 Da; putative annotation: N/A; putative formula: C12H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.213,"smiles":null,"spectrum_id":"CCMSLIB00017280796","spectrum_index":34641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1242.5973 Da; putative annotation: N/A; putative formula: C66H78N14O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1435.67,"smiles":null,"spectrum_id":"CCMSLIB00017280798","spectrum_index":34642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 82.0275 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.088,"smiles":null,"spectrum_id":"CCMSLIB00017280801","spectrum_index":34643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 2.132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.247,"smiles":null,"spectrum_id":"CCMSLIB00017280804","spectrum_index":34644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 158.1096 Da; putative annotation: N/A; putative formula: C12H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017280805","spectrum_index":34645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 51.0473 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.17,"smiles":null,"spectrum_id":"CCMSLIB00017280808","spectrum_index":34646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.149,"smiles":null,"spectrum_id":"CCMSLIB00017280810","spectrum_index":34647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 16.0356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.101,"smiles":null,"spectrum_id":"CCMSLIB00017280812","spectrum_index":34648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSAMINE (delta mass: 168.0905 Da; putative annotation: N/A; putative formula: C8H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.177,"smiles":null,"spectrum_id":"CCMSLIB00017280815","spectrum_index":34649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 44.0608 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.147,"smiles":null,"spectrum_id":"CCMSLIB00017280818","spectrum_index":34650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 209.0895 Da; putative annotation: N/A; putative formula: C7H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.139,"smiles":null,"spectrum_id":"CCMSLIB00017280819","spectrum_index":34651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 195.0725 Da; putative annotation: N/A; putative formula: C3H5N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.143,"smiles":null,"spectrum_id":"CCMSLIB00017280822","spectrum_index":34652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 244.2614 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.379,"smiles":null,"spectrum_id":"CCMSLIB00017280824","spectrum_index":34653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 319.2357 Da; putative annotation: N/A; putative formula: C16H33NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.306,"smiles":null,"spectrum_id":"CCMSLIB00017280826","spectrum_index":34654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 40.0309 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.154,"smiles":null,"spectrum_id":"CCMSLIB00017280829","spectrum_index":34655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 944.5003 Da; putative annotation: N/A; putative formula: C47H76O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1107.56,"smiles":null,"spectrum_id":"CCMSLIB00017280832","spectrum_index":34656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 116.0627 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.149,"smiles":null,"spectrum_id":"CCMSLIB00017280834","spectrum_index":34657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 722.4283 Da; putative annotation: N/A; putative formula: C42H50N12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":877.499,"smiles":null,"spectrum_id":"CCMSLIB00017280836","spectrum_index":34658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 449.2415 Da; putative annotation: N/A; putative formula: C24H35NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.312,"smiles":null,"spectrum_id":"CCMSLIB00017280839","spectrum_index":34659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 939.52 Da; putative annotation: N/A; putative formula: C49H73N5O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1120.59,"smiles":null,"spectrum_id":"CCMSLIB00017280842","spectrum_index":34660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 66.0459 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.205,"smiles":null,"spectrum_id":"CCMSLIB00017280843","spectrum_index":34661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of stepharine (delta mass: 45.0779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.222,"smiles":null,"spectrum_id":"CCMSLIB00017280846","spectrum_index":34662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 105.05 Da; putative annotation: N/A; putative formula: CH7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.128,"smiles":null,"spectrum_id":"CCMSLIB00017280849","spectrum_index":34663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 45.6421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.838,"smiles":null,"spectrum_id":"CCMSLIB00017280851","spectrum_index":34664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-(2-Ethylphenyl)prop-2-enoic acid (delta mass: 74.0366 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017280853","spectrum_index":34665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 27.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.186,"smiles":null,"spectrum_id":"CCMSLIB00017280856","spectrum_index":34666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 919.5285 Da; putative annotation: N/A; putative formula: C62H69N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.57,"smiles":null,"spectrum_id":"CCMSLIB00017280857","spectrum_index":34667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-indole-3-carbaldehyde (delta mass: 164.1412 Da; putative annotation: N/A; putative formula: C9H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.217,"smiles":null,"spectrum_id":"CCMSLIB00017280860","spectrum_index":34668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.092,"smiles":null,"spectrum_id":"CCMSLIB00017280863","spectrum_index":34669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 34.0203 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.169,"smiles":null,"spectrum_id":"CCMSLIB00017280865","spectrum_index":34670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.108,"smiles":null,"spectrum_id":"CCMSLIB00017280868","spectrum_index":34671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 68.9871 Da; putative annotation: N/A; putative formula: CN3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.014,"smiles":null,"spectrum_id":"CCMSLIB00017280870","spectrum_index":34672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 94.0407 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.1,"smiles":null,"spectrum_id":"CCMSLIB00017280873","spectrum_index":34673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 319.1129 Da; putative annotation: N/A; putative formula: C10H17N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.172,"smiles":null,"spectrum_id":"CCMSLIB00017280876","spectrum_index":34674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 45.0215 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.138,"smiles":null,"spectrum_id":"CCMSLIB00017280879","spectrum_index":34675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 170.0612 Da; putative annotation: N/A; putative formula: C7H11N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017280882","spectrum_index":34676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 273.1366 Da; putative annotation: N/A; putative formula: C16H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.218,"smiles":null,"spectrum_id":"CCMSLIB00017280884","spectrum_index":34677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 316.1888 Da; putative annotation: N/A; putative formula: C16H28O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.358,"smiles":null,"spectrum_id":"CCMSLIB00017280887","spectrum_index":34678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cycloheptanol (delta mass: 86.055 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.167,"smiles":null,"spectrum_id":"CCMSLIB00017280889","spectrum_index":34679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 181.9983 Da; putative annotation: N/A; putative formula: C4H7O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.126,"smiles":null,"spectrum_id":"CCMSLIB00017280892","spectrum_index":34680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzoylecgonine (delta mass: 113.0593 Da; putative annotation: N/A; putative formula: C4H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.198,"smiles":null,"spectrum_id":"CCMSLIB00017280895","spectrum_index":34681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 178.1072 Da; putative annotation: N/A; putative formula: C5H14N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.23,"smiles":null,"spectrum_id":"CCMSLIB00017280897","spectrum_index":34682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 114.0678 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.128,"smiles":null,"spectrum_id":"CCMSLIB00017280900","spectrum_index":34683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 15.0318 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.09,"smiles":null,"spectrum_id":"CCMSLIB00017280902","spectrum_index":34684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 33.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017280905","spectrum_index":34685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 188.1048 Da; putative annotation: N/A; putative formula: C9H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.197,"smiles":null,"spectrum_id":"CCMSLIB00017280907","spectrum_index":34686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 207.1023 Da; putative annotation: N/A; putative formula: C8H18NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.183,"smiles":null,"spectrum_id":"CCMSLIB00017280910","spectrum_index":34687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 61.0164 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017280913","spectrum_index":34688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 236.1166 Da; putative annotation: N/A; putative formula: C12H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.192,"smiles":null,"spectrum_id":"CCMSLIB00017280915","spectrum_index":34689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 300.1317 Da; putative annotation: N/A; putative formula: C15H25O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.245,"smiles":null,"spectrum_id":"CCMSLIB00017280918","spectrum_index":34690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 126.0315 Da; putative annotation: 2-(2,2,2-Trifluoroethoxy)ethanol; putative formula: C4H5F3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.102,"smiles":null,"spectrum_id":"CCMSLIB00017280921","spectrum_index":34691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Mannitol from NIST14 (delta mass: 270.2349 Da; putative annotation: 15-Stachen-19-ol; putative formula: C20H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.321,"smiles":null,"spectrum_id":"CCMSLIB00017280923","spectrum_index":34692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 160.0523 Da; putative annotation: (3E)-4-(3,4-Dihydroxyphenyl)-3-buten-2-one; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.117,"smiles":null,"spectrum_id":"CCMSLIB00017280925","spectrum_index":34693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 103.0417 Da; putative annotation: Benzamide; putative formula: C7H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.164,"smiles":null,"spectrum_id":"CCMSLIB00017280928","spectrum_index":34694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 139.0997 Da; putative annotation: 2-[1-(Aminomethyl)cyclopentyl]acetic acid; putative formula: C8H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.233,"smiles":null,"spectrum_id":"CCMSLIB00017280931","spectrum_index":34695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 176.0869 Da; putative annotation: Galiellalactone; putative formula: C11H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.183,"smiles":null,"spectrum_id":"CCMSLIB00017280933","spectrum_index":34696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 164.0361 Da; putative annotation: 1-Methyluric acid; putative formula: C6H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017280935","spectrum_index":34697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 314.2606 Da; putative annotation: cis-4,10,13,16-Docosatetraenoic acid; putative formula: C22H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.347,"smiles":null,"spectrum_id":"CCMSLIB00017280938","spectrum_index":34698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ethylimidazoleacetic acid (delta mass: 104.036 Da; putative annotation: N/A; putative formula: C6H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.102,"smiles":null,"spectrum_id":"CCMSLIB00017280940","spectrum_index":34699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 150.0406 Da; putative annotation: N/A; putative formula: C3H2N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.127,"smiles":null,"spectrum_id":"CCMSLIB00017280942","spectrum_index":34700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 44.9801 Da; putative annotation: N/A; putative formula: NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.062,"smiles":null,"spectrum_id":"CCMSLIB00017280945","spectrum_index":34701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 103.052 Da; putative annotation: N/A; putative formula: C6H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.159,"smiles":null,"spectrum_id":"CCMSLIB00017280946","spectrum_index":34702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 241.1433 Da; putative annotation: N/A; putative formula: C12H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.298,"smiles":null,"spectrum_id":"CCMSLIB00017280949","spectrum_index":34703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 32.0114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.202,"smiles":null,"spectrum_id":"CCMSLIB00017280952","spectrum_index":34704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 61.9997 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.07,"smiles":null,"spectrum_id":"CCMSLIB00017280953","spectrum_index":34705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 70.0509 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.21,"smiles":null,"spectrum_id":"CCMSLIB00017280956","spectrum_index":34706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 72.0223 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.108,"smiles":null,"spectrum_id":"CCMSLIB00017280958","spectrum_index":34707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 530.3952 Da; putative annotation: N/A; putative formula: C37H54S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.482,"smiles":null,"spectrum_id":"CCMSLIB00017280960","spectrum_index":34708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 275.1016 Da; putative annotation: N/A; putative formula: C12H21NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.198,"smiles":null,"spectrum_id":"CCMSLIB00017280963","spectrum_index":34709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 179.0857 Da; putative annotation: N/A; putative formula: C10H14NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.181,"smiles":null,"spectrum_id":"CCMSLIB00017280965","spectrum_index":34710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 281.1264 Da; putative annotation: N/A; putative formula: C14H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.213,"smiles":null,"spectrum_id":"CCMSLIB00017280967","spectrum_index":34711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 65.0399 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.143,"smiles":null,"spectrum_id":"CCMSLIB00017280970","spectrum_index":34712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 56.0598 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.177,"smiles":null,"spectrum_id":"CCMSLIB00017280973","spectrum_index":34713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 55.0349 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.094,"smiles":null,"spectrum_id":"CCMSLIB00017280974","spectrum_index":34714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 765.4671 Da; putative annotation: N/A; putative formula: C42H63N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.538,"smiles":null,"spectrum_id":"CCMSLIB00017280977","spectrum_index":34715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 823.2977 Da; putative annotation: N/A; putative formula: C56H38N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1004.34,"smiles":null,"spectrum_id":"CCMSLIB00017280980","spectrum_index":34716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,4'-Dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl)butanoic acid (delta mass: 17.0147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.284,"smiles":null,"spectrum_id":"CCMSLIB00017280981","spectrum_index":34717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 181.0367 Da; putative annotation: N/A; putative formula: C2H8N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.097,"smiles":null,"spectrum_id":"CCMSLIB00017280984","spectrum_index":34718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 323.1558 Da; putative annotation: N/A; putative formula: C17H25NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.294,"smiles":null,"spectrum_id":"CCMSLIB00017280987","spectrum_index":34719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 125.0085 Da; putative annotation: N/A; putative formula: CH-1N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.168,"smiles":null,"spectrum_id":"CCMSLIB00017280988","spectrum_index":34720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 182.0369 Da; putative annotation: N/A; putative formula: C12H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.129,"smiles":null,"spectrum_id":"CCMSLIB00017280991","spectrum_index":34721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 120.0578 Da; putative annotation: N/A; putative formula: C8H8O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.118,"smiles":null,"spectrum_id":"CCMSLIB00017280993","spectrum_index":34722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 145.0625 Da; putative annotation: N/A; putative formula: C8H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017280995","spectrum_index":34723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 330.131 Da; putative annotation: N/A; putative formula: C15H22O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.17,"smiles":null,"spectrum_id":"CCMSLIB00017280998","spectrum_index":34724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 71.0723 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.196,"smiles":null,"spectrum_id":"CCMSLIB00017281001","spectrum_index":34725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 495.2694 Da; putative annotation: N/A; putative formula: C23H37N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.356,"smiles":null,"spectrum_id":"CCMSLIB00017281004","spectrum_index":34726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Communesin A (delta mass: 43.993 Da; putative annotation: N/A; putative formula: HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.253,"smiles":null,"spectrum_id":"CCMSLIB00017281005","spectrum_index":34727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 280.2393 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.305,"smiles":null,"spectrum_id":"CCMSLIB00017281008","spectrum_index":34728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 433.3815 Da; putative annotation: N/A; putative formula: C30H47N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.452,"smiles":null,"spectrum_id":"CCMSLIB00017281011","spectrum_index":34729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 19.0305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.179,"smiles":null,"spectrum_id":"CCMSLIB00017281012","spectrum_index":34730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 733.2539 Da; putative annotation: N/A; putative formula: C43H35N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":955.351,"smiles":null,"spectrum_id":"CCMSLIB00017281015","spectrum_index":34731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 43.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017281018","spectrum_index":34732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 13.0803 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.151,"smiles":null,"spectrum_id":"CCMSLIB00017281020","spectrum_index":34733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroluciferin (delta mass: 176.0429 Da; putative annotation: N/A; putative formula: C5H8N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.032,"smiles":null,"spectrum_id":"CCMSLIB00017281022","spectrum_index":34734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 75.0454 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017281025","spectrum_index":34735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 214.1932 Da; putative annotation: N/A; putative formula: C13H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.29,"smiles":null,"spectrum_id":"CCMSLIB00017281028","spectrum_index":34736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 45.0484 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.213,"smiles":null,"spectrum_id":"CCMSLIB00017281029","spectrum_index":34737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 4.9906 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":115.051,"smiles":null,"spectrum_id":"CCMSLIB00017281032","spectrum_index":34738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 158.0775 Da; putative annotation: N/A; putative formula: CH6N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.174,"smiles":null,"spectrum_id":"CCMSLIB00017281035","spectrum_index":34739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 101.0472 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.197,"smiles":null,"spectrum_id":"CCMSLIB00017281036","spectrum_index":34740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 208.1101 Da; putative annotation: N/A; putative formula: C12H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.207,"smiles":null,"spectrum_id":"CCMSLIB00017281039","spectrum_index":34741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 8.0059 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.066,"smiles":null,"spectrum_id":"CCMSLIB00017281042","spectrum_index":34742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 50.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.124,"smiles":null,"spectrum_id":"CCMSLIB00017281045","spectrum_index":34743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 316.0758 Da; putative annotation: N/A; putative formula: C10H23O5P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.24,"smiles":null,"spectrum_id":"CCMSLIB00017281047","spectrum_index":34744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 940.4714 Da; putative annotation: N/A; putative formula: C50H60N12O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1121.54,"smiles":null,"spectrum_id":"CCMSLIB00017281049","spectrum_index":34745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 19.016 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.12,"smiles":null,"spectrum_id":"CCMSLIB00017281052","spectrum_index":34746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 53.0267 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.139,"smiles":null,"spectrum_id":"CCMSLIB00017281055","spectrum_index":34747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 269.7465 Da; putative annotation: N/A; putative formula: H-1O-1PS8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.818,"smiles":null,"spectrum_id":"CCMSLIB00017281057","spectrum_index":34748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 45.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.128,"smiles":null,"spectrum_id":"CCMSLIB00017281059","spectrum_index":34749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 222.0759 Da; putative annotation: N/A; putative formula: C9H10N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.235,"smiles":null,"spectrum_id":"CCMSLIB00017281062","spectrum_index":34750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 117.0426 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.166,"smiles":null,"spectrum_id":"CCMSLIB00017281065","spectrum_index":34751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 284.1748 Da; putative annotation: N/A; putative formula: C15H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.367,"smiles":null,"spectrum_id":"CCMSLIB00017281066","spectrum_index":34752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 534.2668 Da; putative annotation: N/A; putative formula: C30H38N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.39,"smiles":null,"spectrum_id":"CCMSLIB00017281069","spectrum_index":34753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(6,7-diethoxy(1,2,3,4-tetrahydroisoquinolyl))-2,4-dimethoxybenzene CollisionEnergy:102040\"\" (delta mass: 393.1691 Da; putative annotation: N/A; putative formula: C22H23N3O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":751.37,"smiles":null,"spectrum_id":"CCMSLIB00017281072","spectrum_index":34754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 99.0991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.227,"smiles":null,"spectrum_id":"CCMSLIB00017281075","spectrum_index":34755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 972.319 Da; putative annotation: N/A; putative formula: C64H36N12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1477.5,"smiles":null,"spectrum_id":"CCMSLIB00017281076","spectrum_index":34756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 103.1022 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.129,"smiles":null,"spectrum_id":"CCMSLIB00017281079","spectrum_index":34757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 166.1346 Da; putative annotation: N/A; putative formula: C11H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.215,"smiles":null,"spectrum_id":"CCMSLIB00017281082","spectrum_index":34758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 334.1618 Da; putative annotation: N/A; putative formula: C20H22N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.321,"smiles":null,"spectrum_id":"CCMSLIB00017281083","spectrum_index":34759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 346.0892 Da; putative annotation: N/A; putative formula: C12H14N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.238,"smiles":null,"spectrum_id":"CCMSLIB00017281086","spectrum_index":34760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 196.1251 Da; putative annotation: N/A; putative formula: C15H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017281087","spectrum_index":34761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 107.0442 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.11,"smiles":null,"spectrum_id":"CCMSLIB00017281090","spectrum_index":34762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 45.0617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017281093","spectrum_index":34763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 71.0082 Da; putative annotation: N/A; putative formula: CHN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.089,"smiles":null,"spectrum_id":"CCMSLIB00017281096","spectrum_index":34764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 50.0516 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.326,"smiles":null,"spectrum_id":"CCMSLIB00017281097","spectrum_index":34765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 45.9845 Da; putative annotation: N/A; putative formula: C4H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017281100","spectrum_index":34766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 288.1502 Da; putative annotation: N/A; putative formula: C15H21N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.289,"smiles":null,"spectrum_id":"CCMSLIB00017281103","spectrum_index":34767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 88.0084 Da; putative annotation: N/A; putative formula: C3H5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.08,"smiles":null,"spectrum_id":"CCMSLIB00017281105","spectrum_index":34768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 56.0267 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.134,"smiles":null,"spectrum_id":"CCMSLIB00017281108","spectrum_index":34769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 12.0463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.133,"smiles":null,"spectrum_id":"CCMSLIB00017281111","spectrum_index":34770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 76.0712 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.127,"smiles":null,"spectrum_id":"CCMSLIB00017281114","spectrum_index":34771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304041 p-Coumaraldehyde (delta mass: 75.0299 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.09,"smiles":null,"spectrum_id":"CCMSLIB00017281116","spectrum_index":34772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 1,6-dimethyl-4-phenyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate (delta mass: 58.0822 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.198,"smiles":null,"spectrum_id":"CCMSLIB00017281118","spectrum_index":34773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 39.0209 Da; putative annotation: N/A; putative formula: CHN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017281121","spectrum_index":34774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxycinnamic acid methyl ester (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.081,"smiles":null,"spectrum_id":"CCMSLIB00017281124","spectrum_index":34775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017281125","spectrum_index":34776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 45.0099 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017281128","spectrum_index":34777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 194.0727 Da; putative annotation: N/A; putative formula: C6H14N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.175,"smiles":null,"spectrum_id":"CCMSLIB00017281131","spectrum_index":34778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 364.601 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.661,"smiles":null,"spectrum_id":"CCMSLIB00017281132","spectrum_index":34779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 75.0363 Da; putative annotation: N/A; putative formula: CH6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.096,"smiles":null,"spectrum_id":"CCMSLIB00017281135","spectrum_index":34780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 135.3532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.424,"smiles":null,"spectrum_id":"CCMSLIB00017281138","spectrum_index":34781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 200.0087 Da; putative annotation: N/A; putative formula: C4H9O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.132,"smiles":null,"spectrum_id":"CCMSLIB00017281139","spectrum_index":34782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 269.1368 Da; putative annotation: N/A; putative formula: C12H19N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.223,"smiles":null,"spectrum_id":"CCMSLIB00017281142","spectrum_index":34783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 167.0636 Da; putative annotation: N/A; putative formula: C6H9N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.217,"smiles":null,"spectrum_id":"CCMSLIB00017281145","spectrum_index":34784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 166.0639 Da; putative annotation: N/A; putative formula: C10H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.229,"smiles":null,"spectrum_id":"CCMSLIB00017281148","spectrum_index":34785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 323.1224 Da; putative annotation: N/A; putative formula: C13H25NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.198,"smiles":null,"spectrum_id":"CCMSLIB00017281150","spectrum_index":34786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 134.0582 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.202,"smiles":null,"spectrum_id":"CCMSLIB00017281152","spectrum_index":34787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU228201 10,11-Dihydro-10-Hydroxycarbazepine|Licarbazepine|5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 64.0152 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.128,"smiles":null,"spectrum_id":"CCMSLIB00017281155","spectrum_index":34788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 659.3677 Da; putative annotation: N/A; putative formula: C37H57NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.438,"smiles":null,"spectrum_id":"CCMSLIB00017281158","spectrum_index":34789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 769.4971 Da; putative annotation: N/A; putative formula: C54H63N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":950.568,"smiles":null,"spectrum_id":"CCMSLIB00017281159","spectrum_index":34790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.16,"smiles":null,"spectrum_id":"CCMSLIB00017281162","spectrum_index":34791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-(3,4-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 119.0018 Da; putative annotation: N/A; putative formula: C6HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.125,"smiles":null,"spectrum_id":"CCMSLIB00017281164","spectrum_index":34792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 86.989 Da; putative annotation: N/A; putative formula: CHN3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.07,"smiles":null,"spectrum_id":"CCMSLIB00017281167","spectrum_index":34793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU151709 Olanzapine (delta mass: 38.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.206,"smiles":null,"spectrum_id":"CCMSLIB00017281170","spectrum_index":34794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 72.0214 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.176,"smiles":null,"spectrum_id":"CCMSLIB00017281172","spectrum_index":34795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 45.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.17,"smiles":null,"spectrum_id":"CCMSLIB00017281174","spectrum_index":34796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 281.9961 Da; putative annotation: N/A; putative formula: C8H11O7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.067,"smiles":null,"spectrum_id":"CCMSLIB00017281177","spectrum_index":34797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 50.0143 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.09,"smiles":null,"spectrum_id":"CCMSLIB00017281180","spectrum_index":34798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 81.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.143,"smiles":null,"spectrum_id":"CCMSLIB00017281181","spectrum_index":34799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 87.0548 Da; putative annotation: N/A; putative formula: CH5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.177,"smiles":null,"spectrum_id":"CCMSLIB00017281184","spectrum_index":34800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 154.038 Da; putative annotation: N/A; putative formula: C6H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.166,"smiles":null,"spectrum_id":"CCMSLIB00017281187","spectrum_index":34801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 624.2096 Da; putative annotation: N/A; putative formula: C40H28N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1129.39,"smiles":null,"spectrum_id":"CCMSLIB00017281189","spectrum_index":34802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 923.8772 Da; putative annotation: N/A; putative formula: C60H113N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1591.11,"smiles":null,"spectrum_id":"CCMSLIB00017281192","spectrum_index":34803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 199.0841 Da; putative annotation: N/A; putative formula: C9H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.144,"smiles":null,"spectrum_id":"CCMSLIB00017281194","spectrum_index":34804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 401.2113 Da; putative annotation: N/A; putative formula: C18H27N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.298,"smiles":null,"spectrum_id":"CCMSLIB00017281197","spectrum_index":34805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 45.0171 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.065,"smiles":null,"spectrum_id":"CCMSLIB00017281200","spectrum_index":34806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 647.51 Da; putative annotation: N/A; putative formula: C43H69NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.581,"smiles":null,"spectrum_id":"CCMSLIB00017281202","spectrum_index":34807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 710.6334 Da; putative annotation: N/A; putative formula: C47H78N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.705,"smiles":null,"spectrum_id":"CCMSLIB00017281204","spectrum_index":34808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNITOL - 50.0 eV (delta mass: 71.9216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.008,"smiles":null,"spectrum_id":"CCMSLIB00017281207","spectrum_index":34809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 60.0761 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.157,"smiles":null,"spectrum_id":"CCMSLIB00017281209","spectrum_index":34810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 18.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.155,"smiles":null,"spectrum_id":"CCMSLIB00017281212","spectrum_index":34811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 53.0183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.157,"smiles":null,"spectrum_id":"CCMSLIB00017281215","spectrum_index":34812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 23.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.134,"smiles":null,"spectrum_id":"CCMSLIB00017281218","spectrum_index":34813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 57.8657 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.988,"smiles":null,"spectrum_id":"CCMSLIB00017281219","spectrum_index":34814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 197.2727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.307,"smiles":null,"spectrum_id":"CCMSLIB00017281222","spectrum_index":34815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 47.0219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017281225","spectrum_index":34816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 82.0782 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.164,"smiles":null,"spectrum_id":"CCMSLIB00017281228","spectrum_index":34817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 623.3663 Da; putative annotation: N/A; putative formula: C46H45N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.437,"smiles":null,"spectrum_id":"CCMSLIB00017281231","spectrum_index":34818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 210.1045 Da; putative annotation: N/A; putative formula: C15H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.165,"smiles":null,"spectrum_id":"CCMSLIB00017281232","spectrum_index":34819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 414.2481 Da; putative annotation: N/A; putative formula: C19H34N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.345,"smiles":null,"spectrum_id":"CCMSLIB00017281235","spectrum_index":34820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 47.9622 Da; putative annotation: N/A; putative formula: HO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.111,"smiles":null,"spectrum_id":"CCMSLIB00017281238","spectrum_index":34821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 133.0766 Da; putative annotation: N/A; putative formula: C4H12N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.168,"smiles":null,"spectrum_id":"CCMSLIB00017281240","spectrum_index":34822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 23.9975 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.157,"smiles":null,"spectrum_id":"CCMSLIB00017281242","spectrum_index":34823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 53.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.18,"smiles":null,"spectrum_id":"CCMSLIB00017281245","spectrum_index":34824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 186.0676 Da; putative annotation: N/A; putative formula: C7H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.206,"smiles":null,"spectrum_id":"CCMSLIB00017281247","spectrum_index":34825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 211.0486 Da; putative annotation: N/A; putative formula: C10H13NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.135,"smiles":null,"spectrum_id":"CCMSLIB00017281250","spectrum_index":34826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 114.9289 Da; putative annotation: N/A; putative formula: C2NO-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.015,"smiles":null,"spectrum_id":"CCMSLIB00017281253","spectrum_index":34827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7,8-Tetramethyl-2-(.beta.-carboxyethyl)-6-hydroxychroman (delta mass: 234.1256 Da; putative annotation: N/A; putative formula: C14H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.285,"smiles":null,"spectrum_id":"CCMSLIB00017281255","spectrum_index":34828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 729.4529 Da; putative annotation: N/A; putative formula: C36H67N5O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.524,"smiles":null,"spectrum_id":"CCMSLIB00017281258","spectrum_index":34829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 86.0521 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.144,"smiles":null,"spectrum_id":"CCMSLIB00017281261","spectrum_index":34830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylaldehyde (delta mass: 58.042 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.086,"smiles":null,"spectrum_id":"CCMSLIB00017281263","spectrum_index":34831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 199.1461 Da; putative annotation: N/A; putative formula: C13H17N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017281266","spectrum_index":34832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 163.0637 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.198,"smiles":null,"spectrum_id":"CCMSLIB00017281268","spectrum_index":34833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4R,5R,6S)-2-[[(2R,3S,4S,5R,6R)-6-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol (delta mass: 284.0071 Da; putative annotation: N/A; putative formula: C6H12N4O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":893.298,"smiles":null,"spectrum_id":"CCMSLIB00017281271","spectrum_index":34834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 90.0432 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.27,"smiles":null,"spectrum_id":"CCMSLIB00017281273","spectrum_index":34835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 114.0417 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.181,"smiles":null,"spectrum_id":"CCMSLIB00017281275","spectrum_index":34836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 101.1148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.238,"smiles":null,"spectrum_id":"CCMSLIB00017281278","spectrum_index":34837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 46.0109 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.096,"smiles":null,"spectrum_id":"CCMSLIB00017281281","spectrum_index":34838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 157.8843 Da; putative annotation: N/A; putative formula: O2P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.971,"smiles":null,"spectrum_id":"CCMSLIB00017281282","spectrum_index":34839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 58.0813 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.162,"smiles":null,"spectrum_id":"CCMSLIB00017281285","spectrum_index":34840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 70.057 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017281288","spectrum_index":34841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 275.0553 Da; putative annotation: N/A; putative formula: C13H13N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.147,"smiles":null,"spectrum_id":"CCMSLIB00017281289","spectrum_index":34842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 254.1514 Da; putative annotation: N/A; putative formula: C14H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.232,"smiles":null,"spectrum_id":"CCMSLIB00017281292","spectrum_index":34843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 35.0467 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.133,"smiles":null,"spectrum_id":"CCMSLIB00017281295","spectrum_index":34844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione (delta mass: 131.0948 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.223,"smiles":null,"spectrum_id":"CCMSLIB00017281296","spectrum_index":34845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 174.0633 Da; putative annotation: N/A; putative formula: C8H15PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.139,"smiles":null,"spectrum_id":"CCMSLIB00017281299","spectrum_index":34846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 46.078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.117,"smiles":null,"spectrum_id":"CCMSLIB00017281301","spectrum_index":34847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 36.0194 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.095,"smiles":null,"spectrum_id":"CCMSLIB00017281303","spectrum_index":34848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 95.0584 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.197,"smiles":null,"spectrum_id":"CCMSLIB00017281306","spectrum_index":34849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 58.0786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.191,"smiles":null,"spectrum_id":"CCMSLIB00017281308","spectrum_index":34850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 29.0132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.126,"smiles":null,"spectrum_id":"CCMSLIB00017281311","spectrum_index":34851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 58.0419 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.122,"smiles":null,"spectrum_id":"CCMSLIB00017281314","spectrum_index":34852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 122.0732 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017281317","spectrum_index":34853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 162.0527 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.186,"smiles":null,"spectrum_id":"CCMSLIB00017281320","spectrum_index":34854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 161.0701 Da; putative annotation: N/A; putative formula: C7H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.24,"smiles":null,"spectrum_id":"CCMSLIB00017281323","spectrum_index":34855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 206.1056 Da; putative annotation: N/A; putative formula: C11H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.181,"smiles":null,"spectrum_id":"CCMSLIB00017281324","spectrum_index":34856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 61.0131 Da; putative annotation: N/A; putative formula: H3N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017281327","spectrum_index":34857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 520.3809 Da; putative annotation: N/A; putative formula: C28H58O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.53,"smiles":null,"spectrum_id":"CCMSLIB00017281329","spectrum_index":34858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 188.0787 Da; putative annotation: N/A; putative formula: C9H17PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.16,"smiles":null,"spectrum_id":"CCMSLIB00017281331","spectrum_index":34859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 92.0196 Da; putative annotation: N/A; putative formula: C6H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.086,"smiles":null,"spectrum_id":"CCMSLIB00017281334","spectrum_index":34860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 80.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.16,"smiles":null,"spectrum_id":"CCMSLIB00017281336","spectrum_index":34861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apixaban (delta mass: 476.2171 Da; putative annotation: N/A; putative formula: C25H28N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.415,"smiles":null,"spectrum_id":"CCMSLIB00017281338","spectrum_index":34862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 184.1222 Da; putative annotation: Ile-Ala; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.293,"smiles":null,"spectrum_id":"CCMSLIB00017281341","spectrum_index":34863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 154.075 Da; putative annotation: Glycyl-Proline; AIF; CE0; MS2Dec; putative formula: C7H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.162,"smiles":null,"spectrum_id":"CCMSLIB00017281344","spectrum_index":34864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Phe from NIST14 (delta mass: 276.1113 Da; putative annotation: Phe-Glu; putative formula: C14H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.23,"smiles":null,"spectrum_id":"CCMSLIB00017281345","spectrum_index":34865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 264.0843 Da; putative annotation: 1,4-D-Xylobiose; putative formula: C10H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.144,"smiles":null,"spectrum_id":"CCMSLIB00017281348","spectrum_index":34866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 87.032 Da; putative annotation: Massbank:RP000702 L-Serine|(2S)-2-amino-3-hydroxypropanoic acid; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.103,"smiles":null,"spectrum_id":"CCMSLIB00017281349","spectrum_index":34867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PM018176 Spermidine-di-p-coumaroyl (delta mass: 206.0585 Da; putative annotation: SINAPIC ACID CollisionEnergy:102040; putative formula: C11H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.297,"smiles":null,"spectrum_id":"CCMSLIB00017281352","spectrum_index":34868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 170.1334 Da; putative annotation: Ethyl 3-hydroxyoctanoate; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.181,"smiles":null,"spectrum_id":"CCMSLIB00017281355","spectrum_index":34869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 185.0293 Da; putative annotation: N-Phenyl-2-thiophenecarboxamide; putative formula: C11H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.1,"smiles":null,"spectrum_id":"CCMSLIB00017281356","spectrum_index":34870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 122.0733 Da; putative annotation: (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017281359","spectrum_index":34871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 113.0844 Da; putative annotation: 1747371 - 40.0 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.255,"smiles":null,"spectrum_id":"CCMSLIB00017281362","spectrum_index":34872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 144.0931 Da; putative annotation: 4-Penten-1-ol, 5-phenyl-, (4E)-; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.518,"smiles":null,"spectrum_id":"CCMSLIB00017281363","spectrum_index":34873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.102,"smiles":null,"spectrum_id":"CCMSLIB00017281366","spectrum_index":34874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 148.0372 Da; putative annotation: N/A; putative formula: C5H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.124,"smiles":null,"spectrum_id":"CCMSLIB00017281368","spectrum_index":34875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 124.0672 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.191,"smiles":null,"spectrum_id":"CCMSLIB00017281370","spectrum_index":34876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 152.9651 Da; putative annotation: N/A; putative formula: C2H4NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.098,"smiles":null,"spectrum_id":"CCMSLIB00017281373","spectrum_index":34877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 298.2508 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.493,"smiles":null,"spectrum_id":"CCMSLIB00017281376","spectrum_index":34878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 182.167 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017281377","spectrum_index":34879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 612.4143 Da; putative annotation: N/A; putative formula: C29H56N8O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.516,"smiles":null,"spectrum_id":"CCMSLIB00017281380","spectrum_index":34880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 357.1576 Da; putative annotation: N/A; putative formula: C20H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.344,"smiles":null,"spectrum_id":"CCMSLIB00017281383","spectrum_index":34881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 15.0113 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.134,"smiles":null,"spectrum_id":"CCMSLIB00017281384","spectrum_index":34882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 18.0147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.087,"smiles":null,"spectrum_id":"CCMSLIB00017281387","spectrum_index":34883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 863.4304 Da; putative annotation: N/A; putative formula: C50H57N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1056.5,"smiles":null,"spectrum_id":"CCMSLIB00017281390","spectrum_index":34884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 735.3824 Da; putative annotation: N/A; putative formula: C51H49N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.469,"smiles":null,"spectrum_id":"CCMSLIB00017281391","spectrum_index":34885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 1060.6421 Da; putative annotation: N/A; putative formula: C59H80N16OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1215.71,"smiles":null,"spectrum_id":"CCMSLIB00017281394","spectrum_index":34886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dideoxyuridine (delta mass: 54.0455 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.133,"smiles":null,"spectrum_id":"CCMSLIB00017281397","spectrum_index":34887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU022001 Labetalol|2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide (delta mass: 282.1463 Da; putative annotation: N/A; putative formula: C15H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.332,"smiles":null,"spectrum_id":"CCMSLIB00017281398","spectrum_index":34888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 836.4505 Da; putative annotation: N/A; putative formula: C36H60N12O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1163.58,"smiles":null,"spectrum_id":"CCMSLIB00017281401","spectrum_index":34889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:KO008824 N-Acetylneuraminate|5-Acetamido-3,5-dideoxy-D-glycero-D-galacto-2-nonulosonic acid|N-Acetylneuraminic acid|Neu5Ac (delta mass: 118.0676 Da; putative annotation: N/A; putative formula: C3H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.181,"smiles":null,"spectrum_id":"CCMSLIB00017281404","spectrum_index":34890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 83.9993 Da; putative annotation: N/A; putative formula: CHN4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.136,"smiles":null,"spectrum_id":"CCMSLIB00017281407","spectrum_index":34891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 42.017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.065,"smiles":null,"spectrum_id":"CCMSLIB00017281408","spectrum_index":34892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 104.0274 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.103,"smiles":null,"spectrum_id":"CCMSLIB00017281411","spectrum_index":34893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 238.0634 Da; putative annotation: N/A; putative formula: C15H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.187,"smiles":null,"spectrum_id":"CCMSLIB00017281414","spectrum_index":34894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 459.4086 Da; putative annotation: N/A; putative formula: C30H53NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.479,"smiles":null,"spectrum_id":"CCMSLIB00017281417","spectrum_index":34895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 93.0832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.122,"smiles":null,"spectrum_id":"CCMSLIB00017281418","spectrum_index":34896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 115.0271 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.151,"smiles":null,"spectrum_id":"CCMSLIB00017281421","spectrum_index":34897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 618.545 Da; putative annotation: N/A; putative formula: C37H70N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.616,"smiles":null,"spectrum_id":"CCMSLIB00017281424","spectrum_index":34898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 156.0405 Da; putative annotation: N/A; putative formula: C11H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.153,"smiles":null,"spectrum_id":"CCMSLIB00017281426","spectrum_index":34899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 38.0523 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.16,"smiles":null,"spectrum_id":"CCMSLIB00017281428","spectrum_index":34900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 72.0573 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.196,"smiles":null,"spectrum_id":"CCMSLIB00017281431","spectrum_index":34901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.144,"smiles":null,"spectrum_id":"CCMSLIB00017281434","spectrum_index":34902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.133,"smiles":null,"spectrum_id":"CCMSLIB00017281436","spectrum_index":34903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitol (delta mass: 44.0226 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.088,"smiles":null,"spectrum_id":"CCMSLIB00017281438","spectrum_index":34904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 23.9967 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.057,"smiles":null,"spectrum_id":"CCMSLIB00017281442","spectrum_index":34905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 32.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.112,"smiles":null,"spectrum_id":"CCMSLIB00017281444","spectrum_index":34906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 169.0212 Da; putative annotation: N/A; putative formula: C7H9NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.144,"smiles":null,"spectrum_id":"CCMSLIB00017281447","spectrum_index":34907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 36.0837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.165,"smiles":null,"spectrum_id":"CCMSLIB00017281450","spectrum_index":34908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 185.036 Da; putative annotation: N/A; putative formula: C6H8N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.205,"smiles":null,"spectrum_id":"CCMSLIB00017281451","spectrum_index":34909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 167.0253 Da; putative annotation: N/A; putative formula: C4H9NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.195,"smiles":null,"spectrum_id":"CCMSLIB00017281454","spectrum_index":34910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 152.0922 Da; putative annotation: N/A; putative formula: C4H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.2,"smiles":null,"spectrum_id":"CCMSLIB00017281457","spectrum_index":34911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 29.0026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.062,"smiles":null,"spectrum_id":"CCMSLIB00017281458","spectrum_index":34912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 24.036 Da; putative annotation: N/A; putative formula: C3H4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.096,"smiles":null,"spectrum_id":"CCMSLIB00017281461","spectrum_index":34913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 25.9939 Da; putative annotation: N/A; putative formula: H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.075,"smiles":null,"spectrum_id":"CCMSLIB00017281464","spectrum_index":34914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 16.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.148,"smiles":null,"spectrum_id":"CCMSLIB00017281466","spectrum_index":34915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 77.0481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.098,"smiles":null,"spectrum_id":"CCMSLIB00017281468","spectrum_index":34916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.092,"smiles":null,"spectrum_id":"CCMSLIB00017281471","spectrum_index":34917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Bromo-4H,5H-pyrrolo[1,2-a]quinoxalin-4-one (delta mass: 252.3093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.291,"smiles":null,"spectrum_id":"CCMSLIB00017281474","spectrum_index":34918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Tyr (delta mass: 260.1531 Da; putative annotation: N/A; putative formula: C15H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.287,"smiles":null,"spectrum_id":"CCMSLIB00017281476","spectrum_index":34919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 199.1304 Da; putative annotation: N/A; putative formula: C9H17N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.195,"smiles":null,"spectrum_id":"CCMSLIB00017281478","spectrum_index":34920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 256.0852 Da; putative annotation: N/A; putative formula: C7H12N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.212,"smiles":null,"spectrum_id":"CCMSLIB00017281481","spectrum_index":34921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl hydrogen malonate (delta mass: 26.9941 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.044,"smiles":null,"spectrum_id":"CCMSLIB00017281484","spectrum_index":34922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 971.3684 Da; putative annotation: N/A; putative formula: C50H57N3O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1152.44,"smiles":null,"spectrum_id":"CCMSLIB00017281485","spectrum_index":34923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 887.4898 Da; putative annotation: N/A; putative formula: C46H65N9O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1050.55,"smiles":null,"spectrum_id":"CCMSLIB00017281488","spectrum_index":34924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 31.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.118,"smiles":null,"spectrum_id":"CCMSLIB00017281491","spectrum_index":34925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Blood Group H Trisaccharide (delta mass: 346.0921 Da; putative annotation: N/A; putative formula: C16H18N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":876.3,"smiles":null,"spectrum_id":"CCMSLIB00017281492","spectrum_index":34926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 78.973 Da; putative annotation: N/A; putative formula: HNO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.028,"smiles":null,"spectrum_id":"CCMSLIB00017281495","spectrum_index":34927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 51.0567 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.122,"smiles":null,"spectrum_id":"CCMSLIB00017281498","spectrum_index":34928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 141.0984 Da; putative annotation: N/A; putative formula: C8H15NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.196,"smiles":null,"spectrum_id":"CCMSLIB00017281500","spectrum_index":34929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 24.0001 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.113,"smiles":null,"spectrum_id":"CCMSLIB00017281502","spectrum_index":34930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 169.9903 Da; putative annotation: N/A; putative formula: C4H2N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.066,"smiles":null,"spectrum_id":"CCMSLIB00017281505","spectrum_index":34931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 68.0271 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.124,"smiles":null,"spectrum_id":"CCMSLIB00017281508","spectrum_index":34932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 108.094 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.217,"smiles":null,"spectrum_id":"CCMSLIB00017281510","spectrum_index":34933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 111.0356 Da; putative annotation: N/A; putative formula: C4H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.111,"smiles":null,"spectrum_id":"CCMSLIB00017281512","spectrum_index":34934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 470.2159 Da; putative annotation: N/A; putative formula: C24H38O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.302,"smiles":null,"spectrum_id":"CCMSLIB00017281515","spectrum_index":34935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 487.2533 Da; putative annotation: N/A; putative formula: C25H38N5OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.345,"smiles":null,"spectrum_id":"CCMSLIB00017281517","spectrum_index":34936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 30.0288 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.089,"smiles":null,"spectrum_id":"CCMSLIB00017281519","spectrum_index":34937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 120.0406 Da; putative annotation: N/A; putative formula: C8H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.121,"smiles":null,"spectrum_id":"CCMSLIB00017281522","spectrum_index":34938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:102040 (delta mass: 212.0162 Da; putative annotation: N/A; putative formula: C10H4N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.112,"smiles":null,"spectrum_id":"CCMSLIB00017281525","spectrum_index":34939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of UNII-UGT5535REQ (delta mass: 18.0759 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.191,"smiles":null,"spectrum_id":"CCMSLIB00017281527","spectrum_index":34940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000574951-01! (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.097,"smiles":null,"spectrum_id":"CCMSLIB00017281529","spectrum_index":34941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 101.0933 Da; putative annotation: N/A; putative formula: C4H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.169,"smiles":null,"spectrum_id":"CCMSLIB00017281532","spectrum_index":34942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 58.04 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.126,"smiles":null,"spectrum_id":"CCMSLIB00017281535","spectrum_index":34943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 12.0359 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.117,"smiles":null,"spectrum_id":"CCMSLIB00017281536","spectrum_index":34944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 70.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.104,"smiles":null,"spectrum_id":"CCMSLIB00017281539","spectrum_index":34945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 44.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.154,"smiles":null,"spectrum_id":"CCMSLIB00017281542","spectrum_index":34946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 43.0176 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.078,"smiles":null,"spectrum_id":"CCMSLIB00017281543","spectrum_index":34947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethoxy-2(1H)-quinolinone (delta mass: 213.1979 Da; putative annotation: N/A; putative formula: C10H23N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.279,"smiles":null,"spectrum_id":"CCMSLIB00017281546","spectrum_index":34948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eslicarbazepine acetate (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.149,"smiles":null,"spectrum_id":"CCMSLIB00017281549","spectrum_index":34949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 130.0015 Da; putative annotation: N/A; putative formula: C3H2N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.135,"smiles":null,"spectrum_id":"CCMSLIB00017281552","spectrum_index":34950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 586.2326 Da; putative annotation: N/A; putative formula: C34H30N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.272,"smiles":null,"spectrum_id":"CCMSLIB00017281553","spectrum_index":34951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdesmethoxycurcumin (delta mass: 34.0116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.124,"smiles":null,"spectrum_id":"CCMSLIB00017281556","spectrum_index":34952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 11.9987 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.137,"smiles":null,"spectrum_id":"CCMSLIB00017281559","spectrum_index":34953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 283.1191 Da; putative annotation: N/A; putative formula: C11H18N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.237,"smiles":null,"spectrum_id":"CCMSLIB00017281562","spectrum_index":34954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 174.1258 Da; putative annotation: N/A; putative formula: C9H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.212,"smiles":null,"spectrum_id":"CCMSLIB00017281565","spectrum_index":34955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 36.0222 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.093,"smiles":null,"spectrum_id":"CCMSLIB00017281566","spectrum_index":34956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 100.0886 Da; putative annotation: N/A; putative formula: C6H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.232,"smiles":null,"spectrum_id":"CCMSLIB00017281569","spectrum_index":34957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 226.0582 Da; putative annotation: N/A; putative formula: C11H15OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.139,"smiles":null,"spectrum_id":"CCMSLIB00017281572","spectrum_index":34958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 177.8829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.894,"smiles":null,"spectrum_id":"CCMSLIB00017281574","spectrum_index":34959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 7.9799 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.102,"smiles":null,"spectrum_id":"CCMSLIB00017281577","spectrum_index":34960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 308.136 Da; putative annotation: N/A; putative formula: C12H12N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.259,"smiles":null,"spectrum_id":"CCMSLIB00017281579","spectrum_index":34961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 126.1052 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.213,"smiles":null,"spectrum_id":"CCMSLIB00017281582","spectrum_index":34962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 942.4827 Da; putative annotation: N/A; putative formula: C53H66N8O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1149.57,"smiles":null,"spectrum_id":"CCMSLIB00017281585","spectrum_index":34963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 64.068 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.154,"smiles":null,"spectrum_id":"CCMSLIB00017281586","spectrum_index":34964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 351.1001 Da; putative annotation: N/A; putative formula: C13H23NO6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.196,"smiles":null,"spectrum_id":"CCMSLIB00017281589","spectrum_index":34965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 102.0377 Da; putative annotation: N/A; putative formula: C2H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.161,"smiles":null,"spectrum_id":"CCMSLIB00017281592","spectrum_index":34966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 103.0026 Da; putative annotation: N/A; putative formula: CHN3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.116,"smiles":null,"spectrum_id":"CCMSLIB00017281594","spectrum_index":34967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 112.041 Da; putative annotation: N/A; putative formula: C8H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.118,"smiles":null,"spectrum_id":"CCMSLIB00017281596","spectrum_index":34968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 407.159 Da; putative annotation: N/A; putative formula: C21H29NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.292,"smiles":null,"spectrum_id":"CCMSLIB00017281599","spectrum_index":34969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 67.0788 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.15,"smiles":null,"spectrum_id":"CCMSLIB00017281602","spectrum_index":34970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB001381 5-Hydroxyindole-3-acetic acid|2-(5-hydroxy-1H-indol-3-yl)acetic acid (delta mass: 408.2783 Da; putative annotation: N/A; putative formula: C19H36N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.344,"smiles":null,"spectrum_id":"CCMSLIB00017281603","spectrum_index":34971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 52.0288 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.125,"smiles":null,"spectrum_id":"CCMSLIB00017281606","spectrum_index":34972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 23.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.092,"smiles":null,"spectrum_id":"CCMSLIB00017281609","spectrum_index":34973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 73.0313 Da; putative annotation: N/A; putative formula: C6H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.133,"smiles":null,"spectrum_id":"CCMSLIB00017281610","spectrum_index":34974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine - 40.0 eV (delta mass: 93.0818 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.168,"smiles":null,"spectrum_id":"CCMSLIB00017281613","spectrum_index":34975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 98.0139 Da; putative annotation: N/A; putative formula: C2H3N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.069,"smiles":null,"spectrum_id":"CCMSLIB00017281616","spectrum_index":34976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 217.0729 Da; putative annotation: N/A; putative formula: C6H12N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.196,"smiles":null,"spectrum_id":"CCMSLIB00017281619","spectrum_index":34977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 222.0672 Da; putative annotation: N/A; putative formula: C9H11N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.217,"smiles":null,"spectrum_id":"CCMSLIB00017281621","spectrum_index":34978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 61.0031 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.136,"smiles":null,"spectrum_id":"CCMSLIB00017281623","spectrum_index":34979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 74.0522 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.181,"smiles":null,"spectrum_id":"CCMSLIB00017281626","spectrum_index":34980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 27.9954 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.035,"smiles":null,"spectrum_id":"CCMSLIB00017281629","spectrum_index":34981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 400.5993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.686,"smiles":null,"spectrum_id":"CCMSLIB00017281632","spectrum_index":34982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 413.4258 Da; putative annotation: N/A; putative formula: C22H51N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.512,"smiles":null,"spectrum_id":"CCMSLIB00017281634","spectrum_index":34983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptoline (delta mass: 106.0785 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.186,"smiles":null,"spectrum_id":"CCMSLIB00017281636","spectrum_index":34984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 146.0544 Da; putative annotation: N/A; putative formula: C2H6N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.114,"smiles":null,"spectrum_id":"CCMSLIB00017281639","spectrum_index":34985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 357.3237 Da; putative annotation: N/A; putative formula: C21H43NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.389,"smiles":null,"spectrum_id":"CCMSLIB00017281642","spectrum_index":34986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 88.0525 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.107,"smiles":null,"spectrum_id":"CCMSLIB00017281644","spectrum_index":34987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 143.0662 Da; putative annotation: N/A; putative formula: CH5N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.115,"smiles":null,"spectrum_id":"CCMSLIB00017281646","spectrum_index":34988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 20.0 eV (delta mass: 453.6698 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.783,"smiles":null,"spectrum_id":"CCMSLIB00017281649","spectrum_index":34989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydrozingerone (delta mass: 182.0578 Da; putative annotation: N/A; putative formula: C9H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017281652","spectrum_index":34990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 447.2322 Da; putative annotation: N/A; putative formula: C23H29N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.302,"smiles":null,"spectrum_id":"CCMSLIB00017281654","spectrum_index":34991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 124.0491 Da; putative annotation: N/A; putative formula: C3H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.156,"smiles":null,"spectrum_id":"CCMSLIB00017281656","spectrum_index":34992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-nitrobenzyl)ethanamine (delta mass: 84.0109 Da; putative annotation: N/A; putative formula: C6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.13,"smiles":null,"spectrum_id":"CCMSLIB00017281659","spectrum_index":34993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 447.8391 Da; putative annotation: N/A; putative formula: C14H8OS8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.963,"smiles":null,"spectrum_id":"CCMSLIB00017281662","spectrum_index":34994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 558.9077 Da; putative annotation: N/A; putative formula: C27H13NO-1S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.058,"smiles":null,"spectrum_id":"CCMSLIB00017281664","spectrum_index":34995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 789.7524 Da; putative annotation: N/A; putative formula: C58H95NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1081.86,"smiles":null,"spectrum_id":"CCMSLIB00017281666","spectrum_index":34996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 463.2297 Da; putative annotation: N/A; putative formula: C35H29N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.3,"smiles":null,"spectrum_id":"CCMSLIB00017281669","spectrum_index":34997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 474.2466 Da; putative annotation: N/A; putative formula: C23H38O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.385,"smiles":null,"spectrum_id":"CCMSLIB00017281672","spectrum_index":34998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 76.0211 Da; putative annotation: N/A; putative formula: H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.17,"smiles":null,"spectrum_id":"CCMSLIB00017281673","spectrum_index":34999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 98.0841 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.18,"smiles":null,"spectrum_id":"CCMSLIB00017281676","spectrum_index":35000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 759.994 Da; putative annotation: N/A; putative formula: C26H24N4O13S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":982.091,"smiles":null,"spectrum_id":"CCMSLIB00017281679","spectrum_index":35001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 575.3316 Da; putative annotation: N/A; putative formula: C39H46NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.402,"smiles":null,"spectrum_id":"CCMSLIB00017281681","spectrum_index":35002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 250.0526 Da; putative annotation: N/A; putative formula: C10H10N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.139,"smiles":null,"spectrum_id":"CCMSLIB00017281683","spectrum_index":35003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 352.6933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.764,"smiles":null,"spectrum_id":"CCMSLIB00017281687","spectrum_index":35004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 206.0944 Da; putative annotation: N/A; putative formula: C12H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.175,"smiles":null,"spectrum_id":"CCMSLIB00017281689","spectrum_index":35005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 93.0425 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.176,"smiles":null,"spectrum_id":"CCMSLIB00017281692","spectrum_index":35006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 201.1217 Da; putative annotation: N/A; putative formula: C7H15N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.171,"smiles":null,"spectrum_id":"CCMSLIB00017281695","spectrum_index":35007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 246.064 Da; putative annotation: N/A; putative formula: C12H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.145,"smiles":null,"spectrum_id":"CCMSLIB00017281698","spectrum_index":35008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 153.0797 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.192,"smiles":null,"spectrum_id":"CCMSLIB00017281699","spectrum_index":35009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 96.0424 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017281702","spectrum_index":35010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 114.0681 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.166,"smiles":null,"spectrum_id":"CCMSLIB00017281705","spectrum_index":35011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 110.0578 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.117,"smiles":null,"spectrum_id":"CCMSLIB00017281706","spectrum_index":35012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 153.0524 Da; putative annotation: N/A; putative formula: C2H3N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017281709","spectrum_index":35013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 96.032 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.139,"smiles":null,"spectrum_id":"CCMSLIB00017281712","spectrum_index":35014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 247.179 Da; putative annotation: N/A; putative formula: C13H21N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.25,"smiles":null,"spectrum_id":"CCMSLIB00017281715","spectrum_index":35015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 341.1952 Da; putative annotation: N/A; putative formula: C16H27N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.286,"smiles":null,"spectrum_id":"CCMSLIB00017281716","spectrum_index":35016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 218.079 Da; putative annotation: N/A; putative formula: C9H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.228,"smiles":null,"spectrum_id":"CCMSLIB00017281719","spectrum_index":35017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 171.0534 Da; putative annotation: N/A; putative formula: C7H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.182,"smiles":null,"spectrum_id":"CCMSLIB00017281722","spectrum_index":35018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 54.0735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.089,"smiles":null,"spectrum_id":"CCMSLIB00017281723","spectrum_index":35019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 92.0627 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.16,"smiles":null,"spectrum_id":"CCMSLIB00017281726","spectrum_index":35020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 410.2623 Da; putative annotation: N/A; putative formula: C18H38N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.334,"smiles":null,"spectrum_id":"CCMSLIB00017281729","spectrum_index":35021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 315.1302 Da; putative annotation: N/A; putative formula: C11H13N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.206,"smiles":null,"spectrum_id":"CCMSLIB00017281732","spectrum_index":35022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 33.0407 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.127,"smiles":null,"spectrum_id":"CCMSLIB00017281734","spectrum_index":35023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 48.0403 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017281736","spectrum_index":35024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 17.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.108,"smiles":null,"spectrum_id":"CCMSLIB00017281739","spectrum_index":35025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 70.078 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.3,"smiles":null,"spectrum_id":"CCMSLIB00017281742","spectrum_index":35026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 156.0939 Da; putative annotation: N/A; putative formula: C12H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.159,"smiles":null,"spectrum_id":"CCMSLIB00017281743","spectrum_index":35027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GLUCOSAMINE (delta mass: 262.2314 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.318,"smiles":null,"spectrum_id":"CCMSLIB00017281746","spectrum_index":35028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydro-10-phenophosphazinol 10-oxide (delta mass: 70.05 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.102,"smiles":null,"spectrum_id":"CCMSLIB00017281749","spectrum_index":35029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 352.3334 Da; putative annotation: N/A; putative formula: C23H44O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.37,"smiles":null,"spectrum_id":"CCMSLIB00017281750","spectrum_index":35030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 120.0436 Da; putative annotation: N/A; putative formula: C5H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.145,"smiles":null,"spectrum_id":"CCMSLIB00017281753","spectrum_index":35031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 168.042 Da; putative annotation: N/A; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.165,"smiles":null,"spectrum_id":"CCMSLIB00017281756","spectrum_index":35032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 183.0533 Da; putative annotation: N/A; putative formula: C8H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.119,"smiles":null,"spectrum_id":"CCMSLIB00017281759","spectrum_index":35033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 130.1792 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.291,"smiles":null,"spectrum_id":"CCMSLIB00017281760","spectrum_index":35034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Val (delta mass: 113.0841 Da; putative annotation: L-Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017281763","spectrum_index":35035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 204.0785 Da; putative annotation: 2-(3-Methylbenzyl)butanedioic acid; putative formula: C12H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.175,"smiles":null,"spectrum_id":"CCMSLIB00017281766","spectrum_index":35036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 145.054 Da; putative annotation: 3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.151,"smiles":null,"spectrum_id":"CCMSLIB00017281769","spectrum_index":35037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 173.1415 Da; putative annotation: Triisopropanolamine; putative formula: C9H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.29,"smiles":null,"spectrum_id":"CCMSLIB00017281770","spectrum_index":35038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 240.2123 Da; putative annotation: 3-Dodecyloxypropanoic acid; putative formula: C15H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.351,"smiles":null,"spectrum_id":"CCMSLIB00017281773","spectrum_index":35039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 252.0408 Da; putative annotation: Norwogenin; putative formula: C15H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.169,"smiles":null,"spectrum_id":"CCMSLIB00017281776","spectrum_index":35040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-Hydroxy-4,6-dimethoxyacetophenone\"\" (delta mass: 368.344 Da; putative annotation: Cholesterol; putative formula: C27H44)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.425,"smiles":null,"spectrum_id":"CCMSLIB00017281778","spectrum_index":35041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 810.2676 Da; putative annotation: Spectral Match to Maltopentaose from NIST14; putative formula: C30H50O25)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1477.5,"smiles":null,"spectrum_id":"CCMSLIB00017281780","spectrum_index":35042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 172.2186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.258,"smiles":null,"spectrum_id":"CCMSLIB00017281783","spectrum_index":35043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine CollisionEnergy:102040 (delta mass: 256.9503 Da; putative annotation: N/A; putative formula: C6H3N5OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.047,"smiles":null,"spectrum_id":"CCMSLIB00017281786","spectrum_index":35044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 230.0084 Da; putative annotation: N/A; putative formula: C2H2N10O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.108,"smiles":null,"spectrum_id":"CCMSLIB00017281789","spectrum_index":35045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 55.0416 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.165,"smiles":null,"spectrum_id":"CCMSLIB00017281790","spectrum_index":35046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Terbutaline (delta mass: 57.0312 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.175,"smiles":null,"spectrum_id":"CCMSLIB00017281793","spectrum_index":35047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 140.0622 Da; putative annotation: N/A; putative formula: C11H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.186,"smiles":null,"spectrum_id":"CCMSLIB00017281796","spectrum_index":35048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 267.0783 Da; putative annotation: N/A; putative formula: C10H21NOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.18,"smiles":null,"spectrum_id":"CCMSLIB00017281797","spectrum_index":35049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 98.0731 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.216,"smiles":null,"spectrum_id":"CCMSLIB00017281800","spectrum_index":35050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 171.0793 Da; putative annotation: N/A; putative formula: C10H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.15,"smiles":null,"spectrum_id":"CCMSLIB00017281803","spectrum_index":35051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 835.4709 Da; putative annotation: N/A; putative formula: C38H70N5O13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1016.54,"smiles":null,"spectrum_id":"CCMSLIB00017281804","spectrum_index":35052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-glutamic acid (delta mass: 53.063 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.139,"smiles":null,"spectrum_id":"CCMSLIB00017281807","spectrum_index":35053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE30; CorrDec (delta mass: 45.0206 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":131.081,"smiles":null,"spectrum_id":"CCMSLIB00017281810","spectrum_index":35054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 804.2838 Da; putative annotation: N/A; putative formula: C37H44N10O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":989.365,"smiles":null,"spectrum_id":"CCMSLIB00017281812","spectrum_index":35055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 124.0413 Da; putative annotation: N/A; putative formula: C9H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.18,"smiles":null,"spectrum_id":"CCMSLIB00017281814","spectrum_index":35056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 46.0058 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.076,"smiles":null,"spectrum_id":"CCMSLIB00017281817","spectrum_index":35057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 148.0008 Da; putative annotation: N/A; putative formula: C4H4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.066,"smiles":null,"spectrum_id":"CCMSLIB00017281820","spectrum_index":35058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 41.0623 Da; putative annotation: N/A; putative formula: C3H7NO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.128,"smiles":null,"spectrum_id":"CCMSLIB00017281822","spectrum_index":35059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 155.043 Da; putative annotation: N/A; putative formula: C7H11NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.086,"smiles":null,"spectrum_id":"CCMSLIB00017281825","spectrum_index":35060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 389.1483 Da; putative annotation: N/A; putative formula: C21H27NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.208,"smiles":null,"spectrum_id":"CCMSLIB00017281828","spectrum_index":35061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-5-pentyl- (delta mass: 186.2016 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.413,"smiles":null,"spectrum_id":"CCMSLIB00017281831","spectrum_index":35062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 12.0083 Da; putative annotation: N/A; putative formula: N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.049,"smiles":null,"spectrum_id":"CCMSLIB00017281833","spectrum_index":35063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 78.0103 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.134,"smiles":null,"spectrum_id":"CCMSLIB00017281835","spectrum_index":35064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 314.0597 Da; putative annotation: N/A; putative formula: C8H14N2O11)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.13,"smiles":null,"spectrum_id":"CCMSLIB00017281838","spectrum_index":35065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 100.0342 Da; putative annotation: N/A; putative formula: C5H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.136,"smiles":null,"spectrum_id":"CCMSLIB00017281841","spectrum_index":35066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 50.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.17,"smiles":null,"spectrum_id":"CCMSLIB00017281842","spectrum_index":35067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 126.0277 Da; putative annotation: N/A; putative formula: C2H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.204,"smiles":null,"spectrum_id":"CCMSLIB00017281845","spectrum_index":35068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 303.1674 Da; putative annotation: N/A; putative formula: C18H27NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.254,"smiles":null,"spectrum_id":"CCMSLIB00017281848","spectrum_index":35069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ETHYL 3-INDOLEACETATE - 50.0 eV (delta mass: 129.0573 Da; putative annotation: N/A; putative formula: C3H8N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.159,"smiles":null,"spectrum_id":"CCMSLIB00017281851","spectrum_index":35070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carboxylic acid, ethyl ester (delta mass: 2.0137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017281852","spectrum_index":35071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Norepinephrine from NIST14 (delta mass: 68.0623 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.143,"smiles":null,"spectrum_id":"CCMSLIB00017281855","spectrum_index":35072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 233.0358 Da; putative annotation: N/A; putative formula: C8H11NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.127,"smiles":null,"spectrum_id":"CCMSLIB00017281858","spectrum_index":35073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indazol-6-ol, 1-[(2S)-2-aminopropyl]- (delta mass: 176.0231 Da; putative annotation: N/A; putative formula: CH4N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.136,"smiles":null,"spectrum_id":"CCMSLIB00017281861","spectrum_index":35074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 92.0978 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.168,"smiles":null,"spectrum_id":"CCMSLIB00017281862","spectrum_index":35075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(4-(5-(methoxymethyl)-1H-1,2,4-triazol-3-yl)phenyl)acetamide (delta mass: 244.0992 Da; putative annotation: N/A; putative formula: C12H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":873.371,"smiles":null,"spectrum_id":"CCMSLIB00017281865","spectrum_index":35076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 295.1221 Da; putative annotation: N/A; putative formula: C19H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.224,"smiles":null,"spectrum_id":"CCMSLIB00017281868","spectrum_index":35077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 65.4137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.5,"smiles":null,"spectrum_id":"CCMSLIB00017281871","spectrum_index":35078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 137.0461 Da; putative annotation: N/A; putative formula: C3H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.175,"smiles":null,"spectrum_id":"CCMSLIB00017281872","spectrum_index":35079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 1057.6231 Da; putative annotation: N/A; putative formula: C57H79N13O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1212.66,"smiles":null,"spectrum_id":"CCMSLIB00017281875","spectrum_index":35080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 64.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.148,"smiles":null,"spectrum_id":"CCMSLIB00017281878","spectrum_index":35081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 713.4401 Da; putative annotation: N/A; putative formula: C43H59N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.51,"smiles":null,"spectrum_id":"CCMSLIB00017281879","spectrum_index":35082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 42.0533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017281882","spectrum_index":35083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 25.9116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.993,"smiles":null,"spectrum_id":"CCMSLIB00017281885","spectrum_index":35084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 496.4389 Da; putative annotation: N/A; putative formula: C33H56N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.52,"smiles":null,"spectrum_id":"CCMSLIB00017281886","spectrum_index":35085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 131.5639 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.635,"smiles":null,"spectrum_id":"CCMSLIB00017281889","spectrum_index":35086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)benzamide (delta mass: 40.0165 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.15,"smiles":null,"spectrum_id":"CCMSLIB00017281892","spectrum_index":35087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 189.0786 Da; putative annotation: N/A; putative formula: C11H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.154,"smiles":null,"spectrum_id":"CCMSLIB00017281895","spectrum_index":35088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 120.0653 Da; putative annotation: N/A; putative formula: C2H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.124,"smiles":null,"spectrum_id":"CCMSLIB00017281896","spectrum_index":35089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 164.0327 Da; putative annotation: N/A; putative formula: C6H12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.113,"smiles":null,"spectrum_id":"CCMSLIB00017281899","spectrum_index":35090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 131.084 Da; putative annotation: N/A; putative formula: C8H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.202,"smiles":null,"spectrum_id":"CCMSLIB00017281902","spectrum_index":35091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 130.714 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.847,"smiles":null,"spectrum_id":"CCMSLIB00017281905","spectrum_index":35092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,7,8-trimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 105.0429 Da; putative annotation: N/A; putative formula: C3H7NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.15,"smiles":null,"spectrum_id":"CCMSLIB00017281906","spectrum_index":35093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 131.9933 Da; putative annotation: N/A; putative formula: C2H4N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.101,"smiles":null,"spectrum_id":"CCMSLIB00017281909","spectrum_index":35094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 101.0703 Da; putative annotation: N/A; putative formula: C2H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.13,"smiles":null,"spectrum_id":"CCMSLIB00017281912","spectrum_index":35095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 44.0495 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.136,"smiles":null,"spectrum_id":"CCMSLIB00017281915","spectrum_index":35096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 38.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.211,"smiles":null,"spectrum_id":"CCMSLIB00017281916","spectrum_index":35097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 62.0523 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.358,"smiles":null,"spectrum_id":"CCMSLIB00017281919","spectrum_index":35098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 36.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.139,"smiles":null,"spectrum_id":"CCMSLIB00017281922","spectrum_index":35099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 161.1941 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.265,"smiles":null,"spectrum_id":"CCMSLIB00017281923","spectrum_index":35100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 137.0841 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.176,"smiles":null,"spectrum_id":"CCMSLIB00017281926","spectrum_index":35101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 87.0682 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017281929","spectrum_index":35102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 64.0277 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.099,"smiles":null,"spectrum_id":"CCMSLIB00017281930","spectrum_index":35103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 108.0946 Da; putative annotation: N/A; putative formula: C8H12)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.155,"smiles":null,"spectrum_id":"CCMSLIB00017281933","spectrum_index":35104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 48.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.102,"smiles":null,"spectrum_id":"CCMSLIB00017281936","spectrum_index":35105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 59.0367 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.159,"smiles":null,"spectrum_id":"CCMSLIB00017281939","spectrum_index":35106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 65.0495 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017281940","spectrum_index":35107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Leu (delta mass: 27.9955 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.124,"smiles":null,"spectrum_id":"CCMSLIB00017281943","spectrum_index":35108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 99.0404 Da; putative annotation: N/A; putative formula: C3H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.116,"smiles":null,"spectrum_id":"CCMSLIB00017281946","spectrum_index":35109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 189.9126 Da; putative annotation: N/A; putative formula: C3H-2N2O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.999,"smiles":null,"spectrum_id":"CCMSLIB00017281947","spectrum_index":35110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-8-methyl-2-(2-pyridinyl)-4-quinolinecarboxylic acid (delta mass: 18.0073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.065,"smiles":null,"spectrum_id":"CCMSLIB00017281950","spectrum_index":35111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 282.0697 Da; putative annotation: N/A; putative formula: C6H2N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.13,"smiles":null,"spectrum_id":"CCMSLIB00017281953","spectrum_index":35112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087703 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 121.0374 Da; putative annotation: N/A; putative formula: C3H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017281956","spectrum_index":35113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 85.0492 Da; putative annotation: N/A; putative formula: H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.13,"smiles":null,"spectrum_id":"CCMSLIB00017281957","spectrum_index":35114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 26.9881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.064,"smiles":null,"spectrum_id":"CCMSLIB00017281960","spectrum_index":35115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 46.0049 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.138,"smiles":null,"spectrum_id":"CCMSLIB00017281963","spectrum_index":35116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 180.0311 Da; putative annotation: N/A; putative formula: C5H13N2O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017281965","spectrum_index":35117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 111.0326 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.177,"smiles":null,"spectrum_id":"CCMSLIB00017281968","spectrum_index":35118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 60.0269 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.075,"smiles":null,"spectrum_id":"CCMSLIB00017281970","spectrum_index":35119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 73.0531 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.155,"smiles":null,"spectrum_id":"CCMSLIB00017281973","spectrum_index":35120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 55.0787 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017281976","spectrum_index":35121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 18.0188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.105,"smiles":null,"spectrum_id":"CCMSLIB00017281977","spectrum_index":35122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 113.0802 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.219,"smiles":null,"spectrum_id":"CCMSLIB00017281980","spectrum_index":35123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 674.4068 Da; putative annotation: N/A; putative formula: C36H66O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1179.58,"smiles":null,"spectrum_id":"CCMSLIB00017281983","spectrum_index":35124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 764.4361 Da; putative annotation: N/A; putative formula: C42H60N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.507,"smiles":null,"spectrum_id":"CCMSLIB00017281986","spectrum_index":35125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 36.0175 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.177,"smiles":null,"spectrum_id":"CCMSLIB00017281987","spectrum_index":35126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 376.1366 Da; putative annotation: N/A; putative formula: C29H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.286,"smiles":null,"spectrum_id":"CCMSLIB00017281990","spectrum_index":35127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 421.2284 Da; putative annotation: N/A; putative formula: C15H31N7O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.352,"smiles":null,"spectrum_id":"CCMSLIB00017281993","spectrum_index":35128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-ylmethylene)malononitrile (delta mass: 171.0887 Da; putative annotation: N/A; putative formula: C8H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.16,"smiles":null,"spectrum_id":"CCMSLIB00017281996","spectrum_index":35129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 32.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.078,"smiles":null,"spectrum_id":"CCMSLIB00017281997","spectrum_index":35130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 62.0004 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.097,"smiles":null,"spectrum_id":"CCMSLIB00017282000","spectrum_index":35131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CloxacillinNa (delta mass: 180.0641 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.137,"smiles":null,"spectrum_id":"CCMSLIB00017282003","spectrum_index":35132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 208.0676 Da; putative annotation: N/A; putative formula: C18H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.191,"smiles":null,"spectrum_id":"CCMSLIB00017282006","spectrum_index":35133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 669.4139 Da; putative annotation: N/A; putative formula: C41H55N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.484,"smiles":null,"spectrum_id":"CCMSLIB00017282007","spectrum_index":35134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 202.1534 Da; putative annotation: N/A; putative formula: C7H18N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.196,"smiles":null,"spectrum_id":"CCMSLIB00017282010","spectrum_index":35135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 143.0407 Da; putative annotation: N/A; putative formula: C6H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.117,"smiles":null,"spectrum_id":"CCMSLIB00017282013","spectrum_index":35136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 52.0677 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.134,"smiles":null,"spectrum_id":"CCMSLIB00017282015","spectrum_index":35137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 121.0774 Da; putative annotation: N/A; putative formula: C5H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.112,"smiles":null,"spectrum_id":"CCMSLIB00017282017","spectrum_index":35138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C4:0 (delta mass: 350.0994 Da; putative annotation: N/A; putative formula: C11H19N4O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.228,"smiles":null,"spectrum_id":"CCMSLIB00017282020","spectrum_index":35139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 60.0363 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.169,"smiles":null,"spectrum_id":"CCMSLIB00017282023","spectrum_index":35140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 637.2102 Da; putative annotation: N/A; putative formula: C33H39N3O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":818.251,"smiles":null,"spectrum_id":"CCMSLIB00017282024","spectrum_index":35141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 117.0419 Da; putative annotation: N/A; putative formula: C4H7NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.129,"smiles":null,"spectrum_id":"CCMSLIB00017282027","spectrum_index":35142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 126.9967 Da; putative annotation: N/A; putative formula: C2HN5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.065,"smiles":null,"spectrum_id":"CCMSLIB00017282030","spectrum_index":35143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 109.0412 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.174,"smiles":null,"spectrum_id":"CCMSLIB00017282033","spectrum_index":35144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-4-quinolinecarboxylic acid (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.097,"smiles":null,"spectrum_id":"CCMSLIB00017282034","spectrum_index":35145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 51.9971 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.099,"smiles":null,"spectrum_id":"CCMSLIB00017282037","spectrum_index":35146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 156.1303 Da; putative annotation: N/A; putative formula: C13H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.307,"smiles":null,"spectrum_id":"CCMSLIB00017282040","spectrum_index":35147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 342.168 Da; putative annotation: N/A; putative formula: C17H26O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.322,"smiles":null,"spectrum_id":"CCMSLIB00017282041","spectrum_index":35148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 234.2346 Da; putative annotation: N/A; putative formula: C17H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.321,"smiles":null,"spectrum_id":"CCMSLIB00017282044","spectrum_index":35149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 938.4048 Da; putative annotation: N/A; putative formula: C48H62N2O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1248.52,"smiles":null,"spectrum_id":"CCMSLIB00017282047","spectrum_index":35150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 118.0781 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.222,"smiles":null,"spectrum_id":"CCMSLIB00017282050","spectrum_index":35151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 99.0473 Da; putative annotation: N/A; putative formula: C8H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.171,"smiles":null,"spectrum_id":"CCMSLIB00017282051","spectrum_index":35152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ticarcillin (delta mass: 42.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.068,"smiles":null,"spectrum_id":"CCMSLIB00017282054","spectrum_index":35153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 99.1775 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.217,"smiles":null,"spectrum_id":"CCMSLIB00017282056","spectrum_index":35154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 961.71 Da; putative annotation: N/A; putative formula: C70H91NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1345.86,"smiles":null,"spectrum_id":"CCMSLIB00017282059","spectrum_index":35155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 130.0778 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.231,"smiles":null,"spectrum_id":"CCMSLIB00017282061","spectrum_index":35156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 54.0165 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.114,"smiles":null,"spectrum_id":"CCMSLIB00017282064","spectrum_index":35157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 298.0939 Da; putative annotation: N/A; putative formula: C10H23N2O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.159,"smiles":null,"spectrum_id":"CCMSLIB00017282067","spectrum_index":35158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 115.0743 Da; putative annotation: N/A; putative formula: C4H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.176,"smiles":null,"spectrum_id":"CCMSLIB00017282068","spectrum_index":35159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 355.1628 Da; putative annotation: N/A; putative formula: C17H25NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.223,"smiles":null,"spectrum_id":"CCMSLIB00017282071","spectrum_index":35160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 424.2829 Da; putative annotation: N/A; putative formula: C24H40O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.374,"smiles":null,"spectrum_id":"CCMSLIB00017282074","spectrum_index":35161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 144.0936 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.149,"smiles":null,"spectrum_id":"CCMSLIB00017282076","spectrum_index":35162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 188.1055 Da; putative annotation: N/A; putative formula: C10H20O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.171,"smiles":null,"spectrum_id":"CCMSLIB00017282078","spectrum_index":35163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrexone (delta mass: 28.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.238,"smiles":null,"spectrum_id":"CCMSLIB00017282081","spectrum_index":35164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hernagine (delta mass: 34.1148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.269,"smiles":null,"spectrum_id":"CCMSLIB00017282084","spectrum_index":35165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 257.1016 Da; putative annotation: N/A; putative formula: C12H22NO-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.235,"smiles":null,"spectrum_id":"CCMSLIB00017282086","spectrum_index":35166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 322.0863 Da; putative annotation: N/A; putative formula: C13H10N10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.183,"smiles":null,"spectrum_id":"CCMSLIB00017282088","spectrum_index":35167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 19.8237 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017282091","spectrum_index":35168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01041 Hexahydrocurcumin (delta mass: 156.0569 Da; putative annotation: N/A; putative formula: C5H9N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.237,"smiles":null,"spectrum_id":"CCMSLIB00017282094","spectrum_index":35169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 108.0466 Da; putative annotation: N/A; putative formula: C7H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.19,"smiles":null,"spectrum_id":"CCMSLIB00017282095","spectrum_index":35170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 762.0125 Da; putative annotation: N/A; putative formula: C36H22N6O2S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":984.11,"smiles":null,"spectrum_id":"CCMSLIB00017282098","spectrum_index":35171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 104.0108 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017282101","spectrum_index":35172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311082 Dicoumaroyl Spermidine (delta mass: 146.1158 Da; putative annotation: N/A; putative formula: C5H14N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.354,"smiles":null,"spectrum_id":"CCMSLIB00017282104","spectrum_index":35173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 120.0307 Da; putative annotation: N/A; putative formula: C2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.17,"smiles":null,"spectrum_id":"CCMSLIB00017282106","spectrum_index":35174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 88.015 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.112,"smiles":null,"spectrum_id":"CCMSLIB00017282109","spectrum_index":35175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 111.8939 Da; putative annotation: N/A; putative formula: O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.98,"smiles":null,"spectrum_id":"CCMSLIB00017282111","spectrum_index":35176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 61.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.253,"smiles":null,"spectrum_id":"CCMSLIB00017282114","spectrum_index":35177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 155.1158 Da; putative annotation: N/A; putative formula: C6H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.269,"smiles":null,"spectrum_id":"CCMSLIB00017282117","spectrum_index":35178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 124.0973 Da; putative annotation: N/A; putative formula: C7H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.175,"smiles":null,"spectrum_id":"CCMSLIB00017282119","spectrum_index":35179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 26.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.117,"smiles":null,"spectrum_id":"CCMSLIB00017282121","spectrum_index":35180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 315.1641 Da; putative annotation: N/A; putative formula: C15H21N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.303,"smiles":null,"spectrum_id":"CCMSLIB00017282124","spectrum_index":35181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 481.7507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.864,"smiles":null,"spectrum_id":"CCMSLIB00017282127","spectrum_index":35182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-homoectoine (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.108,"smiles":null,"spectrum_id":"CCMSLIB00017282130","spectrum_index":35183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 84.0574 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.337,"smiles":null,"spectrum_id":"CCMSLIB00017282131","spectrum_index":35184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 242.1303 Da; putative annotation: N/A; putative formula: C16H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.175,"smiles":null,"spectrum_id":"CCMSLIB00017282134","spectrum_index":35185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 94.042 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017282137","spectrum_index":35186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Atropic acid (delta mass: 46.0072 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.067,"smiles":null,"spectrum_id":"CCMSLIB00017282140","spectrum_index":35187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 117.0612 Da; putative annotation: N/A; putative formula: C5H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.143,"smiles":null,"spectrum_id":"CCMSLIB00017282141","spectrum_index":35188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 160.0493 Da; putative annotation: N/A; putative formula: C6H12N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.188,"smiles":null,"spectrum_id":"CCMSLIB00017282144","spectrum_index":35189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 131.1022 Da; putative annotation: N/A; putative formula: CH9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.277,"smiles":null,"spectrum_id":"CCMSLIB00017282147","spectrum_index":35190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 159.0394 Da; putative annotation: N/A; putative formula: C3H5N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.126,"smiles":null,"spectrum_id":"CCMSLIB00017282148","spectrum_index":35191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 74.0247 Da; putative annotation: N/A; putative formula: H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.091,"smiles":null,"spectrum_id":"CCMSLIB00017282151","spectrum_index":35192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole_3_acetamide (delta mass: 51.0566 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.143,"smiles":null,"spectrum_id":"CCMSLIB00017282154","spectrum_index":35193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 404.0715 Da; putative annotation: N/A; putative formula: C15H12N6O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.142,"smiles":null,"spectrum_id":"CCMSLIB00017282157","spectrum_index":35194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 353.1109 Da; putative annotation: N/A; putative formula: C16H19NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.187,"smiles":null,"spectrum_id":"CCMSLIB00017282158","spectrum_index":35195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 124.1447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.273,"smiles":null,"spectrum_id":"CCMSLIB00017282161","spectrum_index":35196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 276.1349 Da; putative annotation: N/A; putative formula: C10H21N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.202,"smiles":null,"spectrum_id":"CCMSLIB00017282164","spectrum_index":35197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 146.0687 Da; putative annotation: N/A; putative formula: C7H15O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.228,"smiles":null,"spectrum_id":"CCMSLIB00017282167","spectrum_index":35198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine - 40.0 eV (delta mass: 18.055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.141,"smiles":null,"spectrum_id":"CCMSLIB00017282168","spectrum_index":35199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 98.045 Da; putative annotation: N/A; putative formula: H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.125,"smiles":null,"spectrum_id":"CCMSLIB00017282171","spectrum_index":35200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 286.2305 Da; putative annotation: N/A; putative formula: C13H30N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.506,"smiles":null,"spectrum_id":"CCMSLIB00017282174","spectrum_index":35201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 128.0223 Da; putative annotation: N/A; putative formula: C4H4N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.192,"smiles":null,"spectrum_id":"CCMSLIB00017282177","spectrum_index":35202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 394.1162 Da; putative annotation: N/A; putative formula: C21H18N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.187,"smiles":null,"spectrum_id":"CCMSLIB00017282178","spectrum_index":35203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 153.0061 Da; putative annotation: N/A; putative formula: C6H3NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.113,"smiles":null,"spectrum_id":"CCMSLIB00017282181","spectrum_index":35204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110001 Salbutamol|Albuterol|4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol (delta mass: 100.0315 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.191,"smiles":null,"spectrum_id":"CCMSLIB00017282184","spectrum_index":35205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 129.0456 Da; putative annotation: N/A; putative formula: C4H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.121,"smiles":null,"spectrum_id":"CCMSLIB00017282185","spectrum_index":35206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 123.0533 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.155,"smiles":null,"spectrum_id":"CCMSLIB00017282188","spectrum_index":35207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 53.8536 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.896,"smiles":null,"spectrum_id":"CCMSLIB00017282191","spectrum_index":35208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 221.0692 Da; putative annotation: N/A; putative formula: C6H8N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.212,"smiles":null,"spectrum_id":"CCMSLIB00017282194","spectrum_index":35209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 446.2612 Da; putative annotation: N/A; putative formula: C18H30N12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.347,"smiles":null,"spectrum_id":"CCMSLIB00017282195","spectrum_index":35210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 209.2136 Da; putative annotation: N/A; putative formula: C14H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.284,"smiles":null,"spectrum_id":"CCMSLIB00017282198","spectrum_index":35211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 63.0782 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.154,"smiles":null,"spectrum_id":"CCMSLIB00017282201","spectrum_index":35212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 104.0544 Da; putative annotation: N/A; putative formula: C2H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.135,"smiles":null,"spectrum_id":"CCMSLIB00017282203","spectrum_index":35213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 330.2202 Da; putative annotation: N/A; putative formula: C21H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.344,"smiles":null,"spectrum_id":"CCMSLIB00017282206","spectrum_index":35214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 140.0991 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017282209","spectrum_index":35215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 368.3033 Da; putative annotation: N/A; putative formula: C23H45O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.39,"smiles":null,"spectrum_id":"CCMSLIB00017282211","spectrum_index":35216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 335.1057 Da; putative annotation: N/A; putative formula: C22H13N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.186,"smiles":null,"spectrum_id":"CCMSLIB00017282214","spectrum_index":35217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 192.1151 Da; putative annotation: N/A; putative formula: C12H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.186,"smiles":null,"spectrum_id":"CCMSLIB00017282216","spectrum_index":35218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 99.0682 Da; putative annotation: L-Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.192,"smiles":null,"spectrum_id":"CCMSLIB00017282219","spectrum_index":35219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 273.0844 Da; putative annotation: N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy-; putative formula: C11H15NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.234,"smiles":null,"spectrum_id":"CCMSLIB00017282222","spectrum_index":35220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 130.0665 Da; putative annotation: 1-Methyl-1H-pyrazolo[3,4-b]pyridin-3-ylamine; putative formula: C7H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.137,"smiles":null,"spectrum_id":"CCMSLIB00017282225","spectrum_index":35221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 147.1046 Da; putative annotation: (.+/-.)-Anatoxin A; putative formula: C10H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.196,"smiles":null,"spectrum_id":"CCMSLIB00017282226","spectrum_index":35222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 280.0364 Da; putative annotation: 2-Amino-4-(4-chlorophenyl)-7-hydroxy-4H-chromene-3-carbonitrile; putative formula: C16H9ClN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.096,"smiles":null,"spectrum_id":"CCMSLIB00017282229","spectrum_index":35223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 146.036 Da; putative annotation: 3-Coumaric acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.127,"smiles":null,"spectrum_id":"CCMSLIB00017282232","spectrum_index":35224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 264.0427 Da; putative annotation: Damnacanthal; putative formula: C16H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.103,"smiles":null,"spectrum_id":"CCMSLIB00017282235","spectrum_index":35225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 177.1553 Da; putative annotation: N/A; putative formula: C12H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.203,"smiles":null,"spectrum_id":"CCMSLIB00017282236","spectrum_index":35226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML01010 Demecolcine (delta mass: 311.0647 Da; putative annotation: N/A; putative formula: C16H14N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.245,"smiles":null,"spectrum_id":"CCMSLIB00017282239","spectrum_index":35227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 290.1007 Da; putative annotation: N/A; putative formula: C15H19N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.25,"smiles":null,"spectrum_id":"CCMSLIB00017282242","spectrum_index":35228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 300.0838 Da; putative annotation: N/A; putative formula: C18H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.233,"smiles":null,"spectrum_id":"CCMSLIB00017282244","spectrum_index":35229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 130.0437 Da; putative annotation: N/A; putative formula: C2H6N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.13,"smiles":null,"spectrum_id":"CCMSLIB00017282247","spectrum_index":35230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.128,"smiles":null,"spectrum_id":"CCMSLIB00017282250","spectrum_index":35231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 92.0469 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.196,"smiles":null,"spectrum_id":"CCMSLIB00017282252","spectrum_index":35232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 158.1231 Da; putative annotation: N/A; putative formula: C9H19P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.294,"smiles":null,"spectrum_id":"CCMSLIB00017282255","spectrum_index":35233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 28.9901 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.076,"smiles":null,"spectrum_id":"CCMSLIB00017282258","spectrum_index":35234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 64.1251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.222,"smiles":null,"spectrum_id":"CCMSLIB00017282261","spectrum_index":35235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 136.1297 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.2,"smiles":null,"spectrum_id":"CCMSLIB00017282262","spectrum_index":35236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 100.0677 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017282265","spectrum_index":35237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 229.168 Da; putative annotation: N/A; putative formula: C12H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.301,"smiles":null,"spectrum_id":"CCMSLIB00017282268","spectrum_index":35238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 92.0515 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.19,"smiles":null,"spectrum_id":"CCMSLIB00017282270","spectrum_index":35239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 151.0366 Da; putative annotation: N/A; putative formula: C2HN9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.112,"smiles":null,"spectrum_id":"CCMSLIB00017282273","spectrum_index":35240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 995.5106 Da; putative annotation: N/A; putative formula: C54H82N3O6PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1176.58,"smiles":null,"spectrum_id":"CCMSLIB00017282276","spectrum_index":35241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 131.9165 Da; putative annotation: N/A; putative formula: C3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.983,"smiles":null,"spectrum_id":"CCMSLIB00017282278","spectrum_index":35242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 44.0253 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.148,"smiles":null,"spectrum_id":"CCMSLIB00017282281","spectrum_index":35243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 313.1379 Da; putative annotation: N/A; putative formula: C14H24N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.287,"smiles":null,"spectrum_id":"CCMSLIB00017282284","spectrum_index":35244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 884.4678 Da; putative annotation: N/A; putative formula: C61H56N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1211.6,"smiles":null,"spectrum_id":"CCMSLIB00017282287","spectrum_index":35245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-methyl-4-(pyridin-2-yl)but-3-yn-2-ol (delta mass: 239.2516 Da; putative annotation: N/A; putative formula: C13H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.343,"smiles":null,"spectrum_id":"CCMSLIB00017282289","spectrum_index":35246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 268.1137 Da; putative annotation: N/A; putative formula: C14H20O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.267,"smiles":null,"spectrum_id":"CCMSLIB00017282291","spectrum_index":35247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 113.084 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017282294","spectrum_index":35248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 14.0174 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.094,"smiles":null,"spectrum_id":"CCMSLIB00017282297","spectrum_index":35249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 16.8963 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.972,"smiles":null,"spectrum_id":"CCMSLIB00017282300","spectrum_index":35250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Asp (delta mass: 113.085 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.214,"smiles":null,"spectrum_id":"CCMSLIB00017282301","spectrum_index":35251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-Binaphthyl-8,8'-dicarboxylic acid (delta mass: 45.0273 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.124,"smiles":null,"spectrum_id":"CCMSLIB00017282304","spectrum_index":35252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 192.0578 Da; putative annotation: N/A; putative formula: C14H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.181,"smiles":null,"spectrum_id":"CCMSLIB00017282307","spectrum_index":35253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 172.0526 Da; putative annotation: N/A; putative formula: C11H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.113,"smiles":null,"spectrum_id":"CCMSLIB00017282309","spectrum_index":35254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 234.2336 Da; putative annotation: N/A; putative formula: C17H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.325,"smiles":null,"spectrum_id":"CCMSLIB00017282311","spectrum_index":35255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 99.0682 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.201,"smiles":null,"spectrum_id":"CCMSLIB00017282315","spectrum_index":35256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 226.0516 Da; putative annotation: N/A; putative formula: C7H14O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.14,"smiles":null,"spectrum_id":"CCMSLIB00017282317","spectrum_index":35257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 901.5021 Da; putative annotation: N/A; putative formula: C42H67N11O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1064.56,"smiles":null,"spectrum_id":"CCMSLIB00017282320","spectrum_index":35258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 98.0732 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.17,"smiles":null,"spectrum_id":"CCMSLIB00017282323","spectrum_index":35259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101903 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 179.0791 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.165,"smiles":null,"spectrum_id":"CCMSLIB00017282325","spectrum_index":35260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 26.0516 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.149,"smiles":null,"spectrum_id":"CCMSLIB00017282327","spectrum_index":35261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 29.0262 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017282330","spectrum_index":35262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 264.1528 Da; putative annotation: N/A; putative formula: C12H20N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.286,"smiles":null,"spectrum_id":"CCMSLIB00017282333","spectrum_index":35263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 313.1368 Da; putative annotation: N/A; putative formula: C11H23NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.176,"smiles":null,"spectrum_id":"CCMSLIB00017282336","spectrum_index":35264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 67.0195 Da; putative annotation: N/A; putative formula: C2HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017282337","spectrum_index":35265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 352.1176 Da; putative annotation: N/A; putative formula: C18H26OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.193,"smiles":null,"spectrum_id":"CCMSLIB00017282340","spectrum_index":35266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 459.1455 Da; putative annotation: N/A; putative formula: C26H27N3O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.205,"smiles":null,"spectrum_id":"CCMSLIB00017282343","spectrum_index":35267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 73.0519 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.123,"smiles":null,"spectrum_id":"CCMSLIB00017282345","spectrum_index":35268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 82.0408 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.164,"smiles":null,"spectrum_id":"CCMSLIB00017282347","spectrum_index":35269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 97.0532 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.134,"smiles":null,"spectrum_id":"CCMSLIB00017282350","spectrum_index":35270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 228.0787 Da; putative annotation: N/A; putative formula: C14H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.154,"smiles":null,"spectrum_id":"CCMSLIB00017282353","spectrum_index":35271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Statine (delta mass: 138.1403 Da; putative annotation: N/A; putative formula: C10H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.268,"smiles":null,"spectrum_id":"CCMSLIB00017282354","spectrum_index":35272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 109.0319 Da; putative annotation: N/A; putative formula: C9H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.14,"smiles":null,"spectrum_id":"CCMSLIB00017282357","spectrum_index":35273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 281.1093 Da; putative annotation: N/A; putative formula: C7H11N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.19,"smiles":null,"spectrum_id":"CCMSLIB00017282360","spectrum_index":35274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyimipramine (delta mass: 177.0736 Da; putative annotation: N/A; putative formula: C7H16NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.27,"smiles":null,"spectrum_id":"CCMSLIB00017282362","spectrum_index":35275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 219.0365 Da; putative annotation: N/A; putative formula: C4HN11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.138,"smiles":null,"spectrum_id":"CCMSLIB00017282364","spectrum_index":35276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 269.1104 Da; putative annotation: N/A; putative formula: C14H15N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.191,"smiles":null,"spectrum_id":"CCMSLIB00017282367","spectrum_index":35277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 537.3655 Da; putative annotation: N/A; putative formula: C34H53NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.498,"smiles":null,"spectrum_id":"CCMSLIB00017282370","spectrum_index":35278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 876.4858 Da; putative annotation: N/A; putative formula: C44H64N10O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1223.61,"smiles":null,"spectrum_id":"CCMSLIB00017282373","spectrum_index":35279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 237.9238 Da; putative annotation: N/A; putative formula: C5H2O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.004,"smiles":null,"spectrum_id":"CCMSLIB00017282374","spectrum_index":35280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1H-Benzimidazol-2-ylsulfanyl)furan--2-carbaldehyde (delta mass: 267.1387 Da; putative annotation: N/A; putative formula: C14H22NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.177,"smiles":null,"spectrum_id":"CCMSLIB00017282377","spectrum_index":35281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 321.1469 Da; putative annotation: N/A; putative formula: C13H20N7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.238,"smiles":null,"spectrum_id":"CCMSLIB00017282380","spectrum_index":35282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 604.606 Da; putative annotation: N/A; putative formula: C43H76N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.677,"smiles":null,"spectrum_id":"CCMSLIB00017282382","spectrum_index":35283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 517.1487 Da; putative annotation: N/A; putative formula: C20H31N5O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.235,"smiles":null,"spectrum_id":"CCMSLIB00017282385","spectrum_index":35284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 670.3222 Da; putative annotation: N/A; putative formula: C27H46N10O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.414,"smiles":null,"spectrum_id":"CCMSLIB00017282387","spectrum_index":35285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 27.0041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.126,"smiles":null,"spectrum_id":"CCMSLIB00017282390","spectrum_index":35286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 84.152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.247,"smiles":null,"spectrum_id":"CCMSLIB00017282393","spectrum_index":35287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Val (delta mass: 163.0631 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.197,"smiles":null,"spectrum_id":"CCMSLIB00017282396","spectrum_index":35288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 9.0443 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.141,"smiles":null,"spectrum_id":"CCMSLIB00017282397","spectrum_index":35289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 64.02 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.17,"smiles":null,"spectrum_id":"CCMSLIB00017282400","spectrum_index":35290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroergotamine (delta mass: 583.2795 Da; putative annotation: N/A; putative formula: C33H37N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1167.57,"smiles":null,"spectrum_id":"CCMSLIB00017282403","spectrum_index":35291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 25.056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.067,"smiles":null,"spectrum_id":"CCMSLIB00017282405","spectrum_index":35292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 18.0559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.099,"smiles":null,"spectrum_id":"CCMSLIB00017282408","spectrum_index":35293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 1092.4774 Da; putative annotation: N/A; putative formula: C67H68N2O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1247.55,"smiles":null,"spectrum_id":"CCMSLIB00017282410","spectrum_index":35294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 162.0531 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.144,"smiles":null,"spectrum_id":"CCMSLIB00017282413","spectrum_index":35295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 136.0735 Da; putative annotation: N/A; putative formula: C6H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.154,"smiles":null,"spectrum_id":"CCMSLIB00017282416","spectrum_index":35296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 116.029 Da; putative annotation: N/A; putative formula: C5H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.1,"smiles":null,"spectrum_id":"CCMSLIB00017282419","spectrum_index":35297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 175.0303 Da; putative annotation: N/A; putative formula: C6H9NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.148,"smiles":null,"spectrum_id":"CCMSLIB00017282420","spectrum_index":35298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-threonine; LC-tDDA; CE10 (delta mass: 71.0339 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.11,"smiles":null,"spectrum_id":"CCMSLIB00017282423","spectrum_index":35299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 165.9988 Da; putative annotation: N/A; putative formula: C2H-2N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.06,"smiles":null,"spectrum_id":"CCMSLIB00017282426","spectrum_index":35300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 340.0413 Da; putative annotation: N/A; putative formula: C11H12N6O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.165,"smiles":null,"spectrum_id":"CCMSLIB00017282428","spectrum_index":35301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxindole; LC-tDDA; CE30 (delta mass: 40.0323 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.108,"smiles":null,"spectrum_id":"CCMSLIB00017282430","spectrum_index":35302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 54.0511 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.117,"smiles":null,"spectrum_id":"CCMSLIB00017282433","spectrum_index":35303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 54.0349 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.101,"smiles":null,"spectrum_id":"CCMSLIB00017282436","spectrum_index":35304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 114.0243 Da; putative annotation: N/A; putative formula: C5H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.178,"smiles":null,"spectrum_id":"CCMSLIB00017282439","spectrum_index":35305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 39.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.071,"smiles":null,"spectrum_id":"CCMSLIB00017282441","spectrum_index":35306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 95.0721 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.132,"smiles":null,"spectrum_id":"CCMSLIB00017282443","spectrum_index":35307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1015.6655 Da; putative annotation: N/A; putative formula: C48H85N15O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.73,"smiles":null,"spectrum_id":"CCMSLIB00017282446","spectrum_index":35308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 455.3372 Da; putative annotation: N/A; putative formula: C25H41N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.408,"smiles":null,"spectrum_id":"CCMSLIB00017282449","spectrum_index":35309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 61.9913 Da; putative annotation: N/A; putative formula: C3H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.094,"smiles":null,"spectrum_id":"CCMSLIB00017282452","spectrum_index":35310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 310.1311 Da; putative annotation: N/A; putative formula: C20H23O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.244,"smiles":null,"spectrum_id":"CCMSLIB00017282453","spectrum_index":35311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 611.1697 Da; putative annotation: N/A; putative formula: C39H26N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.23,"smiles":null,"spectrum_id":"CCMSLIB00017282456","spectrum_index":35312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 249.1715 Da; putative annotation: N/A; putative formula: C11H19N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.295,"smiles":null,"spectrum_id":"CCMSLIB00017282458","spectrum_index":35313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 105.0557 Da; putative annotation: N/A; putative formula: CH8N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.152,"smiles":null,"spectrum_id":"CCMSLIB00017282461","spectrum_index":35314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 138.0561 Da; putative annotation: N/A; putative formula: C5H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.19,"smiles":null,"spectrum_id":"CCMSLIB00017282464","spectrum_index":35315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hydroquinidine (delta mass: 42.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.223,"smiles":null,"spectrum_id":"CCMSLIB00017282466","spectrum_index":35316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 295.1627 Da; putative annotation: N/A; putative formula: C12H25NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.311,"smiles":null,"spectrum_id":"CCMSLIB00017282469","spectrum_index":35317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 492.4555 Da; putative annotation: N/A; putative formula: C33H56N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.563,"smiles":null,"spectrum_id":"CCMSLIB00017282472","spectrum_index":35318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 76.0163 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.097,"smiles":null,"spectrum_id":"CCMSLIB00017282474","spectrum_index":35319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 42.1598 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.255,"smiles":null,"spectrum_id":"CCMSLIB00017282476","spectrum_index":35320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 657.5173 Da; putative annotation: N/A; putative formula: C37H71NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":820.577,"smiles":null,"spectrum_id":"CCMSLIB00017282479","spectrum_index":35321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 19.0134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.073,"smiles":null,"spectrum_id":"CCMSLIB00017282482","spectrum_index":35322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 58.0287 Da; putative annotation: N/A; putative formula: H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017282484","spectrum_index":35323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 182.1491 Da; putative annotation: N/A; putative formula: C12H22O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.341,"smiles":null,"spectrum_id":"CCMSLIB00017282486","spectrum_index":35324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 295.1509 Da; putative annotation: N/A; putative formula: C18H21N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.237,"smiles":null,"spectrum_id":"CCMSLIB00017282489","spectrum_index":35325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 156.1302 Da; putative annotation: N/A; putative formula: C13H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.307,"smiles":null,"spectrum_id":"CCMSLIB00017282492","spectrum_index":35326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 205.9699 Da; putative annotation: N/A; putative formula: C5H2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.093,"smiles":null,"spectrum_id":"CCMSLIB00017282493","spectrum_index":35327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 254.1883 Da; putative annotation: N/A; putative formula: C15H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.259,"smiles":null,"spectrum_id":"CCMSLIB00017282496","spectrum_index":35328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 115.0629 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.128,"smiles":null,"spectrum_id":"CCMSLIB00017282499","spectrum_index":35329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 880.5197 Da; putative annotation: N/A; putative formula: C46H60N18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1211.67,"smiles":null,"spectrum_id":"CCMSLIB00017282501","spectrum_index":35330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 293.1413 Da; putative annotation: N/A; putative formula: C19H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.265,"smiles":null,"spectrum_id":"CCMSLIB00017282503","spectrum_index":35331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 171.1622 Da; putative annotation: N/A; putative formula: C10H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.227,"smiles":null,"spectrum_id":"CCMSLIB00017282506","spectrum_index":35332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 140.0992 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017282509","spectrum_index":35333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 71.0378 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.124,"smiles":null,"spectrum_id":"CCMSLIB00017282512","spectrum_index":35334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 548.3767 Da; putative annotation: N/A; putative formula: C38H48N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.49,"smiles":null,"spectrum_id":"CCMSLIB00017282514","spectrum_index":35335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 59.049 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.147,"smiles":null,"spectrum_id":"CCMSLIB00017282516","spectrum_index":35336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 228.1103 Da; putative annotation: N/A; putative formula: C12H21PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.244,"smiles":null,"spectrum_id":"CCMSLIB00017282519","spectrum_index":35337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 107.0738 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.176,"smiles":null,"spectrum_id":"CCMSLIB00017282522","spectrum_index":35338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Propionylcarnitine (delta mass: 90.0469 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.186,"smiles":null,"spectrum_id":"CCMSLIB00017282525","spectrum_index":35339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 162.0532 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017282527","spectrum_index":35340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 45.0097 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.148,"smiles":null,"spectrum_id":"CCMSLIB00017282530","spectrum_index":35341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 18.0897 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.138,"smiles":null,"spectrum_id":"CCMSLIB00017282533","spectrum_index":35342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 190.1204 Da; putative annotation: N/A; putative formula: C9H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.274,"smiles":null,"spectrum_id":"CCMSLIB00017282536","spectrum_index":35343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 191.1819 Da; putative annotation: N/A; putative formula: C12H21N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.23,"smiles":null,"spectrum_id":"CCMSLIB00017282538","spectrum_index":35344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 226.1 Da; putative annotation: N/A; putative formula: C8H14N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017282541","spectrum_index":35345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 184.0622 Da; putative annotation: N/A; putative formula: C5H9N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.181,"smiles":null,"spectrum_id":"CCMSLIB00017282544","spectrum_index":35346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyltapentadol (delta mass: 45.0102 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.18,"smiles":null,"spectrum_id":"CCMSLIB00017282547","spectrum_index":35347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310692 Disaccharide(Hex-Hex) (delta mass: 114.0387 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.162,"smiles":null,"spectrum_id":"CCMSLIB00017282550","spectrum_index":35348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 663.4919 Da; putative annotation: N/A; putative formula: C35H69NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":826.552,"smiles":null,"spectrum_id":"CCMSLIB00017282553","spectrum_index":35349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 70.0053 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.155,"smiles":null,"spectrum_id":"CCMSLIB00017282554","spectrum_index":35350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 47.9993 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.08,"smiles":null,"spectrum_id":"CCMSLIB00017282557","spectrum_index":35351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 91.0638 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.228,"smiles":null,"spectrum_id":"CCMSLIB00017282560","spectrum_index":35352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 206.1676 Da; putative annotation: N/A; putative formula: C14H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.264,"smiles":null,"spectrum_id":"CCMSLIB00017282563","spectrum_index":35353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 14.0037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.09,"smiles":null,"spectrum_id":"CCMSLIB00017282564","spectrum_index":35354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 42.0194 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.106,"smiles":null,"spectrum_id":"CCMSLIB00017282567","spectrum_index":35355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 41.0241 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.11,"smiles":null,"spectrum_id":"CCMSLIB00017282570","spectrum_index":35356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.076,"smiles":null,"spectrum_id":"CCMSLIB00017282572","spectrum_index":35357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 379.1474 Da; putative annotation: N/A; putative formula: C28H17N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.218,"smiles":null,"spectrum_id":"CCMSLIB00017282575","spectrum_index":35358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 127.0899 Da; putative annotation: N/A; putative formula: C7H14NO-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.15,"smiles":null,"spectrum_id":"CCMSLIB00017282577","spectrum_index":35359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 102.0057 Da; putative annotation: N/A; putative formula: C4H7O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.061,"smiles":null,"spectrum_id":"CCMSLIB00017282580","spectrum_index":35360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 216.1093 Da; putative annotation: N/A; putative formula: C13H16N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.191,"smiles":null,"spectrum_id":"CCMSLIB00017282583","spectrum_index":35361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 98.075 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.157,"smiles":null,"spectrum_id":"CCMSLIB00017282584","spectrum_index":35362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 199.1206 Da; putative annotation: N/A; putative formula: C10H17NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.181,"smiles":null,"spectrum_id":"CCMSLIB00017282587","spectrum_index":35363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 60.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.138,"smiles":null,"spectrum_id":"CCMSLIB00017282590","spectrum_index":35364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 579.304 Da; putative annotation: N/A; putative formula: C43H37N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":742.364,"smiles":null,"spectrum_id":"CCMSLIB00017282592","spectrum_index":35365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 33.065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.171,"smiles":null,"spectrum_id":"CCMSLIB00017282595","spectrum_index":35366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 451.3148 Da; putative annotation: N/A; putative formula: C22H45NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.463,"smiles":null,"spectrum_id":"CCMSLIB00017282597","spectrum_index":35367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 71.0369 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.196,"smiles":null,"spectrum_id":"CCMSLIB00017282600","spectrum_index":35368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-alpha-D-glucosamine - 40.0 eV (delta mass: 833.021 Da; putative annotation: N/A; putative formula: C65H-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1055.12,"smiles":null,"spectrum_id":"CCMSLIB00017282603","spectrum_index":35369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 48.0002 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.092,"smiles":null,"spectrum_id":"CCMSLIB00017282605","spectrum_index":35370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.096,"smiles":null,"spectrum_id":"CCMSLIB00017282607","spectrum_index":35371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Acetamido-2-methyl-7-oxononanoic acid (delta mass: 72.0399 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.194,"smiles":null,"spectrum_id":"CCMSLIB00017282610","spectrum_index":35372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-methoxybutanoic acid (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.092,"smiles":null,"spectrum_id":"CCMSLIB00017282613","spectrum_index":35373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 93.0578 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.097,"smiles":null,"spectrum_id":"CCMSLIB00017282616","spectrum_index":35374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 63.0149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.116,"smiles":null,"spectrum_id":"CCMSLIB00017282617","spectrum_index":35375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phlorin (delta mass: 195.0743 Da; putative annotation: N/A; putative formula: C6H13NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.166,"smiles":null,"spectrum_id":"CCMSLIB00017282620","spectrum_index":35376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 264.0422 Da; putative annotation: N/A; putative formula: C16H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.123,"smiles":null,"spectrum_id":"CCMSLIB00017282623","spectrum_index":35377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 209.1423 Da; putative annotation: N/A; putative formula: C12H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.244,"smiles":null,"spectrum_id":"CCMSLIB00017282625","spectrum_index":35378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 196.1253 Da; putative annotation: N/A; putative formula: C15H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017282628","spectrum_index":35379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 110.1191 Da; putative annotation: N/A; putative formula: C7H14N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.221,"smiles":null,"spectrum_id":"CCMSLIB00017282630","spectrum_index":35380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 102.079 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.238,"smiles":null,"spectrum_id":"CCMSLIB00017282633","spectrum_index":35381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 113.0924 Da; putative annotation: N/A; putative formula: C5H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.168,"smiles":null,"spectrum_id":"CCMSLIB00017282636","spectrum_index":35382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 393.163 Da; putative annotation: N/A; putative formula: C29H19N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.239,"smiles":null,"spectrum_id":"CCMSLIB00017282638","spectrum_index":35383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 43.0638 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.139,"smiles":null,"spectrum_id":"CCMSLIB00017282640","spectrum_index":35384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 12.0364 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017282643","spectrum_index":35385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 134.9188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.979,"smiles":null,"spectrum_id":"CCMSLIB00017282646","spectrum_index":35386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 472.2184 Da; putative annotation: N/A; putative formula: C29H32N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.315,"smiles":null,"spectrum_id":"CCMSLIB00017282647","spectrum_index":35387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 200.1418 Da; putative annotation: N/A; putative formula: C11H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.249,"smiles":null,"spectrum_id":"CCMSLIB00017282650","spectrum_index":35388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 200.0837 Da; putative annotation: N/A; putative formula: C8H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.17,"smiles":null,"spectrum_id":"CCMSLIB00017282653","spectrum_index":35389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 77.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.133,"smiles":null,"spectrum_id":"CCMSLIB00017282656","spectrum_index":35390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 368.0379 Da; putative annotation: N/A; putative formula: C15H12O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.077,"smiles":null,"spectrum_id":"CCMSLIB00017282657","spectrum_index":35391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-(methylthio)- (delta mass: 28.0088 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.172,"smiles":null,"spectrum_id":"CCMSLIB00017282660","spectrum_index":35392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CLE_291.1026_12.2 (delta mass: 368.1252 Da; putative annotation: N/A; putative formula: C13H24N2O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.228,"smiles":null,"spectrum_id":"CCMSLIB00017282663","spectrum_index":35393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 107.1219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.193,"smiles":null,"spectrum_id":"CCMSLIB00017282665","spectrum_index":35394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 34.0869 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.163,"smiles":null,"spectrum_id":"CCMSLIB00017282668","spectrum_index":35395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol (delta mass: 33.0229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.182,"smiles":null,"spectrum_id":"CCMSLIB00017282670","spectrum_index":35396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 74.1614 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.283,"smiles":null,"spectrum_id":"CCMSLIB00017282673","spectrum_index":35397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Leu-DL-Val (delta mass: 113.0842 Da; putative annotation: 2-Amino-2-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017282676","spectrum_index":35398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 125.0473 Da; putative annotation: 3-Amino-1,1,1-trifluoro-2-butanol; putative formula: C4H6F3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.224,"smiles":null,"spectrum_id":"CCMSLIB00017282677","spectrum_index":35399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 511.1912 Da; putative annotation: Lewis X trisaccharide; putative formula: C20H33NO14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.294,"smiles":null,"spectrum_id":"CCMSLIB00017282680","spectrum_index":35400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S-Carboxymethyl-L-cysteine CollisionEnergy:102040 (delta mass: 145.0195 Da; putative annotation: Acetylcysteine; putative formula: C5H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.052,"smiles":null,"spectrum_id":"CCMSLIB00017282683","spectrum_index":35401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 178.0634 Da; putative annotation: Isobutyrylphloroglucinol; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017282686","spectrum_index":35402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 190.027 Da; putative annotation: 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid; putative formula: C10H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.113,"smiles":null,"spectrum_id":"CCMSLIB00017282687","spectrum_index":35403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 226.0955 Da; putative annotation: Glu-Pro; putative formula: C10H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.182,"smiles":null,"spectrum_id":"CCMSLIB00017282690","spectrum_index":35404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 36.0794 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.175,"smiles":null,"spectrum_id":"CCMSLIB00017282693","spectrum_index":35405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 115.0692 Da; putative annotation: N/A; putative formula: H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.166,"smiles":null,"spectrum_id":"CCMSLIB00017282694","spectrum_index":35406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 80.0686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.364,"smiles":null,"spectrum_id":"CCMSLIB00017282697","spectrum_index":35407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 132.0923 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.335,"smiles":null,"spectrum_id":"CCMSLIB00017282700","spectrum_index":35408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L_DOPA (delta mass: 240.2157 Da; putative annotation: N/A; putative formula: C10H24N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.292,"smiles":null,"spectrum_id":"CCMSLIB00017282702","spectrum_index":35409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNnT (delta mass: 107.0349 Da; putative annotation: N/A; putative formula: C4H4F3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":815.291,"smiles":null,"spectrum_id":"CCMSLIB00017282705","spectrum_index":35410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 53.0265 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.087,"smiles":null,"spectrum_id":"CCMSLIB00017282707","spectrum_index":35411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 345.3348 Da; putative annotation: N/A; putative formula: C24H43N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.406,"smiles":null,"spectrum_id":"CCMSLIB00017282710","spectrum_index":35412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:205060 (delta mass: 76.0745 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.186,"smiles":null,"spectrum_id":"CCMSLIB00017282713","spectrum_index":35413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 61.089 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017282715","spectrum_index":35414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347874-02!5-hydroxy-2,2,6,6-tetramethyl-4-[2-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]propyl]cyclohex-4-ene-1,3-dione (delta mass: 43.9945 Da; putative annotation: N/A; putative formula: HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.217,"smiles":null,"spectrum_id":"CCMSLIB00017282718","spectrum_index":35415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 215.9949 Da; putative annotation: N/A; putative formula: C4H10O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.066,"smiles":null,"spectrum_id":"CCMSLIB00017282721","spectrum_index":35416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 67.0006 Da; putative annotation: N/A; putative formula: C3H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.108,"smiles":null,"spectrum_id":"CCMSLIB00017282723","spectrum_index":35417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 356.2341 Da; putative annotation: N/A; putative formula: C23H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.331,"smiles":null,"spectrum_id":"CCMSLIB00017282725","spectrum_index":35418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 183.0899 Da; putative annotation: N/A; putative formula: C9H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.166,"smiles":null,"spectrum_id":"CCMSLIB00017282728","spectrum_index":35419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 158.1095 Da; putative annotation: N/A; putative formula: C12H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.164,"smiles":null,"spectrum_id":"CCMSLIB00017282731","spectrum_index":35420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 97.0527 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.155,"smiles":null,"spectrum_id":"CCMSLIB00017282733","spectrum_index":35421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 137.0543 Da; putative annotation: N/A; putative formula: CH7N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.15,"smiles":null,"spectrum_id":"CCMSLIB00017282735","spectrum_index":35422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 104.0594 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.176,"smiles":null,"spectrum_id":"CCMSLIB00017282738","spectrum_index":35423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 514.2233 Da; putative annotation: N/A; putative formula: C27H35N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.321,"smiles":null,"spectrum_id":"CCMSLIB00017282741","spectrum_index":35424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)phenol (delta mass: 168.024 Da; putative annotation: N/A; putative formula: C10H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.1,"smiles":null,"spectrum_id":"CCMSLIB00017282743","spectrum_index":35425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 73.031 Da; putative annotation: N/A; putative formula: C6H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017282745","spectrum_index":35426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 98.0846 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.186,"smiles":null,"spectrum_id":"CCMSLIB00017282748","spectrum_index":35427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 61.0318 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017282751","spectrum_index":35428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olanzapine (delta mass: 178.1303 Da; putative annotation: N/A; putative formula: C3H14N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.278,"smiles":null,"spectrum_id":"CCMSLIB00017282754","spectrum_index":35429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 85.0887 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.159,"smiles":null,"spectrum_id":"CCMSLIB00017282756","spectrum_index":35430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 145.046 Da; putative annotation: N/A; putative formula: H3N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.106,"smiles":null,"spectrum_id":"CCMSLIB00017282758","spectrum_index":35431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 70.0042 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.127,"smiles":null,"spectrum_id":"CCMSLIB00017282761","spectrum_index":35432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 142.9394 Da; putative annotation: N/A; putative formula: C3H-2NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.01,"smiles":null,"spectrum_id":"CCMSLIB00017282763","spectrum_index":35433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 268.4876 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.574,"smiles":null,"spectrum_id":"CCMSLIB00017282766","spectrum_index":35434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 589.3976 Da; putative annotation: N/A; putative formula: C34H55NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":884.5,"smiles":null,"spectrum_id":"CCMSLIB00017282768","spectrum_index":35435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1,1-Tris(hydroxymethyl)propane (delta mass: 76.0666 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.168,"smiles":null,"spectrum_id":"CCMSLIB00017282770","spectrum_index":35436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 132.0345 Da; putative annotation: N/A; putative formula: C5H9O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.105,"smiles":null,"spectrum_id":"CCMSLIB00017282773","spectrum_index":35437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 3.4243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017282776","spectrum_index":35438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 200.0838 Da; putative annotation: N/A; putative formula: C13H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.155,"smiles":null,"spectrum_id":"CCMSLIB00017282778","spectrum_index":35439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Bis(2-hydroxyethyl)glycine (delta mass: 55.0422 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.134,"smiles":null,"spectrum_id":"CCMSLIB00017282781","spectrum_index":35440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 178.0294 Da; putative annotation: N/A; putative formula: C8H7N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.11,"smiles":null,"spectrum_id":"CCMSLIB00017282783","spectrum_index":35441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 131.0904 Da; putative annotation: N/A; putative formula: C2H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.181,"smiles":null,"spectrum_id":"CCMSLIB00017282786","spectrum_index":35442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 175.0493 Da; putative annotation: N/A; putative formula: C7H5N5O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.167,"smiles":null,"spectrum_id":"CCMSLIB00017282789","spectrum_index":35443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2Z)-(2-Amino-1,3-thiazol-4-yl)[(2-tert-butoxy-1,1-dimethyl-2-oxoethoxy)imino]ethanoic acid (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.174,"smiles":null,"spectrum_id":"CCMSLIB00017282791","spectrum_index":35444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 98.0413 Da; putative annotation: N/A; putative formula: C4H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.211,"smiles":null,"spectrum_id":"CCMSLIB00017282794","spectrum_index":35445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 116.0478 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.15,"smiles":null,"spectrum_id":"CCMSLIB00017282797","spectrum_index":35446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 112.0516 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.107,"smiles":null,"spectrum_id":"CCMSLIB00017282800","spectrum_index":35447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 394.2433 Da; putative annotation: N/A; putative formula: C16H34N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.314,"smiles":null,"spectrum_id":"CCMSLIB00017282802","spectrum_index":35448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 48.0327 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.156,"smiles":null,"spectrum_id":"CCMSLIB00017282804","spectrum_index":35449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 411.1702 Da; putative annotation: N/A; putative formula: C17H21N11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.267,"smiles":null,"spectrum_id":"CCMSLIB00017282807","spectrum_index":35450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 141.07 Da; putative annotation: N/A; putative formula: C7H12NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.183,"smiles":null,"spectrum_id":"CCMSLIB00017282810","spectrum_index":35451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 17.847 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.97,"smiles":null,"spectrum_id":"CCMSLIB00017282813","spectrum_index":35452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydro-beta-carboline (delta mass: 230.1413 Da; putative annotation: N/A; putative formula: C8H19N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.264,"smiles":null,"spectrum_id":"CCMSLIB00017282815","spectrum_index":35453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 656.3853 Da; putative annotation: N/A; putative formula: C39H53N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":819.445,"smiles":null,"spectrum_id":"CCMSLIB00017282817","spectrum_index":35454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 141.0702 Da; putative annotation: N/A; putative formula: C7H12NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.13,"smiles":null,"spectrum_id":"CCMSLIB00017282820","spectrum_index":35455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ureidopropionic acid (delta mass: 26.0054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.066,"smiles":null,"spectrum_id":"CCMSLIB00017282823","spectrum_index":35456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 971.3332 Da; putative annotation: N/A; putative formula: C42H53N9O16S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1476.51,"smiles":null,"spectrum_id":"CCMSLIB00017282826","spectrum_index":35457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 241.1758 Da; putative annotation: N/A; putative formula: C8H19N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.242,"smiles":null,"spectrum_id":"CCMSLIB00017282827","spectrum_index":35458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017282830","spectrum_index":35459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Octopamine from NIST14 (delta mass: 269.0422 Da; putative annotation: N/A; putative formula: C15H12NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.129,"smiles":null,"spectrum_id":"CCMSLIB00017282833","spectrum_index":35460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 36.0365 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.16,"smiles":null,"spectrum_id":"CCMSLIB00017282834","spectrum_index":35461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 75.0527 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.112,"smiles":null,"spectrum_id":"CCMSLIB00017282837","spectrum_index":35462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one (delta mass: 152.0611 Da; putative annotation: N/A; putative formula: C6H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.132,"smiles":null,"spectrum_id":"CCMSLIB00017282840","spectrum_index":35463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 182.1752 Da; putative annotation: N/A; putative formula: C11H22N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.275,"smiles":null,"spectrum_id":"CCMSLIB00017282842","spectrum_index":35464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 228.2081 Da; putative annotation: N/A; putative formula: C14H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.3,"smiles":null,"spectrum_id":"CCMSLIB00017282844","spectrum_index":35465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 38.0157 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.071,"smiles":null,"spectrum_id":"CCMSLIB00017282847","spectrum_index":35466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 49.0809 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.157,"smiles":null,"spectrum_id":"CCMSLIB00017282850","spectrum_index":35467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 72.0558 Da; putative annotation: N/A; putative formula: H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.095,"smiles":null,"spectrum_id":"CCMSLIB00017282852","spectrum_index":35468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 24.0005 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.113,"smiles":null,"spectrum_id":"CCMSLIB00017282854","spectrum_index":35469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 75.0456 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.09,"smiles":null,"spectrum_id":"CCMSLIB00017282857","spectrum_index":35470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 17.9343 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.01,"smiles":null,"spectrum_id":"CCMSLIB00017282860","spectrum_index":35471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 354.6284 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.715,"smiles":null,"spectrum_id":"CCMSLIB00017282862","spectrum_index":35472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 354.6966 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.783,"smiles":null,"spectrum_id":"CCMSLIB00017282865","spectrum_index":35473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 911.5966 Da; putative annotation: N/A; putative formula: C62H77N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.67,"smiles":null,"spectrum_id":"CCMSLIB00017282868","spectrum_index":35474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 65.0341 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.1,"smiles":null,"spectrum_id":"CCMSLIB00017282870","spectrum_index":35475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 141.0882 Da; putative annotation: N/A; putative formula: C2H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.138,"smiles":null,"spectrum_id":"CCMSLIB00017282873","spectrum_index":35476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:205060 (delta mass: 658.4138 Da; putative annotation: N/A; putative formula: C31H62O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":903.509,"smiles":null,"spectrum_id":"CCMSLIB00017282876","spectrum_index":35477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 195.0753 Da; putative annotation: N/A; putative formula: C7H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.214,"smiles":null,"spectrum_id":"CCMSLIB00017282878","spectrum_index":35478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 42.0039 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.163,"smiles":null,"spectrum_id":"CCMSLIB00017282881","spectrum_index":35479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.055,"smiles":null,"spectrum_id":"CCMSLIB00017282883","spectrum_index":35480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.164,"smiles":null,"spectrum_id":"CCMSLIB00017282886","spectrum_index":35481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 181.1108 Da; putative annotation: N/A; putative formula: C10H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.197,"smiles":null,"spectrum_id":"CCMSLIB00017282889","spectrum_index":35482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 63.0175 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.143,"smiles":null,"spectrum_id":"CCMSLIB00017282891","spectrum_index":35483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017282894","spectrum_index":35484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 284.213 Da; putative annotation: N/A; putative formula: C14H29N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.342,"smiles":null,"spectrum_id":"CCMSLIB00017282896","spectrum_index":35485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 65.0269 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.098,"smiles":null,"spectrum_id":"CCMSLIB00017282898","spectrum_index":35486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 193.0934 Da; putative annotation: N/A; putative formula: C4H7N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.206,"smiles":null,"spectrum_id":"CCMSLIB00017282900","spectrum_index":35487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Pro-Lys (delta mass: 69.0562 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.265,"smiles":null,"spectrum_id":"CCMSLIB00017282903","spectrum_index":35488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-thiol (delta mass: 28.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.058,"smiles":null,"spectrum_id":"CCMSLIB00017282906","spectrum_index":35489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 50.0522 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.242,"smiles":null,"spectrum_id":"CCMSLIB00017282909","spectrum_index":35490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 338.0796 Da; putative annotation: N/A; putative formula: C20H15FO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.15,"smiles":null,"spectrum_id":"CCMSLIB00017282910","spectrum_index":35491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 82.0422 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017282913","spectrum_index":35492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,4-Dinitrophenyl)-DL-threonine (delta mass: 61.0346 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.102,"smiles":null,"spectrum_id":"CCMSLIB00017282916","spectrum_index":35493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 232.0367 Da; putative annotation: N/A; putative formula: C12H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.096,"smiles":null,"spectrum_id":"CCMSLIB00017282918","spectrum_index":35494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 196.1281 Da; putative annotation: N/A; putative formula: C12H20S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.198,"smiles":null,"spectrum_id":"CCMSLIB00017282920","spectrum_index":35495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 194.0805 Da; putative annotation: N/A; putative formula: C8H10N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.172,"smiles":null,"spectrum_id":"CCMSLIB00017282923","spectrum_index":35496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 112.106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.239,"smiles":null,"spectrum_id":"CCMSLIB00017282926","spectrum_index":35497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 47.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.102,"smiles":null,"spectrum_id":"CCMSLIB00017282929","spectrum_index":35498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 393.1628 Da; putative annotation: N/A; putative formula: C29H19N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.259,"smiles":null,"spectrum_id":"CCMSLIB00017282931","spectrum_index":35499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 202.0558 Da; putative annotation: N/A; putative formula: C5H11N6O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.137,"smiles":null,"spectrum_id":"CCMSLIB00017282933","spectrum_index":35500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 87.0314 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.091,"smiles":null,"spectrum_id":"CCMSLIB00017282936","spectrum_index":35501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 260.1524 Da; putative annotation: N/A; putative formula: C15H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.307,"smiles":null,"spectrum_id":"CCMSLIB00017282939","spectrum_index":35502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 764.2526 Da; putative annotation: N/A; putative formula: C42H44N4O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":961.333,"smiles":null,"spectrum_id":"CCMSLIB00017282942","spectrum_index":35503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 762.4524 Da; putative annotation: N/A; putative formula: C38H70N2O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":908.549,"smiles":null,"spectrum_id":"CCMSLIB00017282945","spectrum_index":35504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 264.1845 Da; putative annotation: N/A; putative formula: C15H24N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.297,"smiles":null,"spectrum_id":"CCMSLIB00017282946","spectrum_index":35505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 10.0553 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.131,"smiles":null,"spectrum_id":"CCMSLIB00017282949","spectrum_index":35506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannose 6-phosphate (delta mass: 187.9924 Da; putative annotation: N/A; putative formula: C2N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.029,"smiles":null,"spectrum_id":"CCMSLIB00017282952","spectrum_index":35507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 254.0296 Da; putative annotation: N/A; putative formula: C12H6N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.067,"smiles":null,"spectrum_id":"CCMSLIB00017282954","spectrum_index":35508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 63.0391 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.074,"smiles":null,"spectrum_id":"CCMSLIB00017282956","spectrum_index":35509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 159.0183 Da; putative annotation: N/A; putative formula: C6HN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.095,"smiles":null,"spectrum_id":"CCMSLIB00017282959","spectrum_index":35510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:102040 (delta mass: 444.1623 Da; putative annotation: N/A; putative formula: C14H29N4O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.258,"smiles":null,"spectrum_id":"CCMSLIB00017282962","spectrum_index":35511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 108.0938 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017282964","spectrum_index":35512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 113.9408 Da; putative annotation: N/A; putative formula: C3H-2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.001,"smiles":null,"spectrum_id":"CCMSLIB00017282967","spectrum_index":35513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 38.0523 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017282969","spectrum_index":35514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 96.032 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.108,"smiles":null,"spectrum_id":"CCMSLIB00017282972","spectrum_index":35515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 62.0494 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.182,"smiles":null,"spectrum_id":"CCMSLIB00017282974","spectrum_index":35516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 27.9727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.107,"smiles":null,"spectrum_id":"CCMSLIB00017282977","spectrum_index":35517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Met-Lys (delta mass: 97.0529 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.206,"smiles":null,"spectrum_id":"CCMSLIB00017282980","spectrum_index":35518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 119.0374 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.214,"smiles":null,"spectrum_id":"CCMSLIB00017282981","spectrum_index":35519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 232.2195 Da; putative annotation: N/A; putative formula: C17H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.311,"smiles":null,"spectrum_id":"CCMSLIB00017282984","spectrum_index":35520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 229.131 Da; putative annotation: N/A; putative formula: C11H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.233,"smiles":null,"spectrum_id":"CCMSLIB00017282987","spectrum_index":35521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Chloro-2-hydroxy-4-phenyl-3-quinolinyl)acetic acid (delta mass: 59.0276 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.085,"smiles":null,"spectrum_id":"CCMSLIB00017282989","spectrum_index":35522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 485.2476 Da; putative annotation: N/A; putative formula: C26H31N9O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.318,"smiles":null,"spectrum_id":"CCMSLIB00017282991","spectrum_index":35523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 16.0172 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.161,"smiles":null,"spectrum_id":"CCMSLIB00017282994","spectrum_index":35524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butyrylcarnitine - 60.00 eV (delta mass: 66.0094 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.164,"smiles":null,"spectrum_id":"CCMSLIB00017282997","spectrum_index":35525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 59.0735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.139,"smiles":null,"spectrum_id":"CCMSLIB00017282998","spectrum_index":35526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 102.0834 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.154,"smiles":null,"spectrum_id":"CCMSLIB00017283001","spectrum_index":35527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 388.1603 Da; putative annotation: N/A; putative formula: C16H28N4O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.231,"smiles":null,"spectrum_id":"CCMSLIB00017283004","spectrum_index":35528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 110.0842 Da; putative annotation: N/A; putative formula: C6H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.149,"smiles":null,"spectrum_id":"CCMSLIB00017283005","spectrum_index":35529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 268.0367 Da; putative annotation: N/A; putative formula: C7H12N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.112,"smiles":null,"spectrum_id":"CCMSLIB00017283008","spectrum_index":35530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 205.1314 Da; putative annotation: N/A; putative formula: C9H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.197,"smiles":null,"spectrum_id":"CCMSLIB00017283011","spectrum_index":35531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol, 1-[2-(2,4-dimethylphenyl)diazenyl]- (delta mass: 18.0145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.148,"smiles":null,"spectrum_id":"CCMSLIB00017283014","spectrum_index":35532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]- (delta mass: 162.0881 Da; putative annotation: N/A; putative formula: C7H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.281,"smiles":null,"spectrum_id":"CCMSLIB00017283015","spectrum_index":35533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desomorphine (delta mass: 416.1853 Da; putative annotation: N/A; putative formula: C17H24N10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.35,"smiles":null,"spectrum_id":"CCMSLIB00017283018","spectrum_index":35534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N'-(7-Fluoropyrrolo[1,2-a]quinoxalin-4-yl)pyrazinohydrazide (delta mass: 145.0778 Da; putative annotation: N/A; putative formula: C4H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.183,"smiles":null,"spectrum_id":"CCMSLIB00017283021","spectrum_index":35535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 398.2535 Da; putative annotation: N/A; putative formula: C20H38N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.35,"smiles":null,"spectrum_id":"CCMSLIB00017283024","spectrum_index":35536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 313.1348 Da; putative annotation: N/A; putative formula: C15H23NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.288,"smiles":null,"spectrum_id":"CCMSLIB00017283025","spectrum_index":35537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE10; MS2Dec (delta mass: 187.0488 Da; putative annotation: N/A; putative formula: C8H13NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.13,"smiles":null,"spectrum_id":"CCMSLIB00017283028","spectrum_index":35538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 166.0241 Da; putative annotation: N/A; putative formula: C12H6O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.089,"smiles":null,"spectrum_id":"CCMSLIB00017283031","spectrum_index":35539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 363.2621 Da; putative annotation: N/A; putative formula: C18H37NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.411,"smiles":null,"spectrum_id":"CCMSLIB00017283034","spectrum_index":35540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 120.0461 Da; putative annotation: N/A; putative formula: C2H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.221,"smiles":null,"spectrum_id":"CCMSLIB00017283035","spectrum_index":35541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 27.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.113,"smiles":null,"spectrum_id":"CCMSLIB00017283038","spectrum_index":35542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 23.0409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017283041","spectrum_index":35543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.gamma.-Glutamyl-L-glutamic acid (delta mass: 322.0898 Da; putative annotation: N/A; putative formula: C10H6N14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.193,"smiles":null,"spectrum_id":"CCMSLIB00017283044","spectrum_index":35544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 385.2307 Da; putative annotation: N/A; putative formula: C21H31N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.379,"smiles":null,"spectrum_id":"CCMSLIB00017283045","spectrum_index":35545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 597.6378 Da; putative annotation: N/A; putative formula: C41H79N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":819.735,"smiles":null,"spectrum_id":"CCMSLIB00017283048","spectrum_index":35546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 780.7475 Da; putative annotation: N/A; putative formula: C52H96N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1002.84,"smiles":null,"spectrum_id":"CCMSLIB00017283051","spectrum_index":35547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 260.0896 Da; putative annotation: N/A; putative formula: C11H16O7)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.16,"smiles":null,"spectrum_id":"CCMSLIB00017283054","spectrum_index":35548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Murrayafoline A (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.118,"smiles":null,"spectrum_id":"CCMSLIB00017283055","spectrum_index":35549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 899.5251 Da; putative annotation: N/A; putative formula: C60H65N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1080.6,"smiles":null,"spectrum_id":"CCMSLIB00017283058","spectrum_index":35550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 955.5517 Da; putative annotation: N/A; putative formula: C50H77N5O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1136.62,"smiles":null,"spectrum_id":"CCMSLIB00017283061","spectrum_index":35551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 175.1582 Da; putative annotation: N/A; putative formula: C5H17N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.348,"smiles":null,"spectrum_id":"CCMSLIB00017283062","spectrum_index":35552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 142.0453 Da; putative annotation: N/A; putative formula: C7H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.111,"smiles":null,"spectrum_id":"CCMSLIB00017283065","spectrum_index":35553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYLTRYPTAMINE - 20.0 eV (delta mass: 14.0048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.128,"smiles":null,"spectrum_id":"CCMSLIB00017283068","spectrum_index":35554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 186.0891 Da; putative annotation: N/A; putative formula: C9H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.149,"smiles":null,"spectrum_id":"CCMSLIB00017283069","spectrum_index":35555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ301405 Cefalexin|7-[(2-amino-1-oxo-2-phenylethyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 60.0327 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.134,"smiles":null,"spectrum_id":"CCMSLIB00017283072","spectrum_index":35556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 19.1368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.232,"smiles":null,"spectrum_id":"CCMSLIB00017283075","spectrum_index":35557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 165.0901 Da; putative annotation: N/A; putative formula: C8H11N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.171,"smiles":null,"spectrum_id":"CCMSLIB00017283078","spectrum_index":35558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.112,"smiles":null,"spectrum_id":"CCMSLIB00017283081","spectrum_index":35559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 154.1359 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.217,"smiles":null,"spectrum_id":"CCMSLIB00017283082","spectrum_index":35560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 374.2821 Da; putative annotation: N/A; putative formula: C24H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.379,"smiles":null,"spectrum_id":"CCMSLIB00017283085","spectrum_index":35561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 72.0211 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.128,"smiles":null,"spectrum_id":"CCMSLIB00017283088","spectrum_index":35562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 82.0363 Da; putative annotation: N/A; putative formula: C5H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.148,"smiles":null,"spectrum_id":"CCMSLIB00017283089","spectrum_index":35563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 90.083 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.222,"smiles":null,"spectrum_id":"CCMSLIB00017283092","spectrum_index":35564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 13.8649 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.962,"smiles":null,"spectrum_id":"CCMSLIB00017283094","spectrum_index":35565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 44.0253 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.122,"smiles":null,"spectrum_id":"CCMSLIB00017283097","spectrum_index":35566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 332.1823 Da; putative annotation: N/A; putative formula: C20H30P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.242,"smiles":null,"spectrum_id":"CCMSLIB00017283100","spectrum_index":35567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 194.1306 Da; putative annotation: N/A; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.211,"smiles":null,"spectrum_id":"CCMSLIB00017283102","spectrum_index":35568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4,5-Trimethoxyphenyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol (delta mass: 194.0705 Da; putative annotation: N/A; putative formula: C10H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.22,"smiles":null,"spectrum_id":"CCMSLIB00017283105","spectrum_index":35569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 29.0508 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.132,"smiles":null,"spectrum_id":"CCMSLIB00017283107","spectrum_index":35570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 2.02 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.169,"smiles":null,"spectrum_id":"CCMSLIB00017283110","spectrum_index":35571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 363.7354 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.795,"smiles":null,"spectrum_id":"CCMSLIB00017283113","spectrum_index":35572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 124.0373 Da; putative annotation: N/A; putative formula: C4H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.139,"smiles":null,"spectrum_id":"CCMSLIB00017283116","spectrum_index":35573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-3-yl)propanenitrile (delta mass: 43.0358 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.128,"smiles":null,"spectrum_id":"CCMSLIB00017283117","spectrum_index":35574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 105.0281 Da; putative annotation: N/A; putative formula: H3N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.135,"smiles":null,"spectrum_id":"CCMSLIB00017283120","spectrum_index":35575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 33.0564 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.121,"smiles":null,"spectrum_id":"CCMSLIB00017283123","spectrum_index":35576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 41.026 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.154,"smiles":null,"spectrum_id":"CCMSLIB00017283126","spectrum_index":35577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[1-(3-Fluorophenyl)-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazole-5-carbohydrazide (delta mass: 72.0232 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.103,"smiles":null,"spectrum_id":"CCMSLIB00017283127","spectrum_index":35578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 276.0871 Da; putative annotation: N/A; putative formula: C13H8N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.208,"smiles":null,"spectrum_id":"CCMSLIB00017283130","spectrum_index":35579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melatonin - 30.0 eV (delta mass: 113.0845 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.213,"smiles":null,"spectrum_id":"CCMSLIB00017283133","spectrum_index":35580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 482.729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.789,"smiles":null,"spectrum_id":"CCMSLIB00017283134","spectrum_index":35581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 59.0412 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.149,"smiles":null,"spectrum_id":"CCMSLIB00017283137","spectrum_index":35582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 350.128 Da; putative annotation: N/A; putative formula: C21H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.209,"smiles":null,"spectrum_id":"CCMSLIB00017283140","spectrum_index":35583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyethyl)-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile (delta mass: 264.0941 Da; putative annotation: N/A; putative formula: C21H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.202,"smiles":null,"spectrum_id":"CCMSLIB00017283143","spectrum_index":35584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 77.084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.274,"smiles":null,"spectrum_id":"CCMSLIB00017283145","spectrum_index":35585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 386.0485 Da; putative annotation: N/A; putative formula: C15H14O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.088,"smiles":null,"spectrum_id":"CCMSLIB00017283147","spectrum_index":35586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 45.0441 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.125,"smiles":null,"spectrum_id":"CCMSLIB00017283150","spectrum_index":35587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C18:2 (delta mass: 83.0744 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.469,"smiles":null,"spectrum_id":"CCMSLIB00017283153","spectrum_index":35588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 214.1316 Da; putative annotation: N/A; putative formula: C10H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.26,"smiles":null,"spectrum_id":"CCMSLIB00017283155","spectrum_index":35589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 74.0512 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.143,"smiles":null,"spectrum_id":"CCMSLIB00017283157","spectrum_index":35590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 44.0504 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.101,"smiles":null,"spectrum_id":"CCMSLIB00017283160","spectrum_index":35591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301825 Norharman (delta mass: 509.3281 Da; putative annotation: N/A; putative formula: C27H47N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.404,"smiles":null,"spectrum_id":"CCMSLIB00017283163","spectrum_index":35592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380136-01!1-(2,3-dihydropyrrol-1-yl)-8,9-dihydroxy-2-methyldecane-1,3-dione (delta mass: 27.0471 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.233,"smiles":null,"spectrum_id":"CCMSLIB00017283166","spectrum_index":35593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 7-fluoro-3-methyl-1H-indole-2-carboxylate (delta mass: 162.1671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.244,"smiles":null,"spectrum_id":"CCMSLIB00017283167","spectrum_index":35594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 332.0894 Da; putative annotation: N/A; putative formula: C17H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.149,"smiles":null,"spectrum_id":"CCMSLIB00017283170","spectrum_index":35595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Leu (delta mass: 113.0845 Da; putative annotation: NORLEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017283173","spectrum_index":35596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 170.1061 Da; putative annotation: Gly-Leu; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.276,"smiles":null,"spectrum_id":"CCMSLIB00017283176","spectrum_index":35597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 111.0693 Da; putative annotation: PIPECOLATE - 20.0 eV; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.151,"smiles":null,"spectrum_id":"CCMSLIB00017283179","spectrum_index":35598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltotetraose from NIST14 (delta mass: 275.1366 Da; putative annotation: Massbank:PR310825 N-Fructosyl isoleucine; putative formula: C12H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.366,"smiles":null,"spectrum_id":"CCMSLIB00017283182","spectrum_index":35599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 126.0311 Da; putative annotation: trans-2-Butene-1,4-dicarboxylic acid; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.102,"smiles":null,"spectrum_id":"CCMSLIB00017283183","spectrum_index":35600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 280.2388 Da; putative annotation: 3-Oxostearic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.31,"smiles":null,"spectrum_id":"CCMSLIB00017283186","spectrum_index":35601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 336.2663 Da; putative annotation: 2-Linoleoylglycerol; putative formula: C21H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.326,"smiles":null,"spectrum_id":"CCMSLIB00017283189","spectrum_index":35602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 103.0634 Da; putative annotation: Tris(hydroxymethyl)aminomethane; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.134,"smiles":null,"spectrum_id":"CCMSLIB00017283192","spectrum_index":35603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 160.0992 Da; putative annotation: 4-Phenylbutanehydrazide; putative formula: C10H12N2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.186,"smiles":null,"spectrum_id":"CCMSLIB00017283193","spectrum_index":35604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 108.0938 Da; putative annotation: Bicyclo[2.2.1]heptane-2-methanol; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.384,"smiles":null,"spectrum_id":"CCMSLIB00017283196","spectrum_index":35605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 691.3921 Da; putative annotation: N/A; putative formula: C42H53N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.489,"smiles":null,"spectrum_id":"CCMSLIB00017283199","spectrum_index":35606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 265.1525 Da; putative annotation: N/A; putative formula: C11H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.301,"smiles":null,"spectrum_id":"CCMSLIB00017283202","spectrum_index":35607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 220.1309 Da; putative annotation: N/A; putative formula: C10H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.279,"smiles":null,"spectrum_id":"CCMSLIB00017283203","spectrum_index":35608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 322.1609 Da; putative annotation: N/A; putative formula: C11H18N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.309,"smiles":null,"spectrum_id":"CCMSLIB00017283206","spectrum_index":35609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 383.2155 Da; putative annotation: N/A; putative formula: C14H21N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.364,"smiles":null,"spectrum_id":"CCMSLIB00017283209","spectrum_index":35610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 366.1892 Da; putative annotation: N/A; putative formula: C16H30O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.338,"smiles":null,"spectrum_id":"CCMSLIB00017283210","spectrum_index":35611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 219.1412 Da; putative annotation: N/A; putative formula: C17H17NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.206,"smiles":null,"spectrum_id":"CCMSLIB00017283213","spectrum_index":35612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 59.0373 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.124,"smiles":null,"spectrum_id":"CCMSLIB00017283216","spectrum_index":35613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 54.0872 Da; putative annotation: N/A; putative formula: C5H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.163,"smiles":null,"spectrum_id":"CCMSLIB00017283218","spectrum_index":35614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 70.0428 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.124,"smiles":null,"spectrum_id":"CCMSLIB00017283220","spectrum_index":35615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 27.9864 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.03,"smiles":null,"spectrum_id":"CCMSLIB00017283223","spectrum_index":35616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 156.0769 Da; putative annotation: N/A; putative formula: C4H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.158,"smiles":null,"spectrum_id":"CCMSLIB00017283226","spectrum_index":35617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 86.052 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017283227","spectrum_index":35618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 41.93 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.074,"smiles":null,"spectrum_id":"CCMSLIB00017283230","spectrum_index":35619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 221.0794 Da; putative annotation: N/A; putative formula: C12H16NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.213,"smiles":null,"spectrum_id":"CCMSLIB00017283233","spectrum_index":35620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 171.0564 Da; putative annotation: N/A; putative formula: C6H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.116,"smiles":null,"spectrum_id":"CCMSLIB00017283235","spectrum_index":35621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE10; MS2Dec (delta mass: 46.9525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.05,"smiles":null,"spectrum_id":"CCMSLIB00017283237","spectrum_index":35622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 954.5188 Da; putative annotation: N/A; putative formula: C49H78O18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1147.59,"smiles":null,"spectrum_id":"CCMSLIB00017283240","spectrum_index":35623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.144,"smiles":null,"spectrum_id":"CCMSLIB00017283243","spectrum_index":35624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 130.1359 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.175,"smiles":null,"spectrum_id":"CCMSLIB00017283245","spectrum_index":35625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 682.4154 Da; putative annotation: N/A; putative formula: C34H58N4O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":977.518,"smiles":null,"spectrum_id":"CCMSLIB00017283247","spectrum_index":35626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347572-02_C30H39NO9_Pentanedioic acid, 2-[(2R,2'R,6'S,8a'S)-6'-(acetyloxy)-3',4',4'a,5',6,6',7',8,8',8'a-decahydro-4-hydroxy-2',5',5',8'a-tetramethyl-6-oxospiro[2H-furo[2,3-e]isoindole-2,1'(2'H)-naphthalen]-7(3H)-yl]-, (2S)- (delta mass: 557.256 Da; putative annotation: N/A; putative formula: C29H39N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1115.53,"smiles":null,"spectrum_id":"CCMSLIB00017283250","spectrum_index":35627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 193.1303 Da; putative annotation: N/A; putative formula: C12H19NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.279,"smiles":null,"spectrum_id":"CCMSLIB00017283253","spectrum_index":35628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 156.1497 Da; putative annotation: N/A; putative formula: C6H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.209,"smiles":null,"spectrum_id":"CCMSLIB00017283255","spectrum_index":35629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 410.29 Da; putative annotation: N/A; putative formula: C22H42N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.403,"smiles":null,"spectrum_id":"CCMSLIB00017283257","spectrum_index":35630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 210.162 Da; putative annotation: N/A; putative formula: C13H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.259,"smiles":null,"spectrum_id":"CCMSLIB00017283260","spectrum_index":35631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 76.1128 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.2,"smiles":null,"spectrum_id":"CCMSLIB00017283263","spectrum_index":35632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 125.0478 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.118,"smiles":null,"spectrum_id":"CCMSLIB00017283264","spectrum_index":35633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 262.0636 Da; putative annotation: N/A; putative formula: C9H16N2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.118,"smiles":null,"spectrum_id":"CCMSLIB00017283267","spectrum_index":35634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 974.2755 Da; putative annotation: N/A; putative formula: C52H50N2O13S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1137.34,"smiles":null,"spectrum_id":"CCMSLIB00017283270","spectrum_index":35635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 141.9716 Da; putative annotation: N/A; putative formula: C5H2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.047,"smiles":null,"spectrum_id":"CCMSLIB00017283273","spectrum_index":35636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-.alpha.-Cyclohexylglycine (delta mass: 36.0367 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.154,"smiles":null,"spectrum_id":"CCMSLIB00017283275","spectrum_index":35637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 197.0928 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.204,"smiles":null,"spectrum_id":"CCMSLIB00017283277","spectrum_index":35638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 32.0041 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.092,"smiles":null,"spectrum_id":"CCMSLIB00017283280","spectrum_index":35639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(5-methoxy-1H-indol-3-yl)ethanamine (delta mass: 320.2829 Da; putative annotation: N/A; putative formula: C20H36N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.401,"smiles":null,"spectrum_id":"CCMSLIB00017283283","spectrum_index":35640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 723.2768 Da; putative annotation: N/A; putative formula: C33H46N3O13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.337,"smiles":null,"spectrum_id":"CCMSLIB00017283284","spectrum_index":35641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 256.2403 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.426,"smiles":null,"spectrum_id":"CCMSLIB00017283287","spectrum_index":35642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 251.1366 Da; putative annotation: N/A; putative formula: C10H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.285,"smiles":null,"spectrum_id":"CCMSLIB00017283290","spectrum_index":35643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 543.2781 Da; putative annotation: N/A; putative formula: C30H37N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.369,"smiles":null,"spectrum_id":"CCMSLIB00017283293","spectrum_index":35644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 371.1749 Da; putative annotation: N/A; putative formula: C22H21N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.35,"smiles":null,"spectrum_id":"CCMSLIB00017283295","spectrum_index":35645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381307-01!1-[2,4-dihydroxy-3-(2-hydroxyethyl)-6-methoxyphenyl]butan-1-one (delta mass: 386.1329 Da; putative annotation: N/A; putative formula: C18H29O3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.256,"smiles":null,"spectrum_id":"CCMSLIB00017283297","spectrum_index":35646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 550.1161 Da; putative annotation: N/A; putative formula: C26H22N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.187,"smiles":null,"spectrum_id":"CCMSLIB00017283300","spectrum_index":35647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 103.0632 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.207,"smiles":null,"spectrum_id":"CCMSLIB00017283303","spectrum_index":35648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 88.0209 Da; putative annotation: N/A; putative formula: CH4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.081,"smiles":null,"spectrum_id":"CCMSLIB00017283305","spectrum_index":35649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 151.1825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.248,"smiles":null,"spectrum_id":"CCMSLIB00017283308","spectrum_index":35650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 445.2231 Da; putative annotation: N/A; putative formula: C21H36NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.336,"smiles":null,"spectrum_id":"CCMSLIB00017283311","spectrum_index":35651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ancistrocladine (delta mass: 17.994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.211,"smiles":null,"spectrum_id":"CCMSLIB00017283314","spectrum_index":35652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 313.263 Da; putative annotation: N/A; putative formula: C19H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.328,"smiles":null,"spectrum_id":"CCMSLIB00017283316","spectrum_index":35653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Chlorophenyl)-1H-pyrazol-5-amine (delta mass: 44.0612 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.109,"smiles":null,"spectrum_id":"CCMSLIB00017283319","spectrum_index":35654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 150.1026 Da; putative annotation: N/A; putative formula: C6H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.161,"smiles":null,"spectrum_id":"CCMSLIB00017283322","spectrum_index":35655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 249.065 Da; putative annotation: N/A; putative formula: C13H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.167,"smiles":null,"spectrum_id":"CCMSLIB00017283324","spectrum_index":35656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 88.068 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.139,"smiles":null,"spectrum_id":"CCMSLIB00017283327","spectrum_index":35657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1030.5009 Da; putative annotation: N/A; putative formula: C52H70N8O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1193.56,"smiles":null,"spectrum_id":"CCMSLIB00017283330","spectrum_index":35658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 153.027 Da; putative annotation: N/A; putative formula: C7H9NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.108,"smiles":null,"spectrum_id":"CCMSLIB00017283332","spectrum_index":35659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 19S-Methoxytubotaiwine (delta mass: 13.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.228,"smiles":null,"spectrum_id":"CCMSLIB00017283334","spectrum_index":35660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 134.0727 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.159,"smiles":null,"spectrum_id":"CCMSLIB00017283337","spectrum_index":35661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 369.7568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.905,"smiles":null,"spectrum_id":"CCMSLIB00017283340","spectrum_index":35662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 50.0 eV (delta mass: 18.9938 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.096,"smiles":null,"spectrum_id":"CCMSLIB00017283342","spectrum_index":35663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-2,4-Diaminobutyric acid (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.092,"smiles":null,"spectrum_id":"CCMSLIB00017283344","spectrum_index":35664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 212.141 Da; putative annotation: N/A; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.29,"smiles":null,"spectrum_id":"CCMSLIB00017283347","spectrum_index":35665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 588.2202 Da; putative annotation: N/A; putative formula: C28H32N10OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":823.28,"smiles":null,"spectrum_id":"CCMSLIB00017283350","spectrum_index":35666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin methyl ester CollisionEnergy:102040 (delta mass: 118.085 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017283352","spectrum_index":35667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 43.0449 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.085,"smiles":null,"spectrum_id":"CCMSLIB00017283354","spectrum_index":35668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 16.9682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.044,"smiles":null,"spectrum_id":"CCMSLIB00017283357","spectrum_index":35669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 151.0934 Da; putative annotation: N/A; putative formula: C9H14NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.148,"smiles":null,"spectrum_id":"CCMSLIB00017283359","spectrum_index":35670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 61.0555 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.225,"smiles":null,"spectrum_id":"CCMSLIB00017283361","spectrum_index":35671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 572.3619 Da; putative annotation: N/A; putative formula: C29H48N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.464,"smiles":null,"spectrum_id":"CCMSLIB00017283364","spectrum_index":35672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 365.2238 Da; putative annotation: N/A; putative formula: C17H35NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.377,"smiles":null,"spectrum_id":"CCMSLIB00017283367","spectrum_index":35673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 295.1502 Da; putative annotation: N/A; putative formula: C10H17N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.21,"smiles":null,"spectrum_id":"CCMSLIB00017283369","spectrum_index":35674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 256.2363 Da; putative annotation: N/A; putative formula: C12H28N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.402,"smiles":null,"spectrum_id":"CCMSLIB00017283371","spectrum_index":35675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 42.0211 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.145,"smiles":null,"spectrum_id":"CCMSLIB00017283374","spectrum_index":35676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Gln (delta mass: 111.0328 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.162,"smiles":null,"spectrum_id":"CCMSLIB00017283377","spectrum_index":35677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 56.0352 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.097,"smiles":null,"spectrum_id":"CCMSLIB00017283378","spectrum_index":35678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 675.2644 Da; putative annotation: N/A; putative formula: C35H42N5O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.335,"smiles":null,"spectrum_id":"CCMSLIB00017283381","spectrum_index":35679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 124.0848 Da; putative annotation: N/A; putative formula: C4H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017283384","spectrum_index":35680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 217.132 Da; putative annotation: N/A; putative formula: C11H23NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.223,"smiles":null,"spectrum_id":"CCMSLIB00017283387","spectrum_index":35681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Paxitriol (delta mass: 27.9941 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.258,"smiles":null,"spectrum_id":"CCMSLIB00017283390","spectrum_index":35682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 190.1304 Da; putative annotation: N/A; putative formula: C8H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.206,"smiles":null,"spectrum_id":"CCMSLIB00017283391","spectrum_index":35683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 26.0755 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.151,"smiles":null,"spectrum_id":"CCMSLIB00017283394","spectrum_index":35684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 101.004 Da; putative annotation: N/A; putative formula: C2H3N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.069,"smiles":null,"spectrum_id":"CCMSLIB00017283397","spectrum_index":35685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 342.21 Da; putative annotation: N/A; putative formula: C24H26N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.296,"smiles":null,"spectrum_id":"CCMSLIB00017283400","spectrum_index":35686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 286.069 Da; putative annotation: N/A; putative formula: C12H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.166,"smiles":null,"spectrum_id":"CCMSLIB00017283401","spectrum_index":35687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 557.392 Da; putative annotation: N/A; putative formula: C35H51N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.541,"smiles":null,"spectrum_id":"CCMSLIB00017283404","spectrum_index":35688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 469.3399 Da; putative annotation: N/A; putative formula: C26H47NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.488,"smiles":null,"spectrum_id":"CCMSLIB00017283406","spectrum_index":35689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 53.062 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.122,"smiles":null,"spectrum_id":"CCMSLIB00017283409","spectrum_index":35690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 290.1608 Da; putative annotation: N/A; putative formula: C12H18N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.315,"smiles":null,"spectrum_id":"CCMSLIB00017283411","spectrum_index":35691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 75.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.15,"smiles":null,"spectrum_id":"CCMSLIB00017283414","spectrum_index":35692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 42.0667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.142,"smiles":null,"spectrum_id":"CCMSLIB00017283417","spectrum_index":35693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 202.0245 Da; putative annotation: N/A; putative formula: C15H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.095,"smiles":null,"spectrum_id":"CCMSLIB00017283419","spectrum_index":35694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 403.2293 Da; putative annotation: N/A; putative formula: C22H33N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.331,"smiles":null,"spectrum_id":"CCMSLIB00017283421","spectrum_index":35695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 68.0376 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.14,"smiles":null,"spectrum_id":"CCMSLIB00017283424","spectrum_index":35696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 111.0274 Da; putative annotation: N/A; putative formula: C4H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.119,"smiles":null,"spectrum_id":"CCMSLIB00017283426","spectrum_index":35697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 273.0158 Da; putative annotation: N/A; putative formula: C9H12N3OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.185,"smiles":null,"spectrum_id":"CCMSLIB00017283428","spectrum_index":35698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Anisidine (delta mass: 43.0057 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.081,"smiles":null,"spectrum_id":"CCMSLIB00017283431","spectrum_index":35699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 114.0467 Da; putative annotation: N/A; putative formula: C9H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017283434","spectrum_index":35700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.alpha.-L-fucopyranosyl)-D-glucopyranose (delta mass: 177.8449 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.0,"smiles":null,"spectrum_id":"CCMSLIB00017283435","spectrum_index":35701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 83.0437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017283438","spectrum_index":35702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 103.0721 Da; putative annotation: N/A; putative formula: C3H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.17,"smiles":null,"spectrum_id":"CCMSLIB00017283441","spectrum_index":35703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 280.1654 Da; putative annotation: N/A; putative formula: C20H24O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.314,"smiles":null,"spectrum_id":"CCMSLIB00017283444","spectrum_index":35704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 429.6474 Da; putative annotation: N/A; putative formula: CH2S13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.718,"smiles":null,"spectrum_id":"CCMSLIB00017283445","spectrum_index":35705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 31.0053 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.087,"smiles":null,"spectrum_id":"CCMSLIB00017283448","spectrum_index":35706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,5S)-9-Methyl-9-azabicyclo[3.3.1]nonan-3-amine (delta mass: 17.9375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.092,"smiles":null,"spectrum_id":"CCMSLIB00017283451","spectrum_index":35707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 650.1621 Da; putative annotation: N/A; putative formula: C31H42N2OS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.233,"smiles":null,"spectrum_id":"CCMSLIB00017283453","spectrum_index":35708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 50.0402 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.179,"smiles":null,"spectrum_id":"CCMSLIB00017283455","spectrum_index":35709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 223.0672 Da; putative annotation: N/A; putative formula: C11H13NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.207,"smiles":null,"spectrum_id":"CCMSLIB00017283458","spectrum_index":35710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 14.9623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.038,"smiles":null,"spectrum_id":"CCMSLIB00017283461","spectrum_index":35711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-6-methoxy-2-methylspiro[3,4-dihydroisoquinoline-1,7'-6H-cyclopenta[g][1,3]benzodioxole]-8'-one (delta mass: 176.025 Da; putative annotation: N/A; putative formula: C7H5N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.159,"smiles":null,"spectrum_id":"CCMSLIB00017283463","spectrum_index":35712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 231.1216 Da; putative annotation: N/A; putative formula: C9H17N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.255,"smiles":null,"spectrum_id":"CCMSLIB00017283465","spectrum_index":35713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 64.0678 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017283468","spectrum_index":35714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 58.0937 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.18,"smiles":null,"spectrum_id":"CCMSLIB00017283470","spectrum_index":35715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 609.2044 Da; putative annotation: N/A; putative formula: C43H32NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.291,"smiles":null,"spectrum_id":"CCMSLIB00017283472","spectrum_index":35716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-tyrosine (delta mass: 126.1044 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.196,"smiles":null,"spectrum_id":"CCMSLIB00017283475","spectrum_index":35717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 30.0129 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.13,"smiles":null,"spectrum_id":"CCMSLIB00017283478","spectrum_index":35718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 264.156 Da; putative annotation: N/A; putative formula: C16H26O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.305,"smiles":null,"spectrum_id":"CCMSLIB00017283479","spectrum_index":35719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 441.2202 Da; putative annotation: N/A; putative formula: C31H27N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.369,"smiles":null,"spectrum_id":"CCMSLIB00017283482","spectrum_index":35720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Methylsulfanyl)-9H-pyrimido[4,5-b]indole (delta mass: 28.0014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.06,"smiles":null,"spectrum_id":"CCMSLIB00017283485","spectrum_index":35721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 27.0474 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017283488","spectrum_index":35722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 94.0779 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.164,"smiles":null,"spectrum_id":"CCMSLIB00017283489","spectrum_index":35723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 50.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.144,"smiles":null,"spectrum_id":"CCMSLIB00017283492","spectrum_index":35724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 475.2206 Da; putative annotation: N/A; putative formula: C25H33NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.291,"smiles":null,"spectrum_id":"CCMSLIB00017283495","spectrum_index":35725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 130.0996 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.222,"smiles":null,"spectrum_id":"CCMSLIB00017283498","spectrum_index":35726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 26.0153 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.138,"smiles":null,"spectrum_id":"CCMSLIB00017283499","spectrum_index":35727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 141.0786 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.145,"smiles":null,"spectrum_id":"CCMSLIB00017283502","spectrum_index":35728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 359.8814 Da; putative annotation: N/A; putative formula: C12H9O-1PS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.009,"smiles":null,"spectrum_id":"CCMSLIB00017283505","spectrum_index":35729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-5-hydroxytryptamine (delta mass: 46.0305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017283508","spectrum_index":35730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 70.0891 Da; putative annotation: N/A; putative formula: C4H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.169,"smiles":null,"spectrum_id":"CCMSLIB00017283509","spectrum_index":35731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 488.131 Da; putative annotation: N/A; putative formula: C16H28N2O13S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.202,"smiles":null,"spectrum_id":"CCMSLIB00017283512","spectrum_index":35732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 104.074 Da; putative annotation: N/A; putative formula: C7H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.182,"smiles":null,"spectrum_id":"CCMSLIB00017283515","spectrum_index":35733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 208.0512 Da; putative annotation: N/A; putative formula: C8H9N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.201,"smiles":null,"spectrum_id":"CCMSLIB00017283516","spectrum_index":35734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 323.16 Da; putative annotation: N/A; putative formula: C15H25N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.315,"smiles":null,"spectrum_id":"CCMSLIB00017283519","spectrum_index":35735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 387.2225 Da; putative annotation: N/A; putative formula: C25H30N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.309,"smiles":null,"spectrum_id":"CCMSLIB00017283522","spectrum_index":35736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albizziin (delta mass: 116.0219 Da; putative annotation: N/A; putative formula: C3H4N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.094,"smiles":null,"spectrum_id":"CCMSLIB00017283524","spectrum_index":35737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cephalotaxine (delta mass: 17.0492 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.203,"smiles":null,"spectrum_id":"CCMSLIB00017283527","spectrum_index":35738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 623.5782 Da; putative annotation: N/A; putative formula: C46H73NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":809.65,"smiles":null,"spectrum_id":"CCMSLIB00017283529","spectrum_index":35739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 214.1493 Da; putative annotation: N/A; putative formula: C12H23OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.298,"smiles":null,"spectrum_id":"CCMSLIB00017283532","spectrum_index":35740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 259.1774 Da; putative annotation: N/A; putative formula: C13H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.253,"smiles":null,"spectrum_id":"CCMSLIB00017283535","spectrum_index":35741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000441 DP7|GlcGlcGlcGlcGlcGlcGlc (delta mass: 17.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1170.41,"smiles":null,"spectrum_id":"CCMSLIB00017283536","spectrum_index":35742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 57.0088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.091,"smiles":null,"spectrum_id":"CCMSLIB00017283539","spectrum_index":35743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 60.0204 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.258,"smiles":null,"spectrum_id":"CCMSLIB00017283542","spectrum_index":35744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 48.0363 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.169,"smiles":null,"spectrum_id":"CCMSLIB00017283545","spectrum_index":35745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 258.197 Da; putative annotation: N/A; putative formula: C12H27N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.278,"smiles":null,"spectrum_id":"CCMSLIB00017283546","spectrum_index":35746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 146.0571 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.148,"smiles":null,"spectrum_id":"CCMSLIB00017283549","spectrum_index":35747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 147.0639 Da; putative annotation: N/A; putative formula: C6H14NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.155,"smiles":null,"spectrum_id":"CCMSLIB00017283552","spectrum_index":35748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 20.0 eV (delta mass: 632.8245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.938,"smiles":null,"spectrum_id":"CCMSLIB00017283553","spectrum_index":35749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 126.0834 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.154,"smiles":null,"spectrum_id":"CCMSLIB00017283556","spectrum_index":35750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 43.0544 Da; putative annotation: N/A; putative formula: CH5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.136,"smiles":null,"spectrum_id":"CCMSLIB00017283559","spectrum_index":35751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 414.3328 Da; putative annotation: N/A; putative formula: C21H38N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.404,"smiles":null,"spectrum_id":"CCMSLIB00017283561","spectrum_index":35752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 816.0309 Da; putative annotation: N/A; putative formula: C21H27N10O15P3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1038.13,"smiles":null,"spectrum_id":"CCMSLIB00017283563","spectrum_index":35753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 107.0374 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.124,"smiles":null,"spectrum_id":"CCMSLIB00017283566","spectrum_index":35754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(1H-Benzimidazol-2-yl)-4-fluorobenzamide (delta mass: 17.0198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.108,"smiles":null,"spectrum_id":"CCMSLIB00017283569","spectrum_index":35755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 197.191 Da; putative annotation: N/A; putative formula: C11H23N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.29,"smiles":null,"spectrum_id":"CCMSLIB00017283570","spectrum_index":35756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 128.0787 Da; putative annotation: N/A; putative formula: C6H12N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.18,"smiles":null,"spectrum_id":"CCMSLIB00017283573","spectrum_index":35757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 368.2899 Da; putative annotation: N/A; putative formula: C18H36N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.327,"smiles":null,"spectrum_id":"CCMSLIB00017283576","spectrum_index":35758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 238.0992 Da; putative annotation: N/A; putative formula: C16H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.175,"smiles":null,"spectrum_id":"CCMSLIB00017283577","spectrum_index":35759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 42.0045 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.16,"smiles":null,"spectrum_id":"CCMSLIB00017283580","spectrum_index":35760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 694.5705 Da; putative annotation: N/A; putative formula: C34H70N12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.683,"smiles":null,"spectrum_id":"CCMSLIB00017283583","spectrum_index":35761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ARABITOL (delta mass: 87.0319 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.108,"smiles":null,"spectrum_id":"CCMSLIB00017283586","spectrum_index":35762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-crinamine (delta mass: 125.0833 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.222,"smiles":null,"spectrum_id":"CCMSLIB00017283587","spectrum_index":35763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 537.4241 Da; putative annotation: N/A; putative formula: C31H60N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.573,"smiles":null,"spectrum_id":"CCMSLIB00017283590","spectrum_index":35764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 609.4813 Da; putative annotation: N/A; putative formula: C37H63N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.63,"smiles":null,"spectrum_id":"CCMSLIB00017283593","spectrum_index":35765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 76.031 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017283596","spectrum_index":35766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 30.9883 Da; putative annotation: N/A; putative formula: HNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.075,"smiles":null,"spectrum_id":"CCMSLIB00017283597","spectrum_index":35767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4H-Pyrrolo[3,2-c]pyridin-4-one, 1,5,6,7-tetrahydro-2-[2-(3-quinolinyl)-4-pyridinyl]- (delta mass: 56.0603 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.2,"smiles":null,"spectrum_id":"CCMSLIB00017283600","spectrum_index":35768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid (delta mass: 104.0328 Da; putative annotation: N/A; putative formula: CH4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.128,"smiles":null,"spectrum_id":"CCMSLIB00017283602","spectrum_index":35769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylenetetramine (delta mass: 85.0524 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.213,"smiles":null,"spectrum_id":"CCMSLIB00017283605","spectrum_index":35770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 43.9892 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.08,"smiles":null,"spectrum_id":"CCMSLIB00017283607","spectrum_index":35771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 121.0196 Da; putative annotation: N/A; putative formula: C3H7NO2S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.085,"smiles":null,"spectrum_id":"CCMSLIB00017283610","spectrum_index":35772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 30.0102 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.044,"smiles":null,"spectrum_id":"CCMSLIB00017283613","spectrum_index":35773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 31.0341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.079,"smiles":null,"spectrum_id":"CCMSLIB00017283616","spectrum_index":35774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 57.044 Da; putative annotation: N/A; putative formula: H3N5O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.104,"smiles":null,"spectrum_id":"CCMSLIB00017283617","spectrum_index":35775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 125.0475 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.198,"smiles":null,"spectrum_id":"CCMSLIB00017283621","spectrum_index":35776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 29.0028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.068,"smiles":null,"spectrum_id":"CCMSLIB00017283623","spectrum_index":35777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 47.0717 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.111,"smiles":null,"spectrum_id":"CCMSLIB00017283626","spectrum_index":35778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 205.1098 Da; putative annotation: N/A; putative formula: C12H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.269,"smiles":null,"spectrum_id":"CCMSLIB00017283629","spectrum_index":35779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 130.9019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.015,"smiles":null,"spectrum_id":"CCMSLIB00017283632","spectrum_index":35780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 74.0515 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.18,"smiles":null,"spectrum_id":"CCMSLIB00017283634","spectrum_index":35781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-3-ylmethanamine (delta mass: 18.0492 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.136,"smiles":null,"spectrum_id":"CCMSLIB00017283636","spectrum_index":35782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 70.0293 Da; putative annotation: N/A; putative formula: CH2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017283639","spectrum_index":35783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 98.073 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.153,"smiles":null,"spectrum_id":"CCMSLIB00017283642","spectrum_index":35784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 66.0351 Da; putative annotation: N/A; putative formula: C2H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.148,"smiles":null,"spectrum_id":"CCMSLIB00017283645","spectrum_index":35785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 216.0511 Da; putative annotation: N/A; putative formula: C7H4N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.143,"smiles":null,"spectrum_id":"CCMSLIB00017283647","spectrum_index":35786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 4.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017283650","spectrum_index":35787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 85.0281 Da; putative annotation: N/A; putative formula: C2H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.13,"smiles":null,"spectrum_id":"CCMSLIB00017283653","spectrum_index":35788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 515.34 Da; putative annotation: N/A; putative formula: C34H45NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.437,"smiles":null,"spectrum_id":"CCMSLIB00017283656","spectrum_index":35789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 200.1202 Da; putative annotation: Massbank:NA001272 Pterosin B|(2R)-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one; putative formula: C14H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017283658","spectrum_index":35790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 162.0534 Da; putative annotation: Spectral Match to D-(+)-Mannose from NIST14; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.135,"smiles":null,"spectrum_id":"CCMSLIB00017283661","spectrum_index":35791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 216.1481 Da; putative annotation: a-Santal-10-en-12-oic acid; putative formula: C15H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.26,"smiles":null,"spectrum_id":"CCMSLIB00017283663","spectrum_index":35792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 161.0842 Da; putative annotation: .beta.-Phenyl-.gamma.-aminobutyric acid; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.176,"smiles":null,"spectrum_id":"CCMSLIB00017283666","spectrum_index":35793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 228.0798 Da; putative annotation: 2-(2-Hydroxypropan-2-yl)-2,3-dihydro-7H-furo[3,2-g]chromen-7-one; putative formula: C14H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.14,"smiles":null,"spectrum_id":"CCMSLIB00017283669","spectrum_index":35794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 294.2197 Da; putative annotation: (9Z,12E)-15,16-Dihydroxyoctadeca-9,12-dienoic acid; putative formula: C18H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.322,"smiles":null,"spectrum_id":"CCMSLIB00017283670","spectrum_index":35795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 618.4134 Da; putative annotation: 5-[[17-(5,6-dihydroxy-6-methylheptan-2-yl)-3,12-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-2-yl]oxy]-3-hydroxy-3-methyl-5-oxopentanoic acid; putative formula: C36H58O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.474,"smiles":null,"spectrum_id":"CCMSLIB00017283673","spectrum_index":35796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 162.0518 Da; putative annotation: D-(+)-Mannose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.175,"smiles":null,"spectrum_id":"CCMSLIB00017283676","spectrum_index":35797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 123.0796 Da; putative annotation: Spectral Match to L-Histidinol from NIST14; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.167,"smiles":null,"spectrum_id":"CCMSLIB00017283679","spectrum_index":35798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 162.0528 Da; putative annotation: D-(-)-Tagatose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.139,"smiles":null,"spectrum_id":"CCMSLIB00017283681","spectrum_index":35799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 326.1579 Da; putative annotation: N/A; putative formula: C20H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.25,"smiles":null,"spectrum_id":"CCMSLIB00017283684","spectrum_index":35800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 215.2016 Da; putative annotation: N/A; putative formula: C11H25N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.301,"smiles":null,"spectrum_id":"CCMSLIB00017283686","spectrum_index":35801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 292.0431 Da; putative annotation: N/A; putative formula: C10H12O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.192,"smiles":null,"spectrum_id":"CCMSLIB00017283689","spectrum_index":35802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 1341.5283 Da; putative annotation: N/A; putative formula: C105H67N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1496.6,"smiles":null,"spectrum_id":"CCMSLIB00017283691","spectrum_index":35803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(5-Chloro-1H-indol-3-yl)acetic acid (delta mass: 17.0348 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.066,"smiles":null,"spectrum_id":"CCMSLIB00017283694","spectrum_index":35804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Diphenyl-1H-indole-7-carboxylic acid (delta mass: 169.0752 Da; putative annotation: N/A; putative formula: C9H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.193,"smiles":null,"spectrum_id":"CCMSLIB00017283697","spectrum_index":35805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 289.1892 Da; putative annotation: N/A; putative formula: C14H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.26,"smiles":null,"spectrum_id":"CCMSLIB00017283699","spectrum_index":35806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 63.1116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.16,"smiles":null,"spectrum_id":"CCMSLIB00017283701","spectrum_index":35807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isonicotinamide (delta mass: 2.0046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":125.06,"smiles":null,"spectrum_id":"CCMSLIB00017283704","spectrum_index":35808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 219.0555 Da; putative annotation: N/A; putative formula: C10H10N3OP)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.142,"smiles":null,"spectrum_id":"CCMSLIB00017283707","spectrum_index":35809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 279.2548 Da; putative annotation: N/A; putative formula: C14H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.32,"smiles":null,"spectrum_id":"CCMSLIB00017283709","spectrum_index":35810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 56.0272 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.17,"smiles":null,"spectrum_id":"CCMSLIB00017283711","spectrum_index":35811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 61.0545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017283714","spectrum_index":35812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 297.2045 Da; putative annotation: N/A; putative formula: C17H32NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.345,"smiles":null,"spectrum_id":"CCMSLIB00017283717","spectrum_index":35813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 500.2051 Da; putative annotation: N/A; putative formula: C30H33N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.303,"smiles":null,"spectrum_id":"CCMSLIB00017283720","spectrum_index":35814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 127.0631 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.165,"smiles":null,"spectrum_id":"CCMSLIB00017283722","spectrum_index":35815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 172.0845 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.145,"smiles":null,"spectrum_id":"CCMSLIB00017283724","spectrum_index":35816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 67.9894 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.049,"smiles":null,"spectrum_id":"CCMSLIB00017283727","spectrum_index":35817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 395.0721 Da; putative annotation: N/A; putative formula: C14H23NO6P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.158,"smiles":null,"spectrum_id":"CCMSLIB00017283730","spectrum_index":35818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 119.0398 Da; putative annotation: N/A; putative formula: C4H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.137,"smiles":null,"spectrum_id":"CCMSLIB00017283733","spectrum_index":35819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 294.1433 Da; putative annotation: N/A; putative formula: C14H23N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.23,"smiles":null,"spectrum_id":"CCMSLIB00017283735","spectrum_index":35820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 474.1437 Da; putative annotation: N/A; putative formula: C20H34N4O-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.219,"smiles":null,"spectrum_id":"CCMSLIB00017283738","spectrum_index":35821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 28.9741 Da; putative annotation: N/A; putative formula: C13H18N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017283740","spectrum_index":35822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017283743","spectrum_index":35823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 115.0233 Da; putative annotation: N/A; putative formula: HN7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.193,"smiles":null,"spectrum_id":"CCMSLIB00017283745","spectrum_index":35824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 163.0731 Da; putative annotation: N/A; putative formula: C4H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.188,"smiles":null,"spectrum_id":"CCMSLIB00017283748","spectrum_index":35825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylglutamine (delta mass: 111.0309 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.15,"smiles":null,"spectrum_id":"CCMSLIB00017283751","spectrum_index":35826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-5-(1H-pyrrol-2-yl)-1,3-dihydro-1,4-benzodiazepin-2-one (delta mass: 43.9988 Da; putative annotation: N/A; putative formula: N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.057,"smiles":null,"spectrum_id":"CCMSLIB00017283754","spectrum_index":35827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 60.1044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.197,"smiles":null,"spectrum_id":"CCMSLIB00017283757","spectrum_index":35828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 69.021 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.081,"smiles":null,"spectrum_id":"CCMSLIB00017283759","spectrum_index":35829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Phenyl-1H-1,2,3-triazol-4-yl)methanamine (delta mass: 52.0299 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017283762","spectrum_index":35830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 375.1165 Da; putative annotation: N/A; putative formula: C15H21NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.23,"smiles":null,"spectrum_id":"CCMSLIB00017283765","spectrum_index":35831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 302.3046 Da; putative annotation: N/A; putative formula: C12H34N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.4,"smiles":null,"spectrum_id":"CCMSLIB00017283767","spectrum_index":35832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 61.0315 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.154,"smiles":null,"spectrum_id":"CCMSLIB00017283769","spectrum_index":35833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 255.1841 Da; putative annotation: N/A; putative formula: C14H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.275,"smiles":null,"spectrum_id":"CCMSLIB00017283772","spectrum_index":35834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 371.1591 Da; putative annotation: N/A; putative formula: C18H29NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.245,"smiles":null,"spectrum_id":"CCMSLIB00017283775","spectrum_index":35835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 1111.3584 Da; putative annotation: N/A; putative formula: C41H62N9O25P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1438.49,"smiles":null,"spectrum_id":"CCMSLIB00017283778","spectrum_index":35836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 299.1426 Da; putative annotation: N/A; putative formula: C20H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.244,"smiles":null,"spectrum_id":"CCMSLIB00017283780","spectrum_index":35837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dioxy-creatinine - 40.0 eV (delta mass: 80.0658 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.116,"smiles":null,"spectrum_id":"CCMSLIB00017283782","spectrum_index":35838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 148.0348 Da; putative annotation: N/A; putative formula: C9H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.132,"smiles":null,"spectrum_id":"CCMSLIB00017283785","spectrum_index":35839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 920.5823 Da; putative annotation: N/A; putative formula: C46H84N2O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1101.65,"smiles":null,"spectrum_id":"CCMSLIB00017283788","spectrum_index":35840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 86.0519 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017283791","spectrum_index":35841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 132.1043 Da; putative annotation: N/A; putative formula: C9H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.29,"smiles":null,"spectrum_id":"CCMSLIB00017283794","spectrum_index":35842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 205.1699 Da; putative annotation: N/A; putative formula: C11H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.241,"smiles":null,"spectrum_id":"CCMSLIB00017283795","spectrum_index":35843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 17.0413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.11,"smiles":null,"spectrum_id":"CCMSLIB00017283798","spectrum_index":35844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 166.1365 Da; putative annotation: N/A; putative formula: C11H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.197,"smiles":null,"spectrum_id":"CCMSLIB00017283801","spectrum_index":35845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 18.0193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.184,"smiles":null,"spectrum_id":"CCMSLIB00017283804","spectrum_index":35846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pindolol (delta mass: 98.049 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.209,"smiles":null,"spectrum_id":"CCMSLIB00017283806","spectrum_index":35847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-Hydroxynonenal from NIST14 (delta mass: 186.1626 Da; putative annotation: N/A; putative formula: C11H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.285,"smiles":null,"spectrum_id":"CCMSLIB00017283809","spectrum_index":35848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 330.2755 Da; putative annotation: N/A; putative formula: C23H38O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.336,"smiles":null,"spectrum_id":"CCMSLIB00017283811","spectrum_index":35849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 122.0369 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.18,"smiles":null,"spectrum_id":"CCMSLIB00017283814","spectrum_index":35850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxy-3,5-dimethoxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 17.0703 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.178,"smiles":null,"spectrum_id":"CCMSLIB00017283817","spectrum_index":35851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-6-carboxaldehyde (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017283820","spectrum_index":35852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coniferaldehyde (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.065,"smiles":null,"spectrum_id":"CCMSLIB00017283821","spectrum_index":35853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Omeprazole sulfide (delta mass: 126.0315 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.159,"smiles":null,"spectrum_id":"CCMSLIB00017283824","spectrum_index":35854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 176.0712 Da; putative annotation: N/A; putative formula: C6H13N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.168,"smiles":null,"spectrum_id":"CCMSLIB00017283827","spectrum_index":35855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 296.1404 Da; putative annotation: N/A; putative formula: C13H21N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.236,"smiles":null,"spectrum_id":"CCMSLIB00017283830","spectrum_index":35856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-chloro-5-fluoro-1H-indole-2-carboxylate (delta mass: 90.0036 Da; putative annotation: N/A; putative formula: C6H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.026,"smiles":null,"spectrum_id":"CCMSLIB00017283833","spectrum_index":35857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 66.0246 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.105,"smiles":null,"spectrum_id":"CCMSLIB00017283835","spectrum_index":35858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 148.0499 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.098,"smiles":null,"spectrum_id":"CCMSLIB00017283837","spectrum_index":35859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; LC-tDDA; CE40 (delta mass: 56.0347 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.101,"smiles":null,"spectrum_id":"CCMSLIB00017283840","spectrum_index":35860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 166.0537 Da; putative annotation: N/A; putative formula: C3H12N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.114,"smiles":null,"spectrum_id":"CCMSLIB00017283843","spectrum_index":35861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 80.0262 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.098,"smiles":null,"spectrum_id":"CCMSLIB00017283846","spectrum_index":35862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentanedioic acid, 2-hydroxy, 1,5-diethyl ester (delta mass: 55.0433 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.15,"smiles":null,"spectrum_id":"CCMSLIB00017283848","spectrum_index":35863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 442.3134 Da; putative annotation: N/A; putative formula: C26H42N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.463,"smiles":null,"spectrum_id":"CCMSLIB00017283851","spectrum_index":35864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 494.2089 Da; putative annotation: N/A; putative formula: C18H37N6O4P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.353,"smiles":null,"spectrum_id":"CCMSLIB00017283853","spectrum_index":35865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 143.0217 Da; putative annotation: N/A; putative formula: C5H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.155,"smiles":null,"spectrum_id":"CCMSLIB00017283856","spectrum_index":35866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 174.0524 Da; putative annotation: N/A; putative formula: C7H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.185,"smiles":null,"spectrum_id":"CCMSLIB00017283859","spectrum_index":35867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 93.0402 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.105,"smiles":null,"spectrum_id":"CCMSLIB00017283860","spectrum_index":35868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 91.052 Da; putative annotation: N/A; putative formula: C5H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.144,"smiles":null,"spectrum_id":"CCMSLIB00017283863","spectrum_index":35869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 25.9447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.084,"smiles":null,"spectrum_id":"CCMSLIB00017283866","spectrum_index":35870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Territrem B (delta mass: 526.2191 Da; putative annotation: N/A; putative formula: C34H30N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1053.45,"smiles":null,"spectrum_id":"CCMSLIB00017283869","spectrum_index":35871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Ala (delta mass: 199.0964 Da; putative annotation: N/A; putative formula: C9H9N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.226,"smiles":null,"spectrum_id":"CCMSLIB00017283872","spectrum_index":35872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCURONOLACTONE (delta mass: 56.0209 Da; putative annotation: N/A; putative formula: C3H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.071,"smiles":null,"spectrum_id":"CCMSLIB00017283874","spectrum_index":35873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 120.0479 Da; putative annotation: N/A; putative formula: C2H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.119,"smiles":null,"spectrum_id":"CCMSLIB00017283877","spectrum_index":35874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 106.0662 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.145,"smiles":null,"spectrum_id":"CCMSLIB00017283879","spectrum_index":35875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 42.0669 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.211,"smiles":null,"spectrum_id":"CCMSLIB00017283882","spectrum_index":35876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 302.2822 Da; putative annotation: N/A; putative formula: C19H34N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.363,"smiles":null,"spectrum_id":"CCMSLIB00017283885","spectrum_index":35877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 76.0163 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.118,"smiles":null,"spectrum_id":"CCMSLIB00017283888","spectrum_index":35878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 131.0366 Da; putative annotation: N/A; putative formula: C2H6N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.133,"smiles":null,"spectrum_id":"CCMSLIB00017283891","spectrum_index":35879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 258.1983 Da; putative annotation: N/A; putative formula: C18H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.263,"smiles":null,"spectrum_id":"CCMSLIB00017283893","spectrum_index":35880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 43.9908 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.125,"smiles":null,"spectrum_id":"CCMSLIB00017283895","spectrum_index":35881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 108.0573 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.1,"smiles":null,"spectrum_id":"CCMSLIB00017283898","spectrum_index":35882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 197.163 Da; putative annotation: N/A; putative formula: C9H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017283901","spectrum_index":35883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 147.1042 Da; putative annotation: N/A; putative formula: C10H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.18,"smiles":null,"spectrum_id":"CCMSLIB00017283904","spectrum_index":35884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 40.1041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.164,"smiles":null,"spectrum_id":"CCMSLIB00017283907","spectrum_index":35885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 133.1834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.296,"smiles":null,"spectrum_id":"CCMSLIB00017283910","spectrum_index":35886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 319.1846 Da; putative annotation: N/A; putative formula: C14H30N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.255,"smiles":null,"spectrum_id":"CCMSLIB00017283912","spectrum_index":35887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 649.4189 Da; putative annotation: N/A; putative formula: C36H59NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.49,"smiles":null,"spectrum_id":"CCMSLIB00017283915","spectrum_index":35888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 64.0673 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.138,"smiles":null,"spectrum_id":"CCMSLIB00017283917","spectrum_index":35889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 937.5042 Da; putative annotation: N/A; putative formula: C48H75NO17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1118.57,"smiles":null,"spectrum_id":"CCMSLIB00017283920","spectrum_index":35890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 874.4731 Da; putative annotation: N/A; putative formula: C53H64N8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1037.53,"smiles":null,"spectrum_id":"CCMSLIB00017283922","spectrum_index":35891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 638.2223 Da; putative annotation: N/A; putative formula: C41H35O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.282,"smiles":null,"spectrum_id":"CCMSLIB00017283925","spectrum_index":35892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 397.1936 Da; putative annotation: N/A; putative formula: C21H27N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.342,"smiles":null,"spectrum_id":"CCMSLIB00017283928","spectrum_index":35893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 45.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.154,"smiles":null,"spectrum_id":"CCMSLIB00017283930","spectrum_index":35894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 28.0011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.044,"smiles":null,"spectrum_id":"CCMSLIB00017283933","spectrum_index":35895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 58.0499 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.183,"smiles":null,"spectrum_id":"CCMSLIB00017283935","spectrum_index":35896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 175.0653 Da; putative annotation: N/A; putative formula: C9H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.162,"smiles":null,"spectrum_id":"CCMSLIB00017283938","spectrum_index":35897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00350 (1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol (delta mass: 33.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.233,"smiles":null,"spectrum_id":"CCMSLIB00017283941","spectrum_index":35898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 164.0924 Da; putative annotation: N/A; putative formula: C5H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.216,"smiles":null,"spectrum_id":"CCMSLIB00017283943","spectrum_index":35899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 103.0787 Da; putative annotation: N/A; putative formula: C8H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.176,"smiles":null,"spectrum_id":"CCMSLIB00017283946","spectrum_index":35900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 85.0152 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.091,"smiles":null,"spectrum_id":"CCMSLIB00017283949","spectrum_index":35901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 206.1059 Da; putative annotation: N/A; putative formula: C11H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.193,"smiles":null,"spectrum_id":"CCMSLIB00017283952","spectrum_index":35902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300694 Kainic acid (delta mass: 16.998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.105,"smiles":null,"spectrum_id":"CCMSLIB00017283954","spectrum_index":35903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 97.0128 Da; putative annotation: N/A; putative formula: H-1N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.108,"smiles":null,"spectrum_id":"CCMSLIB00017283957","spectrum_index":35904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 145.0483 Da; putative annotation: N/A; putative formula: C6H12NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.144,"smiles":null,"spectrum_id":"CCMSLIB00017283959","spectrum_index":35905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 72.0209 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.076,"smiles":null,"spectrum_id":"CCMSLIB00017283962","spectrum_index":35906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CNP0214803 (delta mass: 121.0213 Da; putative annotation: N/A; putative formula: C3H9NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.076,"smiles":null,"spectrum_id":"CCMSLIB00017283965","spectrum_index":35907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 42.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.17,"smiles":null,"spectrum_id":"CCMSLIB00017283968","spectrum_index":35908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 45.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.155,"smiles":null,"spectrum_id":"CCMSLIB00017283970","spectrum_index":35909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxidised Phytochelatin 2 (delta mass: 333.0443 Da; putative annotation: N/A; putative formula: C10H11N3O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":871.172,"smiles":null,"spectrum_id":"CCMSLIB00017283972","spectrum_index":35910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of catharanthine (delta mass: 72.0285 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.22,"smiles":null,"spectrum_id":"CCMSLIB00017283975","spectrum_index":35911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chymostatin B (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.315,"smiles":null,"spectrum_id":"CCMSLIB00017283978","spectrum_index":35912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 305.1593 Da; putative annotation: N/A; putative formula: C13H27N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.256,"smiles":null,"spectrum_id":"CCMSLIB00017283980","spectrum_index":35913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 145.0376 Da; putative annotation: N/A; putative formula: C5H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.134,"smiles":null,"spectrum_id":"CCMSLIB00017283982","spectrum_index":35914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 278.0427 Da; putative annotation: N/A; putative formula: C13H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.176,"smiles":null,"spectrum_id":"CCMSLIB00017283985","spectrum_index":35915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 141.0789 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.202,"smiles":null,"spectrum_id":"CCMSLIB00017283988","spectrum_index":35916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 96.0904 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.166,"smiles":null,"spectrum_id":"CCMSLIB00017283991","spectrum_index":35917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 118.0871 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.163,"smiles":null,"spectrum_id":"CCMSLIB00017283994","spectrum_index":35918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 124.0525 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.128,"smiles":null,"spectrum_id":"CCMSLIB00017283996","spectrum_index":35919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 394.0483 Da; putative annotation: N/A; putative formula: C9H6N12O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.135,"smiles":null,"spectrum_id":"CCMSLIB00017283999","spectrum_index":35920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 272.2352 Da; putative annotation: N/A; putative formula: C16H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.322,"smiles":null,"spectrum_id":"CCMSLIB00017284002","spectrum_index":35921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 337.3342 Da; putative annotation: N/A; putative formula: C22H43NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.405,"smiles":null,"spectrum_id":"CCMSLIB00017284005","spectrum_index":35922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 321.1788 Da; putative annotation: N/A; putative formula: C14H27NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.327,"smiles":null,"spectrum_id":"CCMSLIB00017284007","spectrum_index":35923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 703.8234 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":925.921,"smiles":null,"spectrum_id":"CCMSLIB00017284010","spectrum_index":35924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.091,"smiles":null,"spectrum_id":"CCMSLIB00017284013","spectrum_index":35925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 372.1456 Da; putative annotation: N/A; putative formula: C14H28O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.211,"smiles":null,"spectrum_id":"CCMSLIB00017284015","spectrum_index":35926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 285.2053 Da; putative annotation: N/A; putative formula: C14H27N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.355,"smiles":null,"spectrum_id":"CCMSLIB00017284018","spectrum_index":35927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 56.0266 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.134,"smiles":null,"spectrum_id":"CCMSLIB00017284021","spectrum_index":35928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 140.1565 Da; putative annotation: N/A; putative formula: C10H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.248,"smiles":null,"spectrum_id":"CCMSLIB00017284022","spectrum_index":35929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 347.1948 Da; putative annotation: N/A; putative formula: C19H30N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.249,"smiles":null,"spectrum_id":"CCMSLIB00017284025","spectrum_index":35930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 973.7468 Da; putative annotation: N/A; putative formula: C48H99N11O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1265.85,"smiles":null,"spectrum_id":"CCMSLIB00017284028","spectrum_index":35931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Acetyl-L-serine (delta mass: 120.0416 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.102,"smiles":null,"spectrum_id":"CCMSLIB00017284031","spectrum_index":35932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 71.9945 Da; putative annotation: N/A; putative formula: CN2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.076,"smiles":null,"spectrum_id":"CCMSLIB00017284033","spectrum_index":35933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 322.9613 Da; putative annotation: N/A; putative formula: C7H6N3O8PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.048,"smiles":null,"spectrum_id":"CCMSLIB00017284036","spectrum_index":35934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ajmaline (delta mass: 45.0686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017284038","spectrum_index":35935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 86.0731 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.164,"smiles":null,"spectrum_id":"CCMSLIB00017284041","spectrum_index":35936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 403.0183 Da; putative annotation: N/A; putative formula: C9H15N3O11P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.115,"smiles":null,"spectrum_id":"CCMSLIB00017284044","spectrum_index":35937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017284045","spectrum_index":35938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 538.2748 Da; putative annotation: N/A; putative formula: C34H39N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.361,"smiles":null,"spectrum_id":"CCMSLIB00017284048","spectrum_index":35939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 407.2884 Da; putative annotation: N/A; putative formula: C20H41NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.437,"smiles":null,"spectrum_id":"CCMSLIB00017284051","spectrum_index":35940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 159.5787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.65,"smiles":null,"spectrum_id":"CCMSLIB00017284054","spectrum_index":35941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 581.4505 Da; putative annotation: N/A; putative formula: C31H59N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.599,"smiles":null,"spectrum_id":"CCMSLIB00017284056","spectrum_index":35942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 565.4559 Da; putative annotation: N/A; putative formula: C31H59N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.604,"smiles":null,"spectrum_id":"CCMSLIB00017284059","spectrum_index":35943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 375.3345 Da; putative annotation: N/A; putative formula: C22H41N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.483,"smiles":null,"spectrum_id":"CCMSLIB00017284061","spectrum_index":35944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 22.9795 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.055,"smiles":null,"spectrum_id":"CCMSLIB00017284064","spectrum_index":35945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kainic Acid (delta mass: 111.1199 Da; putative annotation: N/A; putative formula: C6H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.227,"smiles":null,"spectrum_id":"CCMSLIB00017284067","spectrum_index":35946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 127.0735 Da; putative annotation: N/A; putative formula: C5H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.119,"smiles":null,"spectrum_id":"CCMSLIB00017284070","spectrum_index":35947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 360.0704 Da; putative annotation: N/A; putative formula: C15H12N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.141,"smiles":null,"spectrum_id":"CCMSLIB00017284073","spectrum_index":35948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ferulic acid methyl ester (delta mass: 64.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.134,"smiles":null,"spectrum_id":"CCMSLIB00017284074","spectrum_index":35949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin_120248 (delta mass: 35.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.128,"smiles":null,"spectrum_id":"CCMSLIB00017284077","spectrum_index":35950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcocaine (delta mass: 104.0225 Da; putative annotation: N/A; putative formula: C2H4N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.161,"smiles":null,"spectrum_id":"CCMSLIB00017284080","spectrum_index":35951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol - 30.0 eV (delta mass: 332.282 Da; putative annotation: N/A; putative formula: C15H37N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.441,"smiles":null,"spectrum_id":"CCMSLIB00017284083","spectrum_index":35952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 45.0158 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.097,"smiles":null,"spectrum_id":"CCMSLIB00017284086","spectrum_index":35953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 88.0094 Da; putative annotation: N/A; putative formula: C2H4N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.179,"smiles":null,"spectrum_id":"CCMSLIB00017284089","spectrum_index":35954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 26.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.108,"smiles":null,"spectrum_id":"CCMSLIB00017284091","spectrum_index":35955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 113.0845 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.166,"smiles":null,"spectrum_id":"CCMSLIB00017284094","spectrum_index":35956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 308.2714 Da; putative annotation: N/A; putative formula: C20H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":917.542,"smiles":null,"spectrum_id":"CCMSLIB00017284097","spectrum_index":35957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 62.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.227,"smiles":null,"spectrum_id":"CCMSLIB00017284100","spectrum_index":35958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Statine (delta mass: 244.2035 Da; putative annotation: N/A; putative formula: C14H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.332,"smiles":null,"spectrum_id":"CCMSLIB00017284103","spectrum_index":35959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.086,"smiles":null,"spectrum_id":"CCMSLIB00017284106","spectrum_index":35960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 28.9794 Da; putative annotation: N/A; putative formula: NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017284109","spectrum_index":35961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 148.1252 Da; putative annotation: N/A; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.159,"smiles":null,"spectrum_id":"CCMSLIB00017284112","spectrum_index":35962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 187.0485 Da; putative annotation: N/A; putative formula: C7H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.109,"smiles":null,"spectrum_id":"CCMSLIB00017284115","spectrum_index":35963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 337.1525 Da; putative annotation: N/A; putative formula: C17H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.213,"smiles":null,"spectrum_id":"CCMSLIB00017284117","spectrum_index":35964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 36.0193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.111,"smiles":null,"spectrum_id":"CCMSLIB00017284120","spectrum_index":35965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 359.1353 Da; putative annotation: N/A; putative formula: C16H21N7O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.232,"smiles":null,"spectrum_id":"CCMSLIB00017284123","spectrum_index":35966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 57.9957 Da; putative annotation: N/A; putative formula: C4H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.077,"smiles":null,"spectrum_id":"CCMSLIB00017284126","spectrum_index":35967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-Gln (delta mass: 111.0303 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.17,"smiles":null,"spectrum_id":"CCMSLIB00017284129","spectrum_index":35968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 126.0312 Da; putative annotation: 3-Methyl-2-pentenedioic acid; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.097,"smiles":null,"spectrum_id":"CCMSLIB00017284130","spectrum_index":35969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 426.2756 Da; putative annotation: 9(11)-Dehydromanogenin; putative formula: C27H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1093.5,"smiles":null,"spectrum_id":"CCMSLIB00017284133","spectrum_index":35970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 108.0801 Da; putative annotation: 5-(2-Aminoethyl)-1H-imidazol-2-amine; putative formula: C5H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.171,"smiles":null,"spectrum_id":"CCMSLIB00017284136","spectrum_index":35971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 145.0739 Da; putative annotation: Bicine - 30.0 eV; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.124,"smiles":null,"spectrum_id":"CCMSLIB00017284138","spectrum_index":35972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 288.2084 Da; putative annotation: Oxandrolone; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.332,"smiles":null,"spectrum_id":"CCMSLIB00017284140","spectrum_index":35973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 157.1104 Da; putative annotation: Statine; putative formula: C8H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.202,"smiles":null,"spectrum_id":"CCMSLIB00017284143","spectrum_index":35974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 159.115 Da; putative annotation: N-(3-(Aminomethyl)benzyl)acetamidine; putative formula: C10H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.206,"smiles":null,"spectrum_id":"CCMSLIB00017284146","spectrum_index":35975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 488.3557 Da; putative annotation: Gymnemagenin; putative formula: C30H48O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":797.468,"smiles":null,"spectrum_id":"CCMSLIB00017284148","spectrum_index":35976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 103.0637 Da; putative annotation: Tris(hydroxymethyl)aminomethane; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.161,"smiles":null,"spectrum_id":"CCMSLIB00017284150","spectrum_index":35977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 176.0926 Da; putative annotation: Ethyl 4,5,6,7-tetrahydro-1H-indazole-5-carboxylate; putative formula: C10H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.179,"smiles":null,"spectrum_id":"CCMSLIB00017284153","spectrum_index":35978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 290.2242 Da; putative annotation: Androstane-3,6,17-triol; putative formula: C19H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.295,"smiles":null,"spectrum_id":"CCMSLIB00017284156","spectrum_index":35979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 122.0732 Da; putative annotation: (1R,6S)-Bicyclo[4.1.0]heptane-7-carboxylic acid; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017284158","spectrum_index":35980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 18.0066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.093,"smiles":null,"spectrum_id":"CCMSLIB00017284161","spectrum_index":35981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 238.0953 Da; putative annotation: N/A; putative formula: C11H14N2O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.155,"smiles":null,"spectrum_id":"CCMSLIB00017284163","spectrum_index":35982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 230.0426 Da; putative annotation: N/A; putative formula: C9H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.139,"smiles":null,"spectrum_id":"CCMSLIB00017284166","spectrum_index":35983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 221.0679 Da; putative annotation: N/A; putative formula: C5H12N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.116,"smiles":null,"spectrum_id":"CCMSLIB00017284169","spectrum_index":35984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 63.0219 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.066,"smiles":null,"spectrum_id":"CCMSLIB00017284170","spectrum_index":35985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 454.241 Da; putative annotation: N/A; putative formula: C33H30N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.39,"smiles":null,"spectrum_id":"CCMSLIB00017284173","spectrum_index":35986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 410.2153 Da; putative annotation: N/A; putative formula: C18H34O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.364,"smiles":null,"spectrum_id":"CCMSLIB00017284176","spectrum_index":35987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 715.4715 Da; putative annotation: N/A; putative formula: C47H61N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":904.62,"smiles":null,"spectrum_id":"CCMSLIB00017284179","spectrum_index":35988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 427.241 Da; putative annotation: N/A; putative formula: C31H29N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.39,"smiles":null,"spectrum_id":"CCMSLIB00017284181","spectrum_index":35989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 83.0453 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.123,"smiles":null,"spectrum_id":"CCMSLIB00017284183","spectrum_index":35990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 414.1154 Da; putative annotation: N/A; putative formula: C16H26N6O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.202,"smiles":null,"spectrum_id":"CCMSLIB00017284186","spectrum_index":35991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 284.0894 Da; putative annotation: N/A; putative formula: C13H16O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.238,"smiles":null,"spectrum_id":"CCMSLIB00017284189","spectrum_index":35992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 306.0588 Da; putative annotation: N/A; putative formula: C11H14O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.208,"smiles":null,"spectrum_id":"CCMSLIB00017284191","spectrum_index":35993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 92.0625 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.176,"smiles":null,"spectrum_id":"CCMSLIB00017284194","spectrum_index":35994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 156.0943 Da; putative annotation: N/A; putative formula: C12H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.149,"smiles":null,"spectrum_id":"CCMSLIB00017284197","spectrum_index":35995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 64.0196 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.159,"smiles":null,"spectrum_id":"CCMSLIB00017284200","spectrum_index":35996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 707.3872 Da; putative annotation: N/A; putative formula: C42H53N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.474,"smiles":null,"spectrum_id":"CCMSLIB00017284202","spectrum_index":35997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 163.1198 Da; putative annotation: N/A; putative formula: C8H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.222,"smiles":null,"spectrum_id":"CCMSLIB00017284205","spectrum_index":35998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 171.0377 Da; putative annotation: N/A; putative formula: C6H10N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.235,"smiles":null,"spectrum_id":"CCMSLIB00017284208","spectrum_index":35999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 368.3437 Da; putative annotation: N/A; putative formula: C27H44)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.441,"smiles":null,"spectrum_id":"CCMSLIB00017284210","spectrum_index":36000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 53.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.177,"smiles":null,"spectrum_id":"CCMSLIB00017284213","spectrum_index":36001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074902 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 87.034 Da; putative annotation: N/A; putative formula: C2H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.115,"smiles":null,"spectrum_id":"CCMSLIB00017284216","spectrum_index":36002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 60.0615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.201,"smiles":null,"spectrum_id":"CCMSLIB00017284219","spectrum_index":36003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 42.0147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.122,"smiles":null,"spectrum_id":"CCMSLIB00017284220","spectrum_index":36004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 130.0637 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.223,"smiles":null,"spectrum_id":"CCMSLIB00017284223","spectrum_index":36005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 256.1311 Da; putative annotation: N/A; putative formula: C13H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.196,"smiles":null,"spectrum_id":"CCMSLIB00017284226","spectrum_index":36006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.123,"smiles":null,"spectrum_id":"CCMSLIB00017284228","spectrum_index":36007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 284.1104 Da; putative annotation: N/A; putative formula: C8H8N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.197,"smiles":null,"spectrum_id":"CCMSLIB00017284230","spectrum_index":36008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 182.0784 Da; putative annotation: N/A; putative formula: C10H16O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.144,"smiles":null,"spectrum_id":"CCMSLIB00017284233","spectrum_index":36009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paxilline (delta mass: 63.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.316,"smiles":null,"spectrum_id":"CCMSLIB00017284236","spectrum_index":36010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 128.9448 Da; putative annotation: N/A; putative formula: C3H2NO-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.031,"smiles":null,"spectrum_id":"CCMSLIB00017284239","spectrum_index":36011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptamine (delta mass: 8.9887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.107,"smiles":null,"spectrum_id":"CCMSLIB00017284240","spectrum_index":36012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 175.1096 Da; putative annotation: N/A; putative formula: C10H13N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.249,"smiles":null,"spectrum_id":"CCMSLIB00017284243","spectrum_index":36013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 84.0211 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.107,"smiles":null,"spectrum_id":"CCMSLIB00017284246","spectrum_index":36014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 59.0738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.145,"smiles":null,"spectrum_id":"CCMSLIB00017284248","spectrum_index":36015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Caffeic acid from NIST14 (delta mass: 135.029 Da; putative annotation: N/A; putative formula: C3H9N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.078,"smiles":null,"spectrum_id":"CCMSLIB00017284250","spectrum_index":36016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coclaurine (delta mass: 140.0292 Da; putative annotation: N/A; putative formula: C7H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.173,"smiles":null,"spectrum_id":"CCMSLIB00017284253","spectrum_index":36017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 131.041 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.179,"smiles":null,"spectrum_id":"CCMSLIB00017284256","spectrum_index":36018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 175.0475 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.123,"smiles":null,"spectrum_id":"CCMSLIB00017284259","spectrum_index":36019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 264.1332 Da; putative annotation: N/A; putative formula: C11H16N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.22,"smiles":null,"spectrum_id":"CCMSLIB00017284261","spectrum_index":36020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Amino-4,4-dimethylpentanoic acid (delta mass: 264.2448 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.362,"smiles":null,"spectrum_id":"CCMSLIB00017284263","spectrum_index":36021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 126.0311 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.097,"smiles":null,"spectrum_id":"CCMSLIB00017284266","spectrum_index":36022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 134.0368 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.134,"smiles":null,"spectrum_id":"CCMSLIB00017284269","spectrum_index":36023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 126.1147 Da; putative annotation: N/A; putative formula: C7H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.175,"smiles":null,"spectrum_id":"CCMSLIB00017284272","spectrum_index":36024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa - 30.0 eV (delta mass: 14.0887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.165,"smiles":null,"spectrum_id":"CCMSLIB00017284274","spectrum_index":36025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 43.0058 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.087,"smiles":null,"spectrum_id":"CCMSLIB00017284277","spectrum_index":36026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 61.0048 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.086,"smiles":null,"spectrum_id":"CCMSLIB00017284280","spectrum_index":36027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxymelatonin (delta mass: 129.0508 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.174,"smiles":null,"spectrum_id":"CCMSLIB00017284282","spectrum_index":36028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 71.985 Da; putative annotation: N/A; putative formula: C2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.051,"smiles":null,"spectrum_id":"CCMSLIB00017284285","spectrum_index":36029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 178.0642 Da; putative annotation: N/A; putative formula: C11H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.161,"smiles":null,"spectrum_id":"CCMSLIB00017284288","spectrum_index":36030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 1034.2897 Da; putative annotation: N/A; putative formula: C74H42N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1241.38,"smiles":null,"spectrum_id":"CCMSLIB00017284291","spectrum_index":36031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 178.066 Da; putative annotation: N/A; putative formula: C9H11N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.204,"smiles":null,"spectrum_id":"CCMSLIB00017284294","spectrum_index":36032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 60.02 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.2,"smiles":null,"spectrum_id":"CCMSLIB00017284296","spectrum_index":36033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 1004.2854 Da; putative annotation: N/A; putative formula: C39H56O30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1185.36,"smiles":null,"spectrum_id":"CCMSLIB00017284299","spectrum_index":36034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(1H-Indol-3-yl)vinyl]isoquinoline (delta mass: 46.0245 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.147,"smiles":null,"spectrum_id":"CCMSLIB00017284302","spectrum_index":36035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 67.8708 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.951,"smiles":null,"spectrum_id":"CCMSLIB00017284305","spectrum_index":36036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 94.0515 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.159,"smiles":null,"spectrum_id":"CCMSLIB00017284307","spectrum_index":36037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 327.2618 Da; putative annotation: N/A; putative formula: C16H33N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.296,"smiles":null,"spectrum_id":"CCMSLIB00017284310","spectrum_index":36038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 80.0878 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017284313","spectrum_index":36039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 145.0524 Da; putative annotation: N/A; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.118,"smiles":null,"spectrum_id":"CCMSLIB00017284315","spectrum_index":36040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 575.3511 Da; putative annotation: N/A; putative formula: C38H45N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.385,"smiles":null,"spectrum_id":"CCMSLIB00017284318","spectrum_index":36041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 333.1098 Da; putative annotation: N/A; putative formula: C13H16N7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.211,"smiles":null,"spectrum_id":"CCMSLIB00017284321","spectrum_index":36042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Methoxybenzyl)(2-nitrophenyl)methanamine (delta mass: 131.071 Da; putative annotation: N/A; putative formula: C3H10N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.194,"smiles":null,"spectrum_id":"CCMSLIB00017284323","spectrum_index":36043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 129.0145 Da; putative annotation: N/A; putative formula: C8H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.085,"smiles":null,"spectrum_id":"CCMSLIB00017284326","spectrum_index":36044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 46.0052 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.107,"smiles":null,"spectrum_id":"CCMSLIB00017284329","spectrum_index":36045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 133.1017 Da; putative annotation: N/A; putative formula: C8H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.19,"smiles":null,"spectrum_id":"CCMSLIB00017284332","spectrum_index":36046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 418.2435 Da; putative annotation: N/A; putative formula: C19H38N4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.345,"smiles":null,"spectrum_id":"CCMSLIB00017284335","spectrum_index":36047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 237.9268 Da; putative annotation: N/A; putative formula: C6H6O2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.007,"smiles":null,"spectrum_id":"CCMSLIB00017284337","spectrum_index":36048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethoxy-2(1H)-quinolinone (delta mass: 16.9836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.065,"smiles":null,"spectrum_id":"CCMSLIB00017284340","spectrum_index":36049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 223.131 Da; putative annotation: N/A; putative formula: C11H17N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.292,"smiles":null,"spectrum_id":"CCMSLIB00017284343","spectrum_index":36050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 21.0196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.085,"smiles":null,"spectrum_id":"CCMSLIB00017284346","spectrum_index":36051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 204.0743 Da; putative annotation: N/A; putative formula: C7H12N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.155,"smiles":null,"spectrum_id":"CCMSLIB00017284349","spectrum_index":36052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 42.046 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.2,"smiles":null,"spectrum_id":"CCMSLIB00017284351","spectrum_index":36053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 543.4647 Da; putative annotation: N/A; putative formula: C35H61NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.535,"smiles":null,"spectrum_id":"CCMSLIB00017284354","spectrum_index":36054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 15.0177 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.093,"smiles":null,"spectrum_id":"CCMSLIB00017284357","spectrum_index":36055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S-Carboxymethyl-L-cysteine (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.043,"smiles":null,"spectrum_id":"CCMSLIB00017284360","spectrum_index":36056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 30.0107 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017284362","spectrum_index":36057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 59.9887 Da; putative annotation: N/A; putative formula: HN2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.096,"smiles":null,"spectrum_id":"CCMSLIB00017284365","spectrum_index":36058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 173.0482 Da; putative annotation: N/A; putative formula: C10H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.134,"smiles":null,"spectrum_id":"CCMSLIB00017284368","spectrum_index":36059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Lys (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.25,"smiles":null,"spectrum_id":"CCMSLIB00017284371","spectrum_index":36060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 218.0534 Da; putative annotation: N/A; putative formula: C9H15O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.208,"smiles":null,"spectrum_id":"CCMSLIB00017284373","spectrum_index":36061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 154.9895 Da; putative annotation: N/A; putative formula: C2H5NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.086,"smiles":null,"spectrum_id":"CCMSLIB00017284376","spectrum_index":36062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 174.141 Da; putative annotation: N/A; putative formula: C13H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017284379","spectrum_index":36063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 111.0287 Da; putative annotation: N/A; putative formula: CHN7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.124,"smiles":null,"spectrum_id":"CCMSLIB00017284382","spectrum_index":36064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 371.1488 Da; putative annotation: N/A; putative formula: C20H25N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.246,"smiles":null,"spectrum_id":"CCMSLIB00017284384","spectrum_index":36065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 24.092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.172,"smiles":null,"spectrum_id":"CCMSLIB00017284387","spectrum_index":36066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 64.0552 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.106,"smiles":null,"spectrum_id":"CCMSLIB00017284390","spectrum_index":36067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 61.0461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.112,"smiles":null,"spectrum_id":"CCMSLIB00017284392","spectrum_index":36068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 70.0 eV (delta mass: 91.0432 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.135,"smiles":null,"spectrum_id":"CCMSLIB00017284395","spectrum_index":36069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.166,"smiles":null,"spectrum_id":"CCMSLIB00017284398","spectrum_index":36070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 53.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.112,"smiles":null,"spectrum_id":"CCMSLIB00017284401","spectrum_index":36071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 8.9647 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.04,"smiles":null,"spectrum_id":"CCMSLIB00017284403","spectrum_index":36072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimifugin (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.128,"smiles":null,"spectrum_id":"CCMSLIB00017284406","spectrum_index":36073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 82.0204 Da; putative annotation: N/A; putative formula: C8H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.144,"smiles":null,"spectrum_id":"CCMSLIB00017284408","spectrum_index":36074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 742.725 Da; putative annotation: N/A; putative formula: C51H90N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":964.822,"smiles":null,"spectrum_id":"CCMSLIB00017284411","spectrum_index":36075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of curcumin CollisionEnergy:102040 (delta mass: 218.1656 Da; putative annotation: N/A; putative formula: C9H23N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.299,"smiles":null,"spectrum_id":"CCMSLIB00017284414","spectrum_index":36076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 13.0313 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.175,"smiles":null,"spectrum_id":"CCMSLIB00017284416","spectrum_index":36077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 28.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.107,"smiles":null,"spectrum_id":"CCMSLIB00017284418","spectrum_index":36078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GALACTOSAMINE (delta mass: 45.0246 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.111,"smiles":null,"spectrum_id":"CCMSLIB00017284421","spectrum_index":36079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 922.4907 Da; putative annotation: N/A; putative formula: C48H74O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1085.55,"smiles":null,"spectrum_id":"CCMSLIB00017284424","spectrum_index":36080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1,1-Tris(hydroxymethyl)propane (delta mass: 134.1067 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.208,"smiles":null,"spectrum_id":"CCMSLIB00017284425","spectrum_index":36081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dehydrocoelenterazine (delta mass: 18.0099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.16,"smiles":null,"spectrum_id":"CCMSLIB00017284428","spectrum_index":36082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 572.2612 Da; putative annotation: N/A; putative formula: C25H41N4O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.514,"smiles":null,"spectrum_id":"CCMSLIB00017284431","spectrum_index":36083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 346.0856 Da; putative annotation: N/A; putative formula: C22H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.219,"smiles":null,"spectrum_id":"CCMSLIB00017284434","spectrum_index":36084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 146.1656 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.246,"smiles":null,"spectrum_id":"CCMSLIB00017284437","spectrum_index":36085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 269.1114 Da; putative annotation: N/A; putative formula: C12H20N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.187,"smiles":null,"spectrum_id":"CCMSLIB00017284439","spectrum_index":36086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 275.2909 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.393,"smiles":null,"spectrum_id":"CCMSLIB00017284441","spectrum_index":36087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 305.1674 Da; putative annotation: N/A; putative formula: C15H23N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.238,"smiles":null,"spectrum_id":"CCMSLIB00017284444","spectrum_index":36088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 83.0331 Da; putative annotation: N/A; putative formula: HN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.113,"smiles":null,"spectrum_id":"CCMSLIB00017284447","spectrum_index":36089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 73.1059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.143,"smiles":null,"spectrum_id":"CCMSLIB00017284449","spectrum_index":36090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 133.169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.224,"smiles":null,"spectrum_id":"CCMSLIB00017284451","spectrum_index":36091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 152.0443 Da; putative annotation: N/A; putative formula: C4H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.095,"smiles":null,"spectrum_id":"CCMSLIB00017284454","spectrum_index":36092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 41.0626 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.202,"smiles":null,"spectrum_id":"CCMSLIB00017284457","spectrum_index":36093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 365.2675 Da; putative annotation: N/A; putative formula: C20H35N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.364,"smiles":null,"spectrum_id":"CCMSLIB00017284459","spectrum_index":36094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tributyl citrate (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.249,"smiles":null,"spectrum_id":"CCMSLIB00017284461","spectrum_index":36095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 34.0209 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.097,"smiles":null,"spectrum_id":"CCMSLIB00017284464","spectrum_index":36096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diprotin B (delta mass: 203.1123 Da; putative annotation: N/A; putative formula: C5H13N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.335,"smiles":null,"spectrum_id":"CCMSLIB00017284467","spectrum_index":36097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 74.0522 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.191,"smiles":null,"spectrum_id":"CCMSLIB00017284470","spectrum_index":36098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 74.037 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.139,"smiles":null,"spectrum_id":"CCMSLIB00017284473","spectrum_index":36099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00017 Biotin (delta mass: 122.0546 Da; putative annotation: N/A; putative formula: H6N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017284474","spectrum_index":36100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 53.0631 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.144,"smiles":null,"spectrum_id":"CCMSLIB00017284477","spectrum_index":36101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Ethyl-9H-carbazol-3-ylamine (delta mass: 174.1053 Da; putative annotation: N/A; putative formula: C5H14N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.228,"smiles":null,"spectrum_id":"CCMSLIB00017284480","spectrum_index":36102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 140.121 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.229,"smiles":null,"spectrum_id":"CCMSLIB00017284482","spectrum_index":36103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one (delta mass: 83.0315 Da; putative annotation: N/A; putative formula: C4H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.059,"smiles":null,"spectrum_id":"CCMSLIB00017284484","spectrum_index":36104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Murrayafoline A (delta mass: 58.0486 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.156,"smiles":null,"spectrum_id":"CCMSLIB00017284487","spectrum_index":36105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 384.143 Da; putative annotation: N/A; putative formula: C19H28O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.345,"smiles":null,"spectrum_id":"CCMSLIB00017284490","spectrum_index":36106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 82.0782 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.253,"smiles":null,"spectrum_id":"CCMSLIB00017284491","spectrum_index":36107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.118,"smiles":null,"spectrum_id":"CCMSLIB00017284494","spectrum_index":36108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 123.9973 Da; putative annotation: N/A; putative formula: H5N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.078,"smiles":null,"spectrum_id":"CCMSLIB00017284497","spectrum_index":36109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 31.9413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.111,"smiles":null,"spectrum_id":"CCMSLIB00017284499","spectrum_index":36110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 38.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017284502","spectrum_index":36111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 423.2894 Da; putative annotation: N/A; putative formula: C26H37N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.385,"smiles":null,"spectrum_id":"CCMSLIB00017284505","spectrum_index":36112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(4-Nitrophenyl)-1,3-propanediamine (delta mass: 43.0152 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.123,"smiles":null,"spectrum_id":"CCMSLIB00017284508","spectrum_index":36113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 583.2124 Da; putative annotation: N/A; putative formula: C34H34NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":734.273,"smiles":null,"spectrum_id":"CCMSLIB00017284509","spectrum_index":36114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 183.1276 Da; putative annotation: N/A; putative formula: C9H18N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.188,"smiles":null,"spectrum_id":"CCMSLIB00017284513","spectrum_index":36115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 29.0995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.16,"smiles":null,"spectrum_id":"CCMSLIB00017284515","spectrum_index":36116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 172.1096 Da; putative annotation: N/A; putative formula: C9H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.279,"smiles":null,"spectrum_id":"CCMSLIB00017284518","spectrum_index":36117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 130.1721 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.269,"smiles":null,"spectrum_id":"CCMSLIB00017284521","spectrum_index":36118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Formyltryptophan (delta mass: 90.0469 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.139,"smiles":null,"spectrum_id":"CCMSLIB00017284522","spectrum_index":36119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 254.1367 Da; putative annotation: N/A; putative formula: C13H23N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.202,"smiles":null,"spectrum_id":"CCMSLIB00017284525","spectrum_index":36120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylcinchoninamide (delta mass: 60.0205 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.107,"smiles":null,"spectrum_id":"CCMSLIB00017284528","spectrum_index":36121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 322.216 Da; putative annotation: N/A; putative formula: C20H26N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.302,"smiles":null,"spectrum_id":"CCMSLIB00017284531","spectrum_index":36122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 474.2331 Da; putative annotation: N/A; putative formula: C23H35N6OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.303,"smiles":null,"spectrum_id":"CCMSLIB00017284533","spectrum_index":36123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 238.2288 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.305,"smiles":null,"spectrum_id":"CCMSLIB00017284536","spectrum_index":36124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 61.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.144,"smiles":null,"spectrum_id":"CCMSLIB00017284539","spectrum_index":36125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 126.0273 Da; putative annotation: N/A; putative formula: C2H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.125,"smiles":null,"spectrum_id":"CCMSLIB00017284542","spectrum_index":36126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2,9,10-trimethoxy-5,6-dihydroisoquinolino[3,2-a]isoquinolinium cation (delta mass: 18.0833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.222,"smiles":null,"spectrum_id":"CCMSLIB00017284544","spectrum_index":36127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 16.0567 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.107,"smiles":null,"spectrum_id":"CCMSLIB00017284547","spectrum_index":36128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 354.6889 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.76,"smiles":null,"spectrum_id":"CCMSLIB00017284550","spectrum_index":36129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 68.0709 Da; putative annotation: N/A; putative formula: C4H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.224,"smiles":null,"spectrum_id":"CCMSLIB00017284552","spectrum_index":36130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 49.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.092,"smiles":null,"spectrum_id":"CCMSLIB00017284555","spectrum_index":36131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 365.2048 Da; putative annotation: N/A; putative formula: C16H31NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.353,"smiles":null,"spectrum_id":"CCMSLIB00017284558","spectrum_index":36132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1012.7989 Da; putative annotation: N/A; putative formula: C50H92N24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1234.9,"smiles":null,"spectrum_id":"CCMSLIB00017284561","spectrum_index":36133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2,5-Dihydroxyhexyl)oxolan-2-one (delta mass: 17.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.154,"smiles":null,"spectrum_id":"CCMSLIB00017284563","spectrum_index":36134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 114.0682 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.17,"smiles":null,"spectrum_id":"CCMSLIB00017284566","spectrum_index":36135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 18.1477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.12,"smiles":null,"spectrum_id":"CCMSLIB00017284569","spectrum_index":36136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 755.4528 Da; putative annotation: N/A; putative formula: C33H65N5O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":918.513,"smiles":null,"spectrum_id":"CCMSLIB00017284570","spectrum_index":36137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 92.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.18,"smiles":null,"spectrum_id":"CCMSLIB00017284573","spectrum_index":36138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 83.0376 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017284576","spectrum_index":36139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromoindoline (delta mass: 218.3839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.375,"smiles":null,"spectrum_id":"CCMSLIB00017284579","spectrum_index":36140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 252.2834 Da; putative annotation: N/A; putative formula: C18H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.37,"smiles":null,"spectrum_id":"CCMSLIB00017284582","spectrum_index":36141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 289.0509 Da; putative annotation: N/A; putative formula: C7H12N7O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.142,"smiles":null,"spectrum_id":"CCMSLIB00017284583","spectrum_index":36142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 493.398 Da; putative annotation: N/A; putative formula: C27H51N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.547,"smiles":null,"spectrum_id":"CCMSLIB00017284586","spectrum_index":36143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 507.4142 Da; putative annotation: N/A; putative formula: C28H53N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.563,"smiles":null,"spectrum_id":"CCMSLIB00017284589","spectrum_index":36144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 52.0312 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.175,"smiles":null,"spectrum_id":"CCMSLIB00017284592","spectrum_index":36145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 135.0535 Da; putative annotation: N/A; putative formula: C4H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.155,"smiles":null,"spectrum_id":"CCMSLIB00017284593","spectrum_index":36146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 94.0779 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017284596","spectrum_index":36147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 390.2784 Da; putative annotation: N/A; putative formula: C25H34N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.36,"smiles":null,"spectrum_id":"CCMSLIB00017284599","spectrum_index":36148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 203.0437 Da; putative annotation: N/A; putative formula: C8H13NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.156,"smiles":null,"spectrum_id":"CCMSLIB00017284602","spectrum_index":36149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 92.0259 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.149,"smiles":null,"spectrum_id":"CCMSLIB00017284604","spectrum_index":36150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 83.0337 Da; putative annotation: N/A; putative formula: HN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.187,"smiles":null,"spectrum_id":"CCMSLIB00017284606","spectrum_index":36151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 146.0793 Da; putative annotation: N/A; putative formula: C4H10N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.239,"smiles":null,"spectrum_id":"CCMSLIB00017284609","spectrum_index":36152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7,8a-dihydroxy-1-methoxy-7-methyl-1H-isochromene-6,8-dione (delta mass: 60.0194 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.161,"smiles":null,"spectrum_id":"CCMSLIB00017284612","spectrum_index":36153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 76.0677 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017284614","spectrum_index":36154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 290.1815 Da; putative annotation: N/A; putative formula: C17H26N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.257,"smiles":null,"spectrum_id":"CCMSLIB00017284616","spectrum_index":36155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.091,"smiles":null,"spectrum_id":"CCMSLIB00017284619","spectrum_index":36156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 141.0778 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.154,"smiles":null,"spectrum_id":"CCMSLIB00017284622","spectrum_index":36157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 134.105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.165,"smiles":null,"spectrum_id":"CCMSLIB00017284624","spectrum_index":36158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 128.0621 Da; putative annotation: N/A; putative formula: C4H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017284627","spectrum_index":36159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 304.0949 Da; putative annotation: N/A; putative formula: C16H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.166,"smiles":null,"spectrum_id":"CCMSLIB00017284630","spectrum_index":36160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 149.0949 Da; putative annotation: N/A; putative formula: C8H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.143,"smiles":null,"spectrum_id":"CCMSLIB00017284632","spectrum_index":36161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.beta.-Leucine (delta mass: 9.9845 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.086,"smiles":null,"spectrum_id":"CCMSLIB00017284635","spectrum_index":36162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 174.1047 Da; putative annotation: N/A; putative formula: C12H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.16,"smiles":null,"spectrum_id":"CCMSLIB00017284638","spectrum_index":36163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 64.031 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017284640","spectrum_index":36164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371603 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 82.0058 Da; putative annotation: N/A; putative formula: C4H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.076,"smiles":null,"spectrum_id":"CCMSLIB00017284643","spectrum_index":36165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 72.075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.142,"smiles":null,"spectrum_id":"CCMSLIB00017284646","spectrum_index":36166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 268.0375 Da; putative annotation: N/A; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.108,"smiles":null,"spectrum_id":"CCMSLIB00017284649","spectrum_index":36167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4,5-Trimethoxyphenyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol (delta mass: 162.0536 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.203,"smiles":null,"spectrum_id":"CCMSLIB00017284650","spectrum_index":36168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epinephrine (delta mass: 340.1081 Da; putative annotation: N/A; putative formula: C17H25OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.205,"smiles":null,"spectrum_id":"CCMSLIB00017284653","spectrum_index":36169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 26.0157 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.149,"smiles":null,"spectrum_id":"CCMSLIB00017284656","spectrum_index":36170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 215.1002 Da; putative annotation: N/A; putative formula: C9H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.233,"smiles":null,"spectrum_id":"CCMSLIB00017284659","spectrum_index":36171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 57.0233 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.127,"smiles":null,"spectrum_id":"CCMSLIB00017284662","spectrum_index":36172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 143.0576 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.181,"smiles":null,"spectrum_id":"CCMSLIB00017284664","spectrum_index":36173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 198.1246 Da; putative annotation: 5-(Hydroxymethyl)-3-(1-hydroxy-4-methylpentyl)oxolan-2-one; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.165,"smiles":null,"spectrum_id":"CCMSLIB00017284666","spectrum_index":36174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 141.057 Da; putative annotation: 5-Methyl-8-quinolinol; putative formula: C10H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.143,"smiles":null,"spectrum_id":"CCMSLIB00017284669","spectrum_index":36175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophol (delta mass: 113.0842 Da; putative annotation: 6-Aminocaproic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.176,"smiles":null,"spectrum_id":"CCMSLIB00017284672","spectrum_index":36176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 114.0682 Da; putative annotation: 2-ETHYL-2-HYDROXYBUTYRIC ACID; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017284674","spectrum_index":36177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100279 D-Sorbitol|D-Sorbit|D-Glucitol|D-1,2,3,4,5,6-Hexanehexol|D-Sorbol|Cystosol|Glucarine|Diakarmon|Esasorb|Sorbol (delta mass: 132.078 Da; putative annotation: Triethylene glycol; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.164,"smiles":null,"spectrum_id":"CCMSLIB00017284676","spectrum_index":36178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 126.0333 Da; putative annotation: 2-(Hydroxymethyl)-3-methoxy-2H-furan-5-one; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.098,"smiles":null,"spectrum_id":"CCMSLIB00017284679","spectrum_index":36179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Asp (delta mass: 113.0848 Da; putative annotation: 1747371 - 40.0 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.214,"smiles":null,"spectrum_id":"CCMSLIB00017284682","spectrum_index":36180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 198.1047 Da; putative annotation: (1R,6R)-6-Benzylcyclohex-3-enecarboxylic acid; putative formula: C14H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017284683","spectrum_index":36181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 96.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.358,"smiles":null,"spectrum_id":"CCMSLIB00017284686","spectrum_index":36182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 153.0998 Da; putative annotation: N/A; putative formula: C6H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.233,"smiles":null,"spectrum_id":"CCMSLIB00017284689","spectrum_index":36183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:102040 (delta mass: 310.2121 Da; putative annotation: N/A; putative formula: C22H30O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.293,"smiles":null,"spectrum_id":"CCMSLIB00017284692","spectrum_index":36184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 204.0636 Da; putative annotation: N/A; putative formula: C8H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.134,"smiles":null,"spectrum_id":"CCMSLIB00017284693","spectrum_index":36185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 190.0658 Da; putative annotation: N/A; putative formula: C10H11N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.152,"smiles":null,"spectrum_id":"CCMSLIB00017284696","spectrum_index":36186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 779.2994 Da; putative annotation: N/A; putative formula: C50H41N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1118.42,"smiles":null,"spectrum_id":"CCMSLIB00017284699","spectrum_index":36187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 690.2969 Da; putative annotation: N/A; putative formula: C50H44O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.357,"smiles":null,"spectrum_id":"CCMSLIB00017284702","spectrum_index":36188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169406-02_C15H18O8_2-Propenoic acid, 3-[4-(beta-D-glucopyranosyloxy)phenyl]-, (2E)- (delta mass: 128.0294 Da; putative annotation: N/A; putative formula: C6H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.137,"smiles":null,"spectrum_id":"CCMSLIB00017284703","spectrum_index":36189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:102040 (delta mass: 131.047 Da; putative annotation: N/A; putative formula: C7H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.142,"smiles":null,"spectrum_id":"CCMSLIB00017284706","spectrum_index":36190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 276.0481 Da; putative annotation: N/A; putative formula: C8N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.145,"smiles":null,"spectrum_id":"CCMSLIB00017284709","spectrum_index":36191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 100.0588 Da; putative annotation: N/A; putative formula: H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.185,"smiles":null,"spectrum_id":"CCMSLIB00017284710","spectrum_index":36192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 426.1374 Da; putative annotation: N/A; putative formula: C16H26O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.198,"smiles":null,"spectrum_id":"CCMSLIB00017284713","spectrum_index":36193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 204.0646 Da; putative annotation: N/A; putative formula: C9H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.193,"smiles":null,"spectrum_id":"CCMSLIB00017284716","spectrum_index":36194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Acetyloxy)-2-naphthoic acid (delta mass: 100.052 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.117,"smiles":null,"spectrum_id":"CCMSLIB00017284719","spectrum_index":36195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 112.0271 Da; putative annotation: N/A; putative formula: C4H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.149,"smiles":null,"spectrum_id":"CCMSLIB00017284721","spectrum_index":36196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 209.478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.564,"smiles":null,"spectrum_id":"CCMSLIB00017284724","spectrum_index":36197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-(2-fluorophenoxy)ethanamine (delta mass: 18.0156 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.145,"smiles":null,"spectrum_id":"CCMSLIB00017284727","spectrum_index":36198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 158.0459 Da; putative annotation: N/A; putative formula: C5H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017284730","spectrum_index":36199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 30.0087 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.057,"smiles":null,"spectrum_id":"CCMSLIB00017284732","spectrum_index":36200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 78.0217 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.097,"smiles":null,"spectrum_id":"CCMSLIB00017284734","spectrum_index":36201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 235.1074 Da; putative annotation: N/A; putative formula: C10H13N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.241,"smiles":null,"spectrum_id":"CCMSLIB00017284737","spectrum_index":36202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-2-phenylpropan-1-amine (delta mass: 100.0528 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.18,"smiles":null,"spectrum_id":"CCMSLIB00017284740","spectrum_index":36203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 102.2198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.324,"smiles":null,"spectrum_id":"CCMSLIB00017284742","spectrum_index":36204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 263.1002 Da; putative annotation: N/A; putative formula: C10H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.224,"smiles":null,"spectrum_id":"CCMSLIB00017284745","spectrum_index":36205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6'-Anhydrooxysporidinone (delta mass: 471.2941 Da; putative annotation: N/A; putative formula: C23H41N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.6,"smiles":null,"spectrum_id":"CCMSLIB00017284748","spectrum_index":36206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 436.0616 Da; putative annotation: N/A; putative formula: C23H16O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.157,"smiles":null,"spectrum_id":"CCMSLIB00017284751","spectrum_index":36207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 297.1266 Da; putative annotation: N/A; putative formula: C20H15N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.176,"smiles":null,"spectrum_id":"CCMSLIB00017284753","spectrum_index":36208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 219.1462 Da; putative annotation: N/A; putative formula: C10H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.227,"smiles":null,"spectrum_id":"CCMSLIB00017284756","spectrum_index":36209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 77.033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.093,"smiles":null,"spectrum_id":"CCMSLIB00017284759","spectrum_index":36210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU161802 Ecgonine-methyl-ester (EME)|AC1L9FBF|methyl (3S,4R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate (delta mass: 41.9921 Da; putative annotation: N/A; putative formula: C2H2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.12,"smiles":null,"spectrum_id":"CCMSLIB00017284761","spectrum_index":36211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 292.2742 Da; putative annotation: N/A; putative formula: C16H32N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":885.55,"smiles":null,"spectrum_id":"CCMSLIB00017284764","spectrum_index":36212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 125.0684 Da; putative annotation: N/A; putative formula: C4H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.134,"smiles":null,"spectrum_id":"CCMSLIB00017284767","spectrum_index":36213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 236.074 Da; putative annotation: N/A; putative formula: C18H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.154,"smiles":null,"spectrum_id":"CCMSLIB00017284768","spectrum_index":36214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 52.0316 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017284771","spectrum_index":36215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 677.5062 Da; putative annotation: N/A; putative formula: C33H63N11O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":858.577,"smiles":null,"spectrum_id":"CCMSLIB00017284774","spectrum_index":36216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 112.145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.19,"smiles":null,"spectrum_id":"CCMSLIB00017284777","spectrum_index":36217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 28.0048 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017284779","spectrum_index":36218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 166.0281 Da; putative annotation: N/A; putative formula: C9H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.105,"smiles":null,"spectrum_id":"CCMSLIB00017284781","spectrum_index":36219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 110.0485 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.145,"smiles":null,"spectrum_id":"CCMSLIB00017284784","spectrum_index":36220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 70.039 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.167,"smiles":null,"spectrum_id":"CCMSLIB00017284787","spectrum_index":36221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 191.153 Da; putative annotation: N/A; putative formula: C10H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.224,"smiles":null,"spectrum_id":"CCMSLIB00017284790","spectrum_index":36222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 15.9946 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.096,"smiles":null,"spectrum_id":"CCMSLIB00017284792","spectrum_index":36223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrexone (delta mass: 48.0032 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.173,"smiles":null,"spectrum_id":"CCMSLIB00017284795","spectrum_index":36224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 292.2406 Da; putative annotation: N/A; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.364,"smiles":null,"spectrum_id":"CCMSLIB00017284797","spectrum_index":36225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001048987-01!5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-methoxyphenol\"\" (delta mass: 192.1347 Da; putative annotation: N/A; putative formula: C13H20O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.305,"smiles":null,"spectrum_id":"CCMSLIB00017284800","spectrum_index":36226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 390.1996 Da; putative annotation: N/A; putative formula: C19H35O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.338,"smiles":null,"spectrum_id":"CCMSLIB00017284803","spectrum_index":36227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 23.0159 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017284805","spectrum_index":36228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 210.1993 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.307,"smiles":null,"spectrum_id":"CCMSLIB00017284808","spectrum_index":36229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 122.0729 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017284811","spectrum_index":36230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 280.0708 Da; putative annotation: N/A; putative formula: C13H8N6O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.157,"smiles":null,"spectrum_id":"CCMSLIB00017284813","spectrum_index":36231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 68.0265 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.066,"smiles":null,"spectrum_id":"CCMSLIB00017284816","spectrum_index":36232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 60.0776 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.158,"smiles":null,"spectrum_id":"CCMSLIB00017284819","spectrum_index":36233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 181.0412 Da; putative annotation: N/A; putative formula: C5H11NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.128,"smiles":null,"spectrum_id":"CCMSLIB00017284821","spectrum_index":36234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 202.0743 Da; putative annotation: N/A; putative formula: C11H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.145,"smiles":null,"spectrum_id":"CCMSLIB00017284823","spectrum_index":36235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 60.0422 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.17,"smiles":null,"spectrum_id":"CCMSLIB00017284826","spectrum_index":36236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 60.0363 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.086,"smiles":null,"spectrum_id":"CCMSLIB00017284829","spectrum_index":36237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 31.0426 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017284832","spectrum_index":36238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.133,"smiles":null,"spectrum_id":"CCMSLIB00017284833","spectrum_index":36239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 43.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017284836","spectrum_index":36240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 115.0265 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.118,"smiles":null,"spectrum_id":"CCMSLIB00017284839","spectrum_index":36241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 111.0432 Da; putative annotation: N/A; putative formula: C4H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.129,"smiles":null,"spectrum_id":"CCMSLIB00017284840","spectrum_index":36242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 153.1145 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.201,"smiles":null,"spectrum_id":"CCMSLIB00017284843","spectrum_index":36243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 226.1573 Da; putative annotation: N/A; putative formula: C13H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.233,"smiles":null,"spectrum_id":"CCMSLIB00017284846","spectrum_index":36244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 11.0184 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.074,"smiles":null,"spectrum_id":"CCMSLIB00017284849","spectrum_index":36245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 30.0142 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.094,"smiles":null,"spectrum_id":"CCMSLIB00017284850","spectrum_index":36246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 212.089 Da; putative annotation: N/A; putative formula: C11H18P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.159,"smiles":null,"spectrum_id":"CCMSLIB00017284853","spectrum_index":36247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Arg (delta mass: 189.0569 Da; putative annotation: N/A; putative formula: C8H8N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.26,"smiles":null,"spectrum_id":"CCMSLIB00017284855","spectrum_index":36248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 447.3189 Da; putative annotation: N/A; putative formula: C27H47NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.379,"smiles":null,"spectrum_id":"CCMSLIB00017284857","spectrum_index":36249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 90.0469 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017284860","spectrum_index":36250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 255.2561 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.389,"smiles":null,"spectrum_id":"CCMSLIB00017284863","spectrum_index":36251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 64.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.144,"smiles":null,"spectrum_id":"CCMSLIB00017284865","spectrum_index":36252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 192.1112 Da; putative annotation: N/A; putative formula: C7H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.213,"smiles":null,"spectrum_id":"CCMSLIB00017284867","spectrum_index":36253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Arg (delta mass: 97.0413 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.244,"smiles":null,"spectrum_id":"CCMSLIB00017284870","spectrum_index":36254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 48.0206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.055,"smiles":null,"spectrum_id":"CCMSLIB00017284873","spectrum_index":36255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 754.4231 Da; putative annotation: N/A; putative formula: C50H58O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1056.56,"smiles":null,"spectrum_id":"CCMSLIB00017284876","spectrum_index":36256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 100.0865 Da; putative annotation: N/A; putative formula: C2H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.251,"smiles":null,"spectrum_id":"CCMSLIB00017284878","spectrum_index":36257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 70.0419 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017284880","spectrum_index":36258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 124.0416 Da; putative annotation: N/A; putative formula: C9H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.176,"smiles":null,"spectrum_id":"CCMSLIB00017284883","spectrum_index":36259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 17.8723 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.975,"smiles":null,"spectrum_id":"CCMSLIB00017284885","spectrum_index":36260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 82.041 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.106,"smiles":null,"spectrum_id":"CCMSLIB00017284887","spectrum_index":36261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 183.0894 Da; putative annotation: N/A; putative formula: C9H13NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.181,"smiles":null,"spectrum_id":"CCMSLIB00017284890","spectrum_index":36262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 40.029 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.094,"smiles":null,"spectrum_id":"CCMSLIB00017284893","spectrum_index":36263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-3-(4-piperidinyl)-1H-indole (delta mass: 77.0608 Da; putative annotation: N/A; putative formula: C6H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.19,"smiles":null,"spectrum_id":"CCMSLIB00017284894","spectrum_index":36264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Aminocamptothecin (delta mass: 130.0705 Da; putative annotation: N/A; putative formula: C4H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.2,"smiles":null,"spectrum_id":"CCMSLIB00017284897","spectrum_index":36265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074903 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 10.9794 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.06,"smiles":null,"spectrum_id":"CCMSLIB00017284900","spectrum_index":36266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 53.0265 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.066,"smiles":null,"spectrum_id":"CCMSLIB00017284902","spectrum_index":36267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 207.0972 Da; putative annotation: N/A; putative formula: C6H17N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.155,"smiles":null,"spectrum_id":"CCMSLIB00017284904","spectrum_index":36268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 174.0016 Da; putative annotation: N/A; putative formula: C5H7N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.151,"smiles":null,"spectrum_id":"CCMSLIB00017284907","spectrum_index":36269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 129.103 Da; putative annotation: N/A; putative formula: C4H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.221,"smiles":null,"spectrum_id":"CCMSLIB00017284910","spectrum_index":36270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 32.0254 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.064,"smiles":null,"spectrum_id":"CCMSLIB00017284912","spectrum_index":36271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-beta-D-galactosamine - 40.0 eV (delta mass: 160.0738 Da; putative annotation: N/A; putative formula: C2H9N8O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.171,"smiles":null,"spectrum_id":"CCMSLIB00017284914","spectrum_index":36272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 41.0246 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.059,"smiles":null,"spectrum_id":"CCMSLIB00017284917","spectrum_index":36273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 278.0938 Da; putative annotation: N/A; putative formula: C10H18N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.19,"smiles":null,"spectrum_id":"CCMSLIB00017284919","spectrum_index":36274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 262.1189 Da; putative annotation: N/A; putative formula: C9H19N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.274,"smiles":null,"spectrum_id":"CCMSLIB00017284921","spectrum_index":36275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 393.2157 Da; putative annotation: N/A; putative formula: C22H35NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.276,"smiles":null,"spectrum_id":"CCMSLIB00017284924","spectrum_index":36276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 52.031 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.206,"smiles":null,"spectrum_id":"CCMSLIB00017284927","spectrum_index":36277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 148.052 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017284928","spectrum_index":36278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 115.9418 Da; putative annotation: N/A; putative formula: C3H2O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.028,"smiles":null,"spectrum_id":"CCMSLIB00017284931","spectrum_index":36279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 356.2203 Da; putative annotation: N/A; putative formula: C20H36OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.291,"smiles":null,"spectrum_id":"CCMSLIB00017284934","spectrum_index":36280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 193.0647 Da; putative annotation: N/A; putative formula: C12H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.26,"smiles":null,"spectrum_id":"CCMSLIB00017284935","spectrum_index":36281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 78.9699 Da; putative annotation: N/A; putative formula: HNO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.03,"smiles":null,"spectrum_id":"CCMSLIB00017284938","spectrum_index":36282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 871.4943 Da; putative annotation: N/A; putative formula: C45H69N5O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1036.57,"smiles":null,"spectrum_id":"CCMSLIB00017284941","spectrum_index":36283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 28.0787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.166,"smiles":null,"spectrum_id":"CCMSLIB00017284942","spectrum_index":36284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid; AIF; CE0; MS2Dec (delta mass: 234.132 Da; putative annotation: N/A; putative formula: C10H23N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.203,"smiles":null,"spectrum_id":"CCMSLIB00017284945","spectrum_index":36285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 591.2856 Da; putative annotation: N/A; putative formula: C36H41N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.445,"smiles":null,"spectrum_id":"CCMSLIB00017284948","spectrum_index":36286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 434.337 Da; putative annotation: N/A; putative formula: C31H46O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.407,"smiles":null,"spectrum_id":"CCMSLIB00017284949","spectrum_index":36287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 73.9985 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.069,"smiles":null,"spectrum_id":"CCMSLIB00017284952","spectrum_index":36288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.219,"smiles":null,"spectrum_id":"CCMSLIB00017284954","spectrum_index":36289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 2-hydroxypropanoate (delta mass: 1.9943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":107.049,"smiles":null,"spectrum_id":"CCMSLIB00017284956","spectrum_index":36290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 274.0314 Da; putative annotation: N/A; putative formula: C15H6N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.118,"smiles":null,"spectrum_id":"CCMSLIB00017284959","spectrum_index":36291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 457.169 Da; putative annotation: N/A; putative formula: C32H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.266,"smiles":null,"spectrum_id":"CCMSLIB00017284961","spectrum_index":36292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 71.0164 Da; putative annotation: N/A; putative formula: C6HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017284963","spectrum_index":36293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C6:0 (delta mass: 350.0996 Da; putative annotation: N/A; putative formula: C11H19N4O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.26,"smiles":null,"spectrum_id":"CCMSLIB00017284966","spectrum_index":36294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 572.4974 Da; putative annotation: N/A; putative formula: C34H64N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.569,"smiles":null,"spectrum_id":"CCMSLIB00017284967","spectrum_index":36295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 390.7443 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.831,"smiles":null,"spectrum_id":"CCMSLIB00017284970","spectrum_index":36296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 385.2652 Da; putative annotation: N/A; putative formula: C21H39NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":920.536,"smiles":null,"spectrum_id":"CCMSLIB00017284971","spectrum_index":36297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Glu (delta mass: 128.0574 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.177,"smiles":null,"spectrum_id":"CCMSLIB00017284974","spectrum_index":36298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 778.3305 Da; putative annotation: N/A; putative formula: C46H46N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":938.427,"smiles":null,"spectrum_id":"CCMSLIB00017284977","spectrum_index":36299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.18,"smiles":null,"spectrum_id":"CCMSLIB00017284978","spectrum_index":36300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 117.0735 Da; putative annotation: N/A; putative formula: C4H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.149,"smiles":null,"spectrum_id":"CCMSLIB00017284981","spectrum_index":36301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethylselegiline (delta mass: 128.0675 Da; putative annotation: N/A; putative formula: H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.195,"smiles":null,"spectrum_id":"CCMSLIB00017284983","spectrum_index":36302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 336.0691 Da; putative annotation: N/A; putative formula: C12H16O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.155,"smiles":null,"spectrum_id":"CCMSLIB00017284985","spectrum_index":36303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.07,"smiles":null,"spectrum_id":"CCMSLIB00017284988","spectrum_index":36304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one (delta mass: 126.1045 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.181,"smiles":null,"spectrum_id":"CCMSLIB00017284989","spectrum_index":36305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 11.0169 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.088,"smiles":null,"spectrum_id":"CCMSLIB00017284992","spectrum_index":36306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 80.9693 Da; putative annotation: N/A; putative formula: C3H-1NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.066,"smiles":null,"spectrum_id":"CCMSLIB00017284995","spectrum_index":36307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 58.0531 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.14,"smiles":null,"spectrum_id":"CCMSLIB00017284998","spectrum_index":36308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 122.0941 Da; putative annotation: N/A; putative formula: C6H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.19,"smiles":null,"spectrum_id":"CCMSLIB00017284999","spectrum_index":36309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 158.9815 Da; putative annotation: N/A; putative formula: C5H5NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.073,"smiles":null,"spectrum_id":"CCMSLIB00017285002","spectrum_index":36310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 254.1483 Da; putative annotation: N/A; putative formula: C10H18N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.313,"smiles":null,"spectrum_id":"CCMSLIB00017285005","spectrum_index":36311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 144.9107 Da; putative annotation: N/A; putative formula: C3H-1NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.982,"smiles":null,"spectrum_id":"CCMSLIB00017285006","spectrum_index":36312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 339.139 Da; putative annotation: N/A; putative formula: C10H21N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.293,"smiles":null,"spectrum_id":"CCMSLIB00017285009","spectrum_index":36313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 224.1082 Da; putative annotation: N/A; putative formula: C11H17N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.2,"smiles":null,"spectrum_id":"CCMSLIB00017285012","spectrum_index":36314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 62.0713 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.225,"smiles":null,"spectrum_id":"CCMSLIB00017285013","spectrum_index":36315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(5-fluoropentyl)- (delta mass: 354.1482 Da; putative annotation: N/A; putative formula: C22H18N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.272,"smiles":null,"spectrum_id":"CCMSLIB00017285016","spectrum_index":36316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 90.0337 Da; putative annotation: N/A; putative formula: C4H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.093,"smiles":null,"spectrum_id":"CCMSLIB00017285019","spectrum_index":36317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 97.9441 Da; putative annotation: N/A; putative formula: C3H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.03,"smiles":null,"spectrum_id":"CCMSLIB00017285020","spectrum_index":36318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 56.0598 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.161,"smiles":null,"spectrum_id":"CCMSLIB00017285023","spectrum_index":36319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE0; CorrDec (delta mass: 132.0398 Da; putative annotation: N/A; putative formula: C9H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.106,"smiles":null,"spectrum_id":"CCMSLIB00017285024","spectrum_index":36320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 450.0665 Da; putative annotation: N/A; putative formula: C28H19PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.215,"smiles":null,"spectrum_id":"CCMSLIB00017285027","spectrum_index":36321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 94.0672 Da; putative annotation: N/A; putative formula: C4H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.185,"smiles":null,"spectrum_id":"CCMSLIB00017285030","spectrum_index":36322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxy-6-methoxy-2-methylspiro[3,4-dihydroisoquinoline-1,7'-6H-cyclopenta[g][1,3]benzodioxole]-8'-one (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.129,"smiles":null,"spectrum_id":"CCMSLIB00017285031","spectrum_index":36323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 64.068 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.217,"smiles":null,"spectrum_id":"CCMSLIB00017285034","spectrum_index":36324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 348.179 Da; putative annotation: N/A; putative formula: C19H29N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.328,"smiles":null,"spectrum_id":"CCMSLIB00017285035","spectrum_index":36325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 110.0531 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.228,"smiles":null,"spectrum_id":"CCMSLIB00017285038","spectrum_index":36326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 112.0675 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017285041","spectrum_index":36327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 463.3879 Da; putative annotation: N/A; putative formula: C26H49N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.536,"smiles":null,"spectrum_id":"CCMSLIB00017285042","spectrum_index":36328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Met-Met (delta mass: 55.0396 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.138,"smiles":null,"spectrum_id":"CCMSLIB00017285045","spectrum_index":36329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 30.0785 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.139,"smiles":null,"spectrum_id":"CCMSLIB00017285046","spectrum_index":36330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine; AIF; CE0; MS2Dec (delta mass: 120.0319 Da; putative annotation: N/A; putative formula: C6H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.129,"smiles":null,"spectrum_id":"CCMSLIB00017285049","spectrum_index":36331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 29.028 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.104,"smiles":null,"spectrum_id":"CCMSLIB00017285052","spectrum_index":36332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:102040\"\" (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017285053","spectrum_index":36333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 65.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.118,"smiles":null,"spectrum_id":"CCMSLIB00017285056","spectrum_index":36334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Acetamido-2-methyl-7-oxononanoic acid (delta mass: 74.0548 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.209,"smiles":null,"spectrum_id":"CCMSLIB00017285057","spectrum_index":36335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 126.0835 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017285060","spectrum_index":36336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-HYDANTOIN (delta mass: 163.0638 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.114,"smiles":null,"spectrum_id":"CCMSLIB00017285061","spectrum_index":36337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 356.1698 Da; putative annotation: N/A; putative formula: C15H24N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.362,"smiles":null,"spectrum_id":"CCMSLIB00017285064","spectrum_index":36338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 68.9935 Da; putative annotation: N/A; putative formula: CH-1N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.036,"smiles":null,"spectrum_id":"CCMSLIB00017285065","spectrum_index":36339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1H-Indole-4-carboxaldehyde from NIST14 (delta mass: 14.0164 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.076,"smiles":null,"spectrum_id":"CCMSLIB00017285068","spectrum_index":36340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 93.9689 Da; putative annotation: N/A; putative formula: C4H-2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.049,"smiles":null,"spectrum_id":"CCMSLIB00017285071","spectrum_index":36341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptoline CollisionEnergy:102040 (delta mass: 238.231 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.338,"smiles":null,"spectrum_id":"CCMSLIB00017285072","spectrum_index":36342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 285.0617 Da; putative annotation: N/A; putative formula: C8H16NO8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.33,"smiles":null,"spectrum_id":"CCMSLIB00017285075","spectrum_index":36343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 92.0504 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.156,"smiles":null,"spectrum_id":"CCMSLIB00017285076","spectrum_index":36344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 57.0337 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.12,"smiles":null,"spectrum_id":"CCMSLIB00017285079","spectrum_index":36345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 83.0455 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017285082","spectrum_index":36346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 167.0942 Da; putative annotation: N/A; putative formula: C9H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.196,"smiles":null,"spectrum_id":"CCMSLIB00017285083","spectrum_index":36347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylimidazoleacetic acid; AIF; CE30; CorrDec (delta mass: 33.9878 Da; putative annotation: N/A; putative formula: C3H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.054,"smiles":null,"spectrum_id":"CCMSLIB00017285086","spectrum_index":36348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 67.0787 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.186,"smiles":null,"spectrum_id":"CCMSLIB00017285087","spectrum_index":36349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 91.0422 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.134,"smiles":null,"spectrum_id":"CCMSLIB00017285090","spectrum_index":36350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 166.0594 Da; putative annotation: N/A; putative formula: C4H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.15,"smiles":null,"spectrum_id":"CCMSLIB00017285093","spectrum_index":36351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 144.0208 Da; putative annotation: 4-Hydroxycoumarin; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.134,"smiles":null,"spectrum_id":"CCMSLIB00017285094","spectrum_index":36352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-((2E)-3-Phenylprop-2-enoyl)-.beta.-D-fructofuranosyl .alpha.-D-glucopyranoside (delta mass: 108.0213 Da; putative annotation: 1,3,5-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.187,"smiles":null,"spectrum_id":"CCMSLIB00017285097","spectrum_index":36353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 146.0384 Da; putative annotation: trans-p-Hydroxycinnamic acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.151,"smiles":null,"spectrum_id":"CCMSLIB00017285098","spectrum_index":36354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380224-01!1,7-bis(3,4-dihydroxyphenyl)-6-methoxyheptan-3-one (delta mass: 130.0417 Da; putative annotation: trans-Cinnamic acid; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.206,"smiles":null,"spectrum_id":"CCMSLIB00017285101","spectrum_index":36355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 143.0591 Da; putative annotation: 2-Aminoadipic acid; AIF; CE0; CorrDec; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.13,"smiles":null,"spectrum_id":"CCMSLIB00017285103","spectrum_index":36356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 136.0519 Da; putative annotation: (3,4-Dihydroxyphenyl)ethanol; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.101,"smiles":null,"spectrum_id":"CCMSLIB00017285105","spectrum_index":36357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Met-C8:0 (delta mass: 131.0398 Da; putative annotation: L-Methionine; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.203,"smiles":null,"spectrum_id":"CCMSLIB00017285108","spectrum_index":36358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 232.0757 Da; putative annotation: 2-(1,2-Dihydroxy-2-phenylethyl)-3-hydroxy-2,3-dihydropyran-6-one; putative formula: C13H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.136,"smiles":null,"spectrum_id":"CCMSLIB00017285111","spectrum_index":36359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 144.042 Da; putative annotation: 3-Hydroxy-3-methylglutarate; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.102,"smiles":null,"spectrum_id":"CCMSLIB00017285112","spectrum_index":36360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(prolyltyrosyl) (delta mass: 196.1248 Da; putative annotation: DETHIOBIOTIN; putative formula: C10H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.248,"smiles":null,"spectrum_id":"CCMSLIB00017285115","spectrum_index":36361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 294.0514 Da; putative annotation: 4-(3,4-Dihydroxyphenyl)-6,7-dihydroxy-2-naphthalenecarboxylic acid; putative formula: C17H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.112,"smiles":null,"spectrum_id":"CCMSLIB00017285118","spectrum_index":36362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 300.1736 Da; putative annotation: NCGC00347634-02!2,3-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,14,15,17-decahydro-1H-cyclopenta[a]phenanthrene-12,16-dione; putative formula: C19H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.244,"smiles":null,"spectrum_id":"CCMSLIB00017285120","spectrum_index":36363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 193.1913 Da; putative annotation: N/A; putative formula: C12H23N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.335,"smiles":null,"spectrum_id":"CCMSLIB00017285122","spectrum_index":36364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 161.1054 Da; putative annotation: N/A; putative formula: C7H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.16,"smiles":null,"spectrum_id":"CCMSLIB00017285125","spectrum_index":36365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 167.1392 Da; putative annotation: N/A; putative formula: C9H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.236,"smiles":null,"spectrum_id":"CCMSLIB00017285128","spectrum_index":36366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 102.0314 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.18,"smiles":null,"spectrum_id":"CCMSLIB00017285130","spectrum_index":36367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 206.0466 Da; putative annotation: N/A; putative formula: C13H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.186,"smiles":null,"spectrum_id":"CCMSLIB00017285132","spectrum_index":36368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Ethoxy-3-methyl-indole-2-carboxylic acid, ethyl ester (delta mass: 246.1096 Da; putative annotation: N/A; putative formula: C15H20O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.238,"smiles":null,"spectrum_id":"CCMSLIB00017285135","spectrum_index":36369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acaranoic acid (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017285138","spectrum_index":36370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 83.0743 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.171,"smiles":null,"spectrum_id":"CCMSLIB00017285139","spectrum_index":36371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,5-tetrahydro-1H-azepin[4,5-b]indole (delta mass: 13.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.164,"smiles":null,"spectrum_id":"CCMSLIB00017285142","spectrum_index":36372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 597.332 Da; putative annotation: N/A; putative formula: C28H43N11O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.403,"smiles":null,"spectrum_id":"CCMSLIB00017285145","spectrum_index":36373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine hydrochloride (delta mass: 77.0807 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.16,"smiles":null,"spectrum_id":"CCMSLIB00017285148","spectrum_index":36374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 89.0375 Da; putative annotation: N/A; putative formula: C5H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.088,"smiles":null,"spectrum_id":"CCMSLIB00017285149","spectrum_index":36375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 792.4299 Da; putative annotation: N/A; putative formula: C48H56N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":999.516,"smiles":null,"spectrum_id":"CCMSLIB00017285152","spectrum_index":36376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 749.4347 Da; putative annotation: N/A; putative formula: C53H55N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.505,"smiles":null,"spectrum_id":"CCMSLIB00017285155","spectrum_index":36377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 176.0693 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.15,"smiles":null,"spectrum_id":"CCMSLIB00017285158","spectrum_index":36378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 64.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.133,"smiles":null,"spectrum_id":"CCMSLIB00017285160","spectrum_index":36379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 136.0565 Da; putative annotation: N/A; putative formula: C7H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.19,"smiles":null,"spectrum_id":"CCMSLIB00017285163","spectrum_index":36380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 507.1585 Da; putative annotation: N/A; putative formula: C26H29N5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.255,"smiles":null,"spectrum_id":"CCMSLIB00017285166","spectrum_index":36381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 317.2941 Da; putative annotation: N/A; putative formula: C19H35N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.443,"smiles":null,"spectrum_id":"CCMSLIB00017285168","spectrum_index":36382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 178.0989 Da; putative annotation: N/A; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.133,"smiles":null,"spectrum_id":"CCMSLIB00017285171","spectrum_index":36383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 122.0735 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.186,"smiles":null,"spectrum_id":"CCMSLIB00017285174","spectrum_index":36384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 165.127 Da; putative annotation: N/A; putative formula: C9H15N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.204,"smiles":null,"spectrum_id":"CCMSLIB00017285177","spectrum_index":36385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 252.2816 Da; putative annotation: N/A; putative formula: C18H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.394,"smiles":null,"spectrum_id":"CCMSLIB00017285178","spectrum_index":36386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 943.3822 Da; putative annotation: N/A; putative formula: C44H53N11O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1106.44,"smiles":null,"spectrum_id":"CCMSLIB00017285181","spectrum_index":36387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 44.9884 Da; putative annotation: N/A; putative formula: H-1NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.08,"smiles":null,"spectrum_id":"CCMSLIB00017285184","spectrum_index":36388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 368.2059 Da; putative annotation: N/A; putative formula: C17H28N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.303,"smiles":null,"spectrum_id":"CCMSLIB00017285185","spectrum_index":36389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Methyl-1-piperazinyl)butanoic acid (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.139,"smiles":null,"spectrum_id":"CCMSLIB00017285188","spectrum_index":36390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 210.6292 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.716,"smiles":null,"spectrum_id":"CCMSLIB00017285191","spectrum_index":36391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 56.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.147,"smiles":null,"spectrum_id":"CCMSLIB00017285194","spectrum_index":36392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074902 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 102.0818 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.163,"smiles":null,"spectrum_id":"CCMSLIB00017285197","spectrum_index":36393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 82.0418 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017285198","spectrum_index":36394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 38.0042 Da; putative annotation: N/A; putative formula: H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.076,"smiles":null,"spectrum_id":"CCMSLIB00017285201","spectrum_index":36395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 136.1617 Da; putative annotation: N/A; putative formula: C11H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.259,"smiles":null,"spectrum_id":"CCMSLIB00017285204","spectrum_index":36396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 410.2818 Da; putative annotation: N/A; putative formula: C27H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":753.405,"smiles":null,"spectrum_id":"CCMSLIB00017285206","spectrum_index":36397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin [M+H-H2O]+; AIF; CE30; CorrDec (delta mass: 68.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.127,"smiles":null,"spectrum_id":"CCMSLIB00017285208","spectrum_index":36398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 161.181 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.471,"smiles":null,"spectrum_id":"CCMSLIB00017285211","spectrum_index":36399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 114.0418 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.191,"smiles":null,"spectrum_id":"CCMSLIB00017285214","spectrum_index":36400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380423-01!2-(hydroxymethyl)-5-(2-oxopropyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one (delta mass: 410.1272 Da; putative annotation: N/A; putative formula: C18H18N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":821.256,"smiles":null,"spectrum_id":"CCMSLIB00017285216","spectrum_index":36401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 56.0469 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.201,"smiles":null,"spectrum_id":"CCMSLIB00017285219","spectrum_index":36402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 117.0926 Da; putative annotation: N/A; putative formula: C9H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.184,"smiles":null,"spectrum_id":"CCMSLIB00017285221","spectrum_index":36403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 147.0326 Da; putative annotation: N/A; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.119,"smiles":null,"spectrum_id":"CCMSLIB00017285224","spectrum_index":36404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 82.9998 Da; putative annotation: N/A; putative formula: C3HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.081,"smiles":null,"spectrum_id":"CCMSLIB00017285226","spectrum_index":36405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 64.0423 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.118,"smiles":null,"spectrum_id":"CCMSLIB00017285228","spectrum_index":36406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 103.0686 Da; putative annotation: N/A; putative formula: C3H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.264,"smiles":null,"spectrum_id":"CCMSLIB00017285231","spectrum_index":36407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 78.0319 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.191,"smiles":null,"spectrum_id":"CCMSLIB00017285234","spectrum_index":36408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxylic acid (delta mass: 34.0761 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.131,"smiles":null,"spectrum_id":"CCMSLIB00017285235","spectrum_index":36409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 510.116 Da; putative annotation: N/A; putative formula: C21H27N4O5PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.155,"smiles":null,"spectrum_id":"CCMSLIB00017285238","spectrum_index":36410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 59.0589 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.192,"smiles":null,"spectrum_id":"CCMSLIB00017285241","spectrum_index":36411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4,6-dimethylpyrimidine (delta mass: 65.0379 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.109,"smiles":null,"spectrum_id":"CCMSLIB00017285243","spectrum_index":36412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 52.0227 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.1,"smiles":null,"spectrum_id":"CCMSLIB00017285245","spectrum_index":36413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 602.542 Da; putative annotation: N/A; putative formula: C43H70O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.613,"smiles":null,"spectrum_id":"CCMSLIB00017285248","spectrum_index":36414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 31.97 Da; putative annotation: N/A; putative formula: S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.119,"smiles":null,"spectrum_id":"CCMSLIB00017285249","spectrum_index":36415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 26.0436 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.086,"smiles":null,"spectrum_id":"CCMSLIB00017285252","spectrum_index":36416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-Thr (delta mass: 101.0519 Da; putative annotation: N/A; putative formula: C3H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.155,"smiles":null,"spectrum_id":"CCMSLIB00017285255","spectrum_index":36417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 55.0186 Da; putative annotation: N/A; putative formula: CHN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.094,"smiles":null,"spectrum_id":"CCMSLIB00017285256","spectrum_index":36418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 42.0478 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.176,"smiles":null,"spectrum_id":"CCMSLIB00017285259","spectrum_index":36419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 120.0227 Da; putative annotation: N/A; putative formula: C6H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.098,"smiles":null,"spectrum_id":"CCMSLIB00017285262","spectrum_index":36420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 141.0119 Da; putative annotation: N/A; putative formula: C3H3N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.14,"smiles":null,"spectrum_id":"CCMSLIB00017285263","spectrum_index":36421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 590.4336 Da; putative annotation: N/A; putative formula: C39H58O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":933.557,"smiles":null,"spectrum_id":"CCMSLIB00017285266","spectrum_index":36422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 146.1104 Da; putative annotation: N/A; putative formula: C11H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.535,"smiles":null,"spectrum_id":"CCMSLIB00017285267","spectrum_index":36423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 313.1775 Da; putative annotation: N/A; putative formula: C14H19N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.331,"smiles":null,"spectrum_id":"CCMSLIB00017285270","spectrum_index":36424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 24.9842 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.086,"smiles":null,"spectrum_id":"CCMSLIB00017285273","spectrum_index":36425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 76.0169 Da; putative annotation: N/A; putative formula: C3N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.094,"smiles":null,"spectrum_id":"CCMSLIB00017285274","spectrum_index":36426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCURONOLACTONE (delta mass: 96.0252 Da; putative annotation: N/A; putative formula: C4H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.075,"smiles":null,"spectrum_id":"CCMSLIB00017285277","spectrum_index":36427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 86.0524 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.342,"smiles":null,"spectrum_id":"CCMSLIB00017285280","spectrum_index":36428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 96.0375 Da; putative annotation: N/A; putative formula: C9H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.171,"smiles":null,"spectrum_id":"CCMSLIB00017285281","spectrum_index":36429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 145.1103 Da; putative annotation: N/A; putative formula: C7H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.217,"smiles":null,"spectrum_id":"CCMSLIB00017285284","spectrum_index":36430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-2-ol (delta mass: 117.0612 Da; putative annotation: N/A; putative formula: C5H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.121,"smiles":null,"spectrum_id":"CCMSLIB00017285285","spectrum_index":36431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 273.1939 Da; putative annotation: N/A; putative formula: C14H27NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.416,"smiles":null,"spectrum_id":"CCMSLIB00017285288","spectrum_index":36432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 325.335 Da; putative annotation: N/A; putative formula: C21H43NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.484,"smiles":null,"spectrum_id":"CCMSLIB00017285291","spectrum_index":36433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 90.0459 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.2,"smiles":null,"spectrum_id":"CCMSLIB00017285292","spectrum_index":36434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydro-10-phenophosphazinol 10-oxide (delta mass: 74.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.116,"smiles":null,"spectrum_id":"CCMSLIB00017285295","spectrum_index":36435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 95.0647 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.087,"smiles":null,"spectrum_id":"CCMSLIB00017285298","spectrum_index":36436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 277.4755 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.751,"smiles":null,"spectrum_id":"CCMSLIB00017285299","spectrum_index":36437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neferine (delta mass: 17.9487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.276,"smiles":null,"spectrum_id":"CCMSLIB00017285302","spectrum_index":36438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 42.0658 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.225,"smiles":null,"spectrum_id":"CCMSLIB00017285303","spectrum_index":36439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 210.1367 Da; putative annotation: N/A; putative formula: C11H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.27,"smiles":null,"spectrum_id":"CCMSLIB00017285306","spectrum_index":36440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 70.0437 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.114,"smiles":null,"spectrum_id":"CCMSLIB00017285309","spectrum_index":36441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 31.0146 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.09,"smiles":null,"spectrum_id":"CCMSLIB00017285310","spectrum_index":36442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 116.0629 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017285313","spectrum_index":36443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 50.0158 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.076,"smiles":null,"spectrum_id":"CCMSLIB00017285316","spectrum_index":36444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100301 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole (delta mass: 36.0549 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.103,"smiles":null,"spectrum_id":"CCMSLIB00017285317","spectrum_index":36445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 619.335 Da; putative annotation: N/A; putative formula: C46H41N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":947.562,"smiles":null,"spectrum_id":"CCMSLIB00017285320","spectrum_index":36446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 80.0622 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.352,"smiles":null,"spectrum_id":"CCMSLIB00017285323","spectrum_index":36447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 17.0597 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.12,"smiles":null,"spectrum_id":"CCMSLIB00017285326","spectrum_index":36448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 16.9933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.08,"smiles":null,"spectrum_id":"CCMSLIB00017285329","spectrum_index":36449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 12.0554 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.131,"smiles":null,"spectrum_id":"CCMSLIB00017285330","spectrum_index":36450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 159.1018 Da; putative annotation: N/A; putative formula: C6H13N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.188,"smiles":null,"spectrum_id":"CCMSLIB00017285333","spectrum_index":36451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 17.2177 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.19,"smiles":null,"spectrum_id":"CCMSLIB00017285336","spectrum_index":36452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 158.0744 Da; putative annotation: N/A; putative formula: C4H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.14,"smiles":null,"spectrum_id":"CCMSLIB00017285338","spectrum_index":36453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 28.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.138,"smiles":null,"spectrum_id":"CCMSLIB00017285340","spectrum_index":36454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017285344","spectrum_index":36455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 401.2774 Da; putative annotation: N/A; putative formula: C21H39NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.348,"smiles":null,"spectrum_id":"CCMSLIB00017285346","spectrum_index":36456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 140.1091 Da; putative annotation: N/A; putative formula: C9H17O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.201,"smiles":null,"spectrum_id":"CCMSLIB00017285349","spectrum_index":36457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 164.0321 Da; putative annotation: N/A; putative formula: C5H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.103,"smiles":null,"spectrum_id":"CCMSLIB00017285351","spectrum_index":36458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-Hydroxy-4,6-dimethoxyacetophenone\"\" (delta mass: 158.0905 Da; putative annotation: N/A; putative formula: C4H10N6O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.171,"smiles":null,"spectrum_id":"CCMSLIB00017285354","spectrum_index":36459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 342.0951 Da; putative annotation: N/A; putative formula: C15H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.271,"smiles":null,"spectrum_id":"CCMSLIB00017285356","spectrum_index":36460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 87.0655 Da; putative annotation: N/A; putative formula: H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.152,"smiles":null,"spectrum_id":"CCMSLIB00017285360","spectrum_index":36461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 366.209 Da; putative annotation: N/A; putative formula: C18H30N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.333,"smiles":null,"spectrum_id":"CCMSLIB00017285363","spectrum_index":36462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 59.0366 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.29,"smiles":null,"spectrum_id":"CCMSLIB00017285365","spectrum_index":36463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-1,2-benzenediol (delta mass: 264.2442 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.299,"smiles":null,"spectrum_id":"CCMSLIB00017285368","spectrum_index":36464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ramosetron (delta mass: 159.0498 Da; putative annotation: N/A; putative formula: C2H5N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.194,"smiles":null,"spectrum_id":"CCMSLIB00017285371","spectrum_index":36465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 765.2949 Da; putative annotation: N/A; putative formula: C48H39N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.366,"smiles":null,"spectrum_id":"CCMSLIB00017285373","spectrum_index":36466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 263.2112 Da; putative annotation: N/A; putative formula: C14H25N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.36,"smiles":null,"spectrum_id":"CCMSLIB00017285375","spectrum_index":36467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 384.2886 Da; putative annotation: N/A; putative formula: C23H44S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.38,"smiles":null,"spectrum_id":"CCMSLIB00017285378","spectrum_index":36468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 147.162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.223,"smiles":null,"spectrum_id":"CCMSLIB00017285381","spectrum_index":36469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 65.1205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.254,"smiles":null,"spectrum_id":"CCMSLIB00017285382","spectrum_index":36470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 182.0757 Da; putative annotation: N/A; putative formula: C2H10N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.157,"smiles":null,"spectrum_id":"CCMSLIB00017285385","spectrum_index":36471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 652.9447 Da; putative annotation: N/A; putative formula: C18H27N3O5S9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.0,"smiles":null,"spectrum_id":"CCMSLIB00017285388","spectrum_index":36472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101903 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 41.0263 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.113,"smiles":null,"spectrum_id":"CCMSLIB00017285391","spectrum_index":36473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 81.0784 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.206,"smiles":null,"spectrum_id":"CCMSLIB00017285392","spectrum_index":36474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alosetron??monohydrochloride (delta mass: 81.0163 Da; putative annotation: N/A; putative formula: H-1N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.172,"smiles":null,"spectrum_id":"CCMSLIB00017285395","spectrum_index":36475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 124.1462 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.254,"smiles":null,"spectrum_id":"CCMSLIB00017285398","spectrum_index":36476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methyl indole CollisionEnergy:102040 (delta mass: 42.0461 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.127,"smiles":null,"spectrum_id":"CCMSLIB00017285399","spectrum_index":36477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 229.0788 Da; putative annotation: N/A; putative formula: C11H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.138,"smiles":null,"spectrum_id":"CCMSLIB00017285402","spectrum_index":36478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 170.0732 Da; putative annotation: N/A; putative formula: C12H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.139,"smiles":null,"spectrum_id":"CCMSLIB00017285405","spectrum_index":36479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 64.0173 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.13,"smiles":null,"spectrum_id":"CCMSLIB00017285408","spectrum_index":36480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 159.0834 Da; putative annotation: N/A; putative formula: C6H13N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.149,"smiles":null,"spectrum_id":"CCMSLIB00017285410","spectrum_index":36481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-8-methoxy-5H-pyrimido[5,4-b]indole (delta mass: 32.0713 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.114,"smiles":null,"spectrum_id":"CCMSLIB00017285412","spectrum_index":36482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 240.1209 Da; putative annotation: N/A; putative formula: C12H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.16,"smiles":null,"spectrum_id":"CCMSLIB00017285415","spectrum_index":36483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 513.1723 Da; putative annotation: N/A; putative formula: C18H32N3O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.243,"smiles":null,"spectrum_id":"CCMSLIB00017285417","spectrum_index":36484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 537.1483 Da; putative annotation: N/A; putative formula: C24H27NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.208,"smiles":null,"spectrum_id":"CCMSLIB00017285420","spectrum_index":36485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 366.1273 Da; putative annotation: N/A; putative formula: C13H22N2O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.255,"smiles":null,"spectrum_id":"CCMSLIB00017285422","spectrum_index":36486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Piperidin-2-yl)-1H-indole (delta mass: 12.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.164,"smiles":null,"spectrum_id":"CCMSLIB00017285425","spectrum_index":36487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 230.0431 Da; putative annotation: N/A; putative formula: C12H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.192,"smiles":null,"spectrum_id":"CCMSLIB00017285428","spectrum_index":36488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.076,"smiles":null,"spectrum_id":"CCMSLIB00017285430","spectrum_index":36489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gramine (delta mass: 129.0516 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.175,"smiles":null,"spectrum_id":"CCMSLIB00017285433","spectrum_index":36490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 472.4369 Da; putative annotation: N/A; putative formula: C27H52N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.56,"smiles":null,"spectrum_id":"CCMSLIB00017285435","spectrum_index":36491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 987.7255 Da; putative annotation: N/A; putative formula: C60H97N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1371.88,"smiles":null,"spectrum_id":"CCMSLIB00017285437","spectrum_index":36492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Lys from NIST14 (delta mass: 241.1798 Da; putative annotation: N/A; putative formula: C12H23N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.377,"smiles":null,"spectrum_id":"CCMSLIB00017285440","spectrum_index":36493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 109.0379 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.15,"smiles":null,"spectrum_id":"CCMSLIB00017285443","spectrum_index":36494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 116.097 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.35,"smiles":null,"spectrum_id":"CCMSLIB00017285444","spectrum_index":36495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 36.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017285447","spectrum_index":36496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 90.0469 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.133,"smiles":null,"spectrum_id":"CCMSLIB00017285449","spectrum_index":36497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 307.204 Da; putative annotation: N/A; putative formula: C20H25N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.384,"smiles":null,"spectrum_id":"CCMSLIB00017285452","spectrum_index":36498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 56.0254 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017285455","spectrum_index":36499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 659.2785 Da; putative annotation: N/A; putative formula: C43H37N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.339,"smiles":null,"spectrum_id":"CCMSLIB00017285457","spectrum_index":36500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 36.0151 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.144,"smiles":null,"spectrum_id":"CCMSLIB00017285460","spectrum_index":36501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 17.002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.146,"smiles":null,"spectrum_id":"CCMSLIB00017285463","spectrum_index":36502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 124.1324 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.235,"smiles":null,"spectrum_id":"CCMSLIB00017285465","spectrum_index":36503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 130.1806 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.277,"smiles":null,"spectrum_id":"CCMSLIB00017285467","spectrum_index":36504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 265.1791 Da; putative annotation: N/A; putative formula: C14H23N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.265,"smiles":null,"spectrum_id":"CCMSLIB00017285470","spectrum_index":36505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 31.0506 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.127,"smiles":null,"spectrum_id":"CCMSLIB00017285472","spectrum_index":36506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.118,"smiles":null,"spectrum_id":"CCMSLIB00017285475","spectrum_index":36507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HarmalolHCl2H2O///harmalol///Harmalol CollisionEnergy:205060 (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.108,"smiles":null,"spectrum_id":"CCMSLIB00017285478","spectrum_index":36508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371603 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 52.0334 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.104,"smiles":null,"spectrum_id":"CCMSLIB00017285480","spectrum_index":36509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-pentyl- (delta mass: 109.0899 Da; putative annotation: N/A; putative formula: C7H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.223,"smiles":null,"spectrum_id":"CCMSLIB00017285483","spectrum_index":36510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 138.1035 Da; putative annotation: N/A; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.2,"smiles":null,"spectrum_id":"CCMSLIB00017285486","spectrum_index":36511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 112.933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.056,"smiles":null,"spectrum_id":"CCMSLIB00017285488","spectrum_index":36512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacetonitrile (delta mass: 193.0687 Da; putative annotation: N/A; putative formula: C2H3N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.145,"smiles":null,"spectrum_id":"CCMSLIB00017285490","spectrum_index":36513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 274.1927 Da; putative annotation: N/A; putative formula: C12H27N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.341,"smiles":null,"spectrum_id":"CCMSLIB00017285493","spectrum_index":36514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 194.1149 Da; putative annotation: N/A; putative formula: C5H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.201,"smiles":null,"spectrum_id":"CCMSLIB00017285496","spectrum_index":36515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 224.2518 Da; putative annotation: N/A; putative formula: C16H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.338,"smiles":null,"spectrum_id":"CCMSLIB00017285498","spectrum_index":36516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 471.2678 Da; putative annotation: N/A; putative formula: C20H41NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.416,"smiles":null,"spectrum_id":"CCMSLIB00017285501","spectrum_index":36517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 348.1413 Da; putative annotation: N/A; putative formula: C20H20N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.29,"smiles":null,"spectrum_id":"CCMSLIB00017285503","spectrum_index":36518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 64.0155 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.154,"smiles":null,"spectrum_id":"CCMSLIB00017285506","spectrum_index":36519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 141.1241 Da; putative annotation: N/A; putative formula: C7H15N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.21,"smiles":null,"spectrum_id":"CCMSLIB00017285508","spectrum_index":36520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 44.0271 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.176,"smiles":null,"spectrum_id":"CCMSLIB00017285510","spectrum_index":36521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 283.0539 Da; putative annotation: N/A; putative formula: C13H9N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.13,"smiles":null,"spectrum_id":"CCMSLIB00017285513","spectrum_index":36522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 77.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.269,"smiles":null,"spectrum_id":"CCMSLIB00017285514","spectrum_index":36523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 45.0283 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.109,"smiles":null,"spectrum_id":"CCMSLIB00017285517","spectrum_index":36524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA000903 PHIP|1-methyl-6-phenylimidazo[4,5-b]pyridin-2-amine (delta mass: 36.02 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.134,"smiles":null,"spectrum_id":"CCMSLIB00017285520","spectrum_index":36525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7,8a-dihydroxy-1-methoxy-7-methyl-1H-isochromene-6,8-dione (delta mass: 62.0529 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.194,"smiles":null,"spectrum_id":"CCMSLIB00017285523","spectrum_index":36526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 461.1532 Da; putative annotation: N/A; putative formula: C19H27NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.218,"smiles":null,"spectrum_id":"CCMSLIB00017285526","spectrum_index":36527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 181.1106 Da; putative annotation: N/A; putative formula: C10H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.228,"smiles":null,"spectrum_id":"CCMSLIB00017285529","spectrum_index":36528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 230.094 Da; putative annotation: N/A; putative formula: C14H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017285531","spectrum_index":36529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 24.9501 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.057,"smiles":null,"spectrum_id":"CCMSLIB00017285533","spectrum_index":36530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 485.3553 Da; putative annotation: N/A; putative formula: C28H47N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.394,"smiles":null,"spectrum_id":"CCMSLIB00017285536","spectrum_index":36531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 240.1036 Da; putative annotation: N/A; putative formula: C11H17N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.199,"smiles":null,"spectrum_id":"CCMSLIB00017285539","spectrum_index":36532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 89.0465 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.127,"smiles":null,"spectrum_id":"CCMSLIB00017285540","spectrum_index":36533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN - 40.0 eV (delta mass: 100.4046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.5,"smiles":null,"spectrum_id":"CCMSLIB00017285543","spectrum_index":36534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 287.1013 Da; putative annotation: N/A; putative formula: C13H21NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.172,"smiles":null,"spectrum_id":"CCMSLIB00017285546","spectrum_index":36535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 120.032 Da; putative annotation: 4-Imidazoleacrylic acid; putative formula: C6H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.181,"smiles":null,"spectrum_id":"CCMSLIB00017285549","spectrum_index":36536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 113.0845 Da; putative annotation: Massbank:PB000396 Isoleucine|2-amino-3-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.255,"smiles":null,"spectrum_id":"CCMSLIB00017285550","spectrum_index":36537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 128.0585 Da; putative annotation: L-Glutamine; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.134,"smiles":null,"spectrum_id":"CCMSLIB00017285553","spectrum_index":36538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 166.1113 Da; putative annotation: Cyclo(alanylisoleucyl); putative formula: C9H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.198,"smiles":null,"spectrum_id":"CCMSLIB00017285556","spectrum_index":36539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 374.2312 Da; putative annotation: 13,14-Dihydro-16,16-difluoroprostaglandin E1; putative formula: C20H32F2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.302,"smiles":null,"spectrum_id":"CCMSLIB00017285559","spectrum_index":36540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 111.018 Da; putative annotation: N/A; putative formula: C2HN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.083,"smiles":null,"spectrum_id":"CCMSLIB00017285560","spectrum_index":36541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 29.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017285563","spectrum_index":36542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 73.053 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.14,"smiles":null,"spectrum_id":"CCMSLIB00017285566","spectrum_index":36543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.133,"smiles":null,"spectrum_id":"CCMSLIB00017285567","spectrum_index":36544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 238.1211 Da; putative annotation: N/A; putative formula: C6H18N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.218,"smiles":null,"spectrum_id":"CCMSLIB00017285570","spectrum_index":36545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidacloprid-guanidine (delta mass: 14.0128 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.087,"smiles":null,"spectrum_id":"CCMSLIB00017285573","spectrum_index":36546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 223.1275 Da; putative annotation: N/A; putative formula: C6H17N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.281,"smiles":null,"spectrum_id":"CCMSLIB00017285575","spectrum_index":36547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 142.9874 Da; putative annotation: N/A; putative formula: C3H2N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.121,"smiles":null,"spectrum_id":"CCMSLIB00017285577","spectrum_index":36548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic Acid CollisionEnergy:102040 (delta mass: 17.0879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.201,"smiles":null,"spectrum_id":"CCMSLIB00017285580","spectrum_index":36549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 300.1088 Da; putative annotation: N/A; putative formula: C9H21N2O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.211,"smiles":null,"spectrum_id":"CCMSLIB00017285581","spectrum_index":36550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin///(-)-citrinin CollisionEnergy:205060 (delta mass: 23.1099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.201,"smiles":null,"spectrum_id":"CCMSLIB00017285584","spectrum_index":36551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 142.0262 Da; putative annotation: N/A; putative formula: C6H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.154,"smiles":null,"spectrum_id":"CCMSLIB00017285587","spectrum_index":36552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 119.0733 Da; putative annotation: N/A; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.197,"smiles":null,"spectrum_id":"CCMSLIB00017285590","spectrum_index":36553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 17.0513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.195,"smiles":null,"spectrum_id":"CCMSLIB00017285591","spectrum_index":36554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 690.3979 Da; putative annotation: N/A; putative formula: C38H58O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.484,"smiles":null,"spectrum_id":"CCMSLIB00017285594","spectrum_index":36555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 696.2409 Da; putative annotation: N/A; putative formula: C42H48O-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":893.322,"smiles":null,"spectrum_id":"CCMSLIB00017285597","spectrum_index":36556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Buten-1-ol (delta mass: 29.0265 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":102.091,"smiles":null,"spectrum_id":"CCMSLIB00017285599","spectrum_index":36557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 192.1153 Da; putative annotation: N/A; putative formula: C12H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.186,"smiles":null,"spectrum_id":"CCMSLIB00017285602","spectrum_index":36558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 137.1444 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.242,"smiles":null,"spectrum_id":"CCMSLIB00017285604","spectrum_index":36559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 140.35 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.5,"smiles":null,"spectrum_id":"CCMSLIB00017285607","spectrum_index":36560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 428.2564 Da; putative annotation: N/A; putative formula: C26H36O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.327,"smiles":null,"spectrum_id":"CCMSLIB00017285609","spectrum_index":36561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 468.148 Da; putative annotation: N/A; putative formula: C24H20N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.219,"smiles":null,"spectrum_id":"CCMSLIB00017285612","spectrum_index":36562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 116.0624 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017285613","spectrum_index":36563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 409.4286 Da; putative annotation: N/A; putative formula: C27H55NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.504,"smiles":null,"spectrum_id":"CCMSLIB00017285616","spectrum_index":36564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 209.0689 Da; putative annotation: N/A; putative formula: C10H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.208,"smiles":null,"spectrum_id":"CCMSLIB00017285619","spectrum_index":36565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,7,8-trimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 104.0587 Da; putative annotation: N/A; putative formula: C3H8N2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.166,"smiles":null,"spectrum_id":"CCMSLIB00017285620","spectrum_index":36566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.129,"smiles":null,"spectrum_id":"CCMSLIB00017285623","spectrum_index":36567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 18.982 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.094,"smiles":null,"spectrum_id":"CCMSLIB00017285624","spectrum_index":36568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 96.8804 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.009,"smiles":null,"spectrum_id":"CCMSLIB00017285627","spectrum_index":36569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 53.093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.205,"smiles":null,"spectrum_id":"CCMSLIB00017285630","spectrum_index":36570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 266.6488 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.735,"smiles":null,"spectrum_id":"CCMSLIB00017285631","spectrum_index":36571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 61.9945 Da; putative annotation: N/A; putative formula: H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017285634","spectrum_index":36572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-Hydroxy-4,6-dimethoxyacetophenone\"\" (delta mass: 193.2405 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.321,"smiles":null,"spectrum_id":"CCMSLIB00017285635","spectrum_index":36573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 64.0191 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.153,"smiles":null,"spectrum_id":"CCMSLIB00017285638","spectrum_index":36574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ305901 Imidacloprid-guanidine|Desnitro-imidacloprid|1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-1H-imidazol-2-amine (delta mass: 66.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.102,"smiles":null,"spectrum_id":"CCMSLIB00017285641","spectrum_index":36575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380192-01! (delta mass: 482.241 Da; putative annotation: N/A; putative formula: C29H39O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1024.48,"smiles":null,"spectrum_id":"CCMSLIB00017285642","spectrum_index":36576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 39.9947 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.133,"smiles":null,"spectrum_id":"CCMSLIB00017285645","spectrum_index":36577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 91.0418 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.165,"smiles":null,"spectrum_id":"CCMSLIB00017285648","spectrum_index":36578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 159.0509 Da; putative annotation: N/A; putative formula: C10H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.122,"smiles":null,"spectrum_id":"CCMSLIB00017285649","spectrum_index":36579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 16.0174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.093,"smiles":null,"spectrum_id":"CCMSLIB00017285652","spectrum_index":36580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dimethyl-1H-benzimidazole-2-thiol (delta mass: 418.1445 Da; putative annotation: N/A; putative formula: C24H23N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.208,"smiles":null,"spectrum_id":"CCMSLIB00017285655","spectrum_index":36581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 432.0985 Da; putative annotation: N/A; putative formula: C22H25O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.173,"smiles":null,"spectrum_id":"CCMSLIB00017285656","spectrum_index":36582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mannitol (delta mass: 242.1311 Da; putative annotation: N/A; putative formula: C9H18N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.217,"smiles":null,"spectrum_id":"CCMSLIB00017285659","spectrum_index":36583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 307.278 Da; putative annotation: N/A; putative formula: C20H38NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.38,"smiles":null,"spectrum_id":"CCMSLIB00017285662","spectrum_index":36584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 340.1368 Da; putative annotation: N/A; putative formula: C13H24O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.244,"smiles":null,"spectrum_id":"CCMSLIB00017285663","spectrum_index":36585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 82.008 Da; putative annotation: N/A; putative formula: C3H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.08,"smiles":null,"spectrum_id":"CCMSLIB00017285666","spectrum_index":36586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 598.3498 Da; putative annotation: N/A; putative formula: C29H51N4O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.41,"smiles":null,"spectrum_id":"CCMSLIB00017285669","spectrum_index":36587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 205.0983 Da; putative annotation: N/A; putative formula: C7H16N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.138,"smiles":null,"spectrum_id":"CCMSLIB00017285670","spectrum_index":36588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 354.9539 Da; putative annotation: N/A; putative formula: C6H7N5O7P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.014,"smiles":null,"spectrum_id":"CCMSLIB00017285673","spectrum_index":36589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 15.0112 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.082,"smiles":null,"spectrum_id":"CCMSLIB00017285676","spectrum_index":36590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 73.0216 Da; putative annotation: N/A; putative formula: CH4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.217,"smiles":null,"spectrum_id":"CCMSLIB00017285677","spectrum_index":36591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 163.1 Da; putative annotation: N/A; putative formula: C10H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.15,"smiles":null,"spectrum_id":"CCMSLIB00017285680","spectrum_index":36592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 740.238 Da; putative annotation: N/A; putative formula: C33H45N2O13PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1083.36,"smiles":null,"spectrum_id":"CCMSLIB00017285683","spectrum_index":36593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 929.7026 Da; putative annotation: N/A; putative formula: C46H87N15O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1118.85,"smiles":null,"spectrum_id":"CCMSLIB00017285684","spectrum_index":36594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 186.1243 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.169,"smiles":null,"spectrum_id":"CCMSLIB00017285687","spectrum_index":36595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 9.0074 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.13,"smiles":null,"spectrum_id":"CCMSLIB00017285690","spectrum_index":36596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 82.0765 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.2,"smiles":null,"spectrum_id":"CCMSLIB00017285691","spectrum_index":36597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 149.1215 Da; putative annotation: N/A; putative formula: C10H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.27,"smiles":null,"spectrum_id":"CCMSLIB00017285694","spectrum_index":36598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 148.0673 Da; putative annotation: N/A; putative formula: C5H12N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.138,"smiles":null,"spectrum_id":"CCMSLIB00017285695","spectrum_index":36599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 116.0834 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.147,"smiles":null,"spectrum_id":"CCMSLIB00017285698","spectrum_index":36600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017285701","spectrum_index":36601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 245.1365 Da; putative annotation: N/A; putative formula: C12H24NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.241,"smiles":null,"spectrum_id":"CCMSLIB00017285702","spectrum_index":36602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 229.0799 Da; putative annotation: N/A; putative formula: C9H16N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.119,"smiles":null,"spectrum_id":"CCMSLIB00017285705","spectrum_index":36603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTOPHAN ETHYL ESTER (delta mass: 113.0867 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.215,"smiles":null,"spectrum_id":"CCMSLIB00017285706","spectrum_index":36604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lofemizole (delta mass: 97.0492 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.102,"smiles":null,"spectrum_id":"CCMSLIB00017285709","spectrum_index":36605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 118.0418 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.139,"smiles":null,"spectrum_id":"CCMSLIB00017285712","spectrum_index":36606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 60.0181 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.156,"smiles":null,"spectrum_id":"CCMSLIB00017285713","spectrum_index":36607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 55.9901 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.07,"smiles":null,"spectrum_id":"CCMSLIB00017285716","spectrum_index":36608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 152.1202 Da; putative annotation: N/A; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.201,"smiles":null,"spectrum_id":"CCMSLIB00017285717","spectrum_index":36609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 28.0064 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.124,"smiles":null,"spectrum_id":"CCMSLIB00017285720","spectrum_index":36610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 154.1244 Da; putative annotation: N/A; putative formula: C7H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.22,"smiles":null,"spectrum_id":"CCMSLIB00017285723","spectrum_index":36611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norharmane (delta mass: 28.0837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.16,"smiles":null,"spectrum_id":"CCMSLIB00017285724","spectrum_index":36612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002982 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 300.0843 Da; putative annotation: N/A; putative formula: C8H21N4O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.123,"smiles":null,"spectrum_id":"CCMSLIB00017285727","spectrum_index":36613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 63.9982 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.147,"smiles":null,"spectrum_id":"CCMSLIB00017285728","spectrum_index":36614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 51.0474 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.134,"smiles":null,"spectrum_id":"CCMSLIB00017285731","spectrum_index":36615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 80.0671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.206,"smiles":null,"spectrum_id":"CCMSLIB00017285734","spectrum_index":36616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 249.6737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.797,"smiles":null,"spectrum_id":"CCMSLIB00017285737","spectrum_index":36617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-pyruvic acid (delta mass: 14.0165 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.082,"smiles":null,"spectrum_id":"CCMSLIB00017285738","spectrum_index":36618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 41.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.102,"smiles":null,"spectrum_id":"CCMSLIB00017285741","spectrum_index":36619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 6.396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.5,"smiles":null,"spectrum_id":"CCMSLIB00017285744","spectrum_index":36620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 233.0845 Da; putative annotation: N/A; putative formula: C9H11N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.171,"smiles":null,"spectrum_id":"CCMSLIB00017285747","spectrum_index":36621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE (delta mass: 111.0318 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.119,"smiles":null,"spectrum_id":"CCMSLIB00017285750","spectrum_index":36622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 49.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.141,"smiles":null,"spectrum_id":"CCMSLIB00017285751","spectrum_index":36623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 172.0733 Da; putative annotation: N/A; putative formula: C8H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.222,"smiles":null,"spectrum_id":"CCMSLIB00017285754","spectrum_index":36624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 354.256 Da; putative annotation: N/A; putative formula: C24H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.321,"smiles":null,"spectrum_id":"CCMSLIB00017285757","spectrum_index":36625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 64.0156 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.086,"smiles":null,"spectrum_id":"CCMSLIB00017285760","spectrum_index":36626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 254.1622 Da; putative annotation: N/A; putative formula: C15H27O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.249,"smiles":null,"spectrum_id":"CCMSLIB00017285761","spectrum_index":36627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 320.1838 Da; putative annotation: N/A; putative formula: C18H29N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.26,"smiles":null,"spectrum_id":"CCMSLIB00017285764","spectrum_index":36628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 204.1503 Da; putative annotation: N/A; putative formula: C8H21N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.231,"smiles":null,"spectrum_id":"CCMSLIB00017285767","spectrum_index":36629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 197.0726 Da; putative annotation: N/A; putative formula: C8H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.172,"smiles":null,"spectrum_id":"CCMSLIB00017285770","spectrum_index":36630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 8.0722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.163,"smiles":null,"spectrum_id":"CCMSLIB00017285771","spectrum_index":36631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Methoxycarbonyl)but-3-enoic acid (delta mass: 102.0317 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.081,"smiles":null,"spectrum_id":"CCMSLIB00017285774","spectrum_index":36632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 129.0429 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.14,"smiles":null,"spectrum_id":"CCMSLIB00017285777","spectrum_index":36633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 112.049 Da; putative annotation: N/A; putative formula: C2H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.193,"smiles":null,"spectrum_id":"CCMSLIB00017285780","spectrum_index":36634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 475.2634 Da; putative annotation: N/A; putative formula: C22H42N3O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.334,"smiles":null,"spectrum_id":"CCMSLIB00017285783","spectrum_index":36635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 287.1583 Da; putative annotation: N/A; putative formula: C13H26N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.229,"smiles":null,"spectrum_id":"CCMSLIB00017285784","spectrum_index":36636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 57.0696 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.15,"smiles":null,"spectrum_id":"CCMSLIB00017285787","spectrum_index":36637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 119.1672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.217,"smiles":null,"spectrum_id":"CCMSLIB00017285790","spectrum_index":36638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 231.1837 Da; putative annotation: N/A; putative formula: C12H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.332,"smiles":null,"spectrum_id":"CCMSLIB00017285793","spectrum_index":36639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017285796","spectrum_index":36640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 118.0419 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.107,"smiles":null,"spectrum_id":"CCMSLIB00017285797","spectrum_index":36641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 107.0638 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.175,"smiles":null,"spectrum_id":"CCMSLIB00017285800","spectrum_index":36642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 101.0266 Da; putative annotation: N/A; putative formula: C7H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.15,"smiles":null,"spectrum_id":"CCMSLIB00017285803","spectrum_index":36643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[(3,4-dimethoxyphenyl)methyl](4-oxo(3-hydrophthalazinyl))carboxamide CollisionEnergy:205060\"\" (delta mass: 128.0806 Da; putative annotation: N/A; putative formula: C3H8N6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.21,"smiles":null,"spectrum_id":"CCMSLIB00017285806","spectrum_index":36644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 559.208 Da; putative annotation: N/A; putative formula: C30H25N9O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.268,"smiles":null,"spectrum_id":"CCMSLIB00017285807","spectrum_index":36645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rhetsinine (delta mass: 297.1406 Da; putative annotation: N/A; putative formula: C15H25NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.28,"smiles":null,"spectrum_id":"CCMSLIB00017285810","spectrum_index":36646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 17.0983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.247,"smiles":null,"spectrum_id":"CCMSLIB00017285813","spectrum_index":36647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 171.0775 Da; putative annotation: N/A; putative formula: C5H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.2,"smiles":null,"spectrum_id":"CCMSLIB00017285816","spectrum_index":36648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 355.3086 Da; putative annotation: N/A; putative formula: C21H41NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.379,"smiles":null,"spectrum_id":"CCMSLIB00017285817","spectrum_index":36649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 390.3151 Da; putative annotation: N/A; putative formula: C18H44N6O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.38,"smiles":null,"spectrum_id":"CCMSLIB00017285820","spectrum_index":36650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-O-Methylvisamminol (delta mass: 162.0489 Da; putative annotation: N/A; putative formula: C4H11N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.172,"smiles":null,"spectrum_id":"CCMSLIB00017285823","spectrum_index":36651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 105.0603 Da; putative annotation: N/A; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.173,"smiles":null,"spectrum_id":"CCMSLIB00017285824","spectrum_index":36652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 116.0876 Da; putative annotation: N/A; putative formula: C5H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.163,"smiles":null,"spectrum_id":"CCMSLIB00017285827","spectrum_index":36653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 164.0562 Da; putative annotation: N/A; putative formula: C4H4N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.09,"smiles":null,"spectrum_id":"CCMSLIB00017285830","spectrum_index":36654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.149,"smiles":null,"spectrum_id":"CCMSLIB00017285831","spectrum_index":36655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 241.2851 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.4,"smiles":null,"spectrum_id":"CCMSLIB00017285834","spectrum_index":36656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1235.596 Da; putative annotation: N/A; putative formula: C73H77N11O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1428.67,"smiles":null,"spectrum_id":"CCMSLIB00017285835","spectrum_index":36657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 168.0941 Da; putative annotation: N/A; putative formula: C13H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.165,"smiles":null,"spectrum_id":"CCMSLIB00017285838","spectrum_index":36658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 492.2441 Da; putative annotation: N/A; putative formula: C31H33N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.314,"smiles":null,"spectrum_id":"CCMSLIB00017285840","spectrum_index":36659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.294,"smiles":null,"spectrum_id":"CCMSLIB00017285842","spectrum_index":36660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one (delta mass: 159.0876 Da; putative annotation: N/A; putative formula: C3H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.169,"smiles":null,"spectrum_id":"CCMSLIB00017285845","spectrum_index":36661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 71.9762 Da; putative annotation: N/A; putative formula: C2HOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.052,"smiles":null,"spectrum_id":"CCMSLIB00017285848","spectrum_index":36662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 131.0581 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.213,"smiles":null,"spectrum_id":"CCMSLIB00017285850","spectrum_index":36663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one (delta mass: 73.0204 Da; putative annotation: N/A; putative formula: CH4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.097,"smiles":null,"spectrum_id":"CCMSLIB00017285852","spectrum_index":36664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 142.063 Da; putative annotation: N/A; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.15,"smiles":null,"spectrum_id":"CCMSLIB00017285855","spectrum_index":36665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 97.0496 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.146,"smiles":null,"spectrum_id":"CCMSLIB00017285858","spectrum_index":36666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 256.1585 Da; putative annotation: N/A; putative formula: C9H20N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.308,"smiles":null,"spectrum_id":"CCMSLIB00017285859","spectrum_index":36667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 108.0659 Da; putative annotation: N/A; putative formula: C6H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.13,"smiles":null,"spectrum_id":"CCMSLIB00017285862","spectrum_index":36668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 152.0469 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.128,"smiles":null,"spectrum_id":"CCMSLIB00017285865","spectrum_index":36669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 846.8992 Da; putative annotation: N/A; putative formula: C51H110N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1000.99,"smiles":null,"spectrum_id":"CCMSLIB00017285867","spectrum_index":36670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-glutamic acid (delta mass: 26.0155 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.071,"smiles":null,"spectrum_id":"CCMSLIB00017285869","spectrum_index":36671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 330.241 Da; putative annotation: N/A; putative formula: C18H34O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.312,"smiles":null,"spectrum_id":"CCMSLIB00017285872","spectrum_index":36672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 306.1694 Da; putative annotation: N/A; putative formula: C15H22N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.267,"smiles":null,"spectrum_id":"CCMSLIB00017285874","spectrum_index":36673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 717.9555 Da; putative annotation: N/A; putative formula: C38H22O-1S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":940.053,"smiles":null,"spectrum_id":"CCMSLIB00017285876","spectrum_index":36674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 747.5131 Da; putative annotation: N/A; putative formula: C37H61N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.662,"smiles":null,"spectrum_id":"CCMSLIB00017285879","spectrum_index":36675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.196,"smiles":null,"spectrum_id":"CCMSLIB00017285881","spectrum_index":36676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.202,"smiles":null,"spectrum_id":"CCMSLIB00017285883","spectrum_index":36677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 65.0646 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.092,"smiles":null,"spectrum_id":"CCMSLIB00017285886","spectrum_index":36678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 181.0775 Da; putative annotation: N/A; putative formula: C8H12N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.226,"smiles":null,"spectrum_id":"CCMSLIB00017285889","spectrum_index":36679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 124.0784 Da; putative annotation: N/A; putative formula: C8H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.217,"smiles":null,"spectrum_id":"CCMSLIB00017285890","spectrum_index":36680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 86.0424 Da; putative annotation: N/A; putative formula: C3H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.338,"smiles":null,"spectrum_id":"CCMSLIB00017285893","spectrum_index":36681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 1190.7461 Da; putative annotation: N/A; putative formula: C73H108O9P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1328.84,"smiles":null,"spectrum_id":"CCMSLIB00017285896","spectrum_index":36682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S-Carboxymethyl-L-cysteine CollisionEnergy:102040 (delta mass: 87.998 Da; putative annotation: N/A; putative formula: C3H4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.03,"smiles":null,"spectrum_id":"CCMSLIB00017285898","spectrum_index":36683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 609.2114 Da; putative annotation: N/A; putative formula: C27H39N5O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.271,"smiles":null,"spectrum_id":"CCMSLIB00017285901","spectrum_index":36684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Val (delta mass: 113.0847 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.219,"smiles":null,"spectrum_id":"CCMSLIB00017285902","spectrum_index":36685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 68.0361 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.113,"smiles":null,"spectrum_id":"CCMSLIB00017285905","spectrum_index":36686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.154,"smiles":null,"spectrum_id":"CCMSLIB00017285908","spectrum_index":36687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 131.9438 Da; putative annotation: N/A; putative formula: C3HO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.015,"smiles":null,"spectrum_id":"CCMSLIB00017285909","spectrum_index":36688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7,10,13-Pentaazacyclopentadecane (delta mass: 59.0366 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.255,"smiles":null,"spectrum_id":"CCMSLIB00017285912","spectrum_index":36689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 178.136 Da; putative annotation: N/A; putative formula: C12H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.237,"smiles":null,"spectrum_id":"CCMSLIB00017285915","spectrum_index":36690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 83.058 Da; putative annotation: N/A; putative formula: C2H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.069,"smiles":null,"spectrum_id":"CCMSLIB00017285917","spectrum_index":36691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 372.199 Da; putative annotation: N/A; putative formula: C28H24N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.264,"smiles":null,"spectrum_id":"CCMSLIB00017285920","spectrum_index":36692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-yl)-N-(4-methoxyphenyl)acetamide (delta mass: 59.0401 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.169,"smiles":null,"spectrum_id":"CCMSLIB00017285922","spectrum_index":36693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 74.0362 Da; putative annotation: N/A; putative formula: C3H6O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.128,"smiles":null,"spectrum_id":"CCMSLIB00017285924","spectrum_index":36694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.128,"smiles":null,"spectrum_id":"CCMSLIB00017285927","spectrum_index":36695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 496.2549 Da; putative annotation: N/A; putative formula: C21H41N2O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.326,"smiles":null,"spectrum_id":"CCMSLIB00017285930","spectrum_index":36696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 116.0836 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.164,"smiles":null,"spectrum_id":"CCMSLIB00017285931","spectrum_index":36697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 101.0331 Da; putative annotation: N/A; putative formula: CH3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.119,"smiles":null,"spectrum_id":"CCMSLIB00017285934","spectrum_index":36698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 70.0422 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.248,"smiles":null,"spectrum_id":"CCMSLIB00017285937","spectrum_index":36699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 29.0296 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.069,"smiles":null,"spectrum_id":"CCMSLIB00017285938","spectrum_index":36700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 77.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.128,"smiles":null,"spectrum_id":"CCMSLIB00017285941","spectrum_index":36701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 17.0041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.071,"smiles":null,"spectrum_id":"CCMSLIB00017285944","spectrum_index":36702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 472.3434 Da; putative annotation: N/A; putative formula: C25H49N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.44,"smiles":null,"spectrum_id":"CCMSLIB00017285945","spectrum_index":36703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 87.0926 Da; putative annotation: N/A; putative formula: C2H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017285948","spectrum_index":36704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 89.0476 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.111,"smiles":null,"spectrum_id":"CCMSLIB00017285951","spectrum_index":36705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophan betaine (delta mass: 127.042 Da; putative annotation: N/A; putative formula: C9H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.186,"smiles":null,"spectrum_id":"CCMSLIB00017285952","spectrum_index":36706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 190.4134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.5,"smiles":null,"spectrum_id":"CCMSLIB00017285955","spectrum_index":36707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 70.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.134,"smiles":null,"spectrum_id":"CCMSLIB00017285958","spectrum_index":36708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 62.0354 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.122,"smiles":null,"spectrum_id":"CCMSLIB00017285959","spectrum_index":36709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 15.0249 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.117,"smiles":null,"spectrum_id":"CCMSLIB00017285962","spectrum_index":36710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 74.0732 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.232,"smiles":null,"spectrum_id":"CCMSLIB00017285965","spectrum_index":36711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 55.2097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.226,"smiles":null,"spectrum_id":"CCMSLIB00017285966","spectrum_index":36712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 97.0156 Da; putative annotation: N/A; putative formula: C4H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.155,"smiles":null,"spectrum_id":"CCMSLIB00017285969","spectrum_index":36713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 116.0832 Da; putative annotation: 1,1,1-Tris(hydroxymethyl)propane; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.169,"smiles":null,"spectrum_id":"CCMSLIB00017285972","spectrum_index":36714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 84.0579 Da; putative annotation: Tetrahydro-3-furanylmethanol; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.17,"smiles":null,"spectrum_id":"CCMSLIB00017285975","spectrum_index":36715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1126.5211 Da; putative annotation: 4-O-Acetyl-6-deoxy-2-O-(6-deoxy-.alpha.-L-mannopyranosyl)-3-O-((2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl)-1-O-((2.beta.,3.beta.,5.xi.,9.xi.)-3-(.beta.-D-glucopyranuronosyloxy)-2,23-dihydroxy-23,28-dioxoolean-12-en-28-yl)-.beta.-D-galactopyranose; putative formula: C55H82O24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1319.59,"smiles":null,"spectrum_id":"CCMSLIB00017285978","spectrum_index":36716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 157.0537 Da; putative annotation: 7-Amino-4-methylcoumarin; putative formula: C10H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.14,"smiles":null,"spectrum_id":"CCMSLIB00017285979","spectrum_index":36717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 41.0264 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017285982","spectrum_index":36718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 72.0361 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.102,"smiles":null,"spectrum_id":"CCMSLIB00017285985","spectrum_index":36719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 372.2051 Da; putative annotation: N/A; putative formula: C21H28N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.291,"smiles":null,"spectrum_id":"CCMSLIB00017285986","spectrum_index":36720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 233.6215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.77,"smiles":null,"spectrum_id":"CCMSLIB00017285989","spectrum_index":36721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380167-01!3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015] (delta mass: 106.0263 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.18,"smiles":null,"spectrum_id":"CCMSLIB00017285992","spectrum_index":36722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylquinolin-4-amine (delta mass: 159.0531 Da; putative annotation: N/A; putative formula: C6H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.145,"smiles":null,"spectrum_id":"CCMSLIB00017285993","spectrum_index":36723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 38.0516 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.132,"smiles":null,"spectrum_id":"CCMSLIB00017285996","spectrum_index":36724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 133.0705 Da; putative annotation: N/A; putative formula: CH7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.12,"smiles":null,"spectrum_id":"CCMSLIB00017285999","spectrum_index":36725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 44.033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.138,"smiles":null,"spectrum_id":"CCMSLIB00017286000","spectrum_index":36726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Camptothecin (delta mass: 18.0917 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.21,"smiles":null,"spectrum_id":"CCMSLIB00017286003","spectrum_index":36727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 195.0566 Da; putative annotation: N/A; putative formula: C6H13NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.196,"smiles":null,"spectrum_id":"CCMSLIB00017286006","spectrum_index":36728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 786.348 Da; putative annotation: N/A; putative formula: C42H50N4O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":993.434,"smiles":null,"spectrum_id":"CCMSLIB00017286008","spectrum_index":36729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 191.1156 Da; putative annotation: N/A; putative formula: C8H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.264,"smiles":null,"spectrum_id":"CCMSLIB00017286010","spectrum_index":36730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 170.0836 Da; putative annotation: N/A; putative formula: C5H11N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.233,"smiles":null,"spectrum_id":"CCMSLIB00017286013","spectrum_index":36731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 96.0468 Da; putative annotation: N/A; putative formula: C6H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.165,"smiles":null,"spectrum_id":"CCMSLIB00017286016","spectrum_index":36732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 68.0115 Da; putative annotation: N/A; putative formula: CN4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.165,"smiles":null,"spectrum_id":"CCMSLIB00017286019","spectrum_index":36733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 146.0653 Da; putative annotation: N/A; putative formula: C10H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.167,"smiles":null,"spectrum_id":"CCMSLIB00017286020","spectrum_index":36734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 243.6616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.732,"smiles":null,"spectrum_id":"CCMSLIB00017286023","spectrum_index":36735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 36.0236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.319,"smiles":null,"spectrum_id":"CCMSLIB00017286026","spectrum_index":36736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 38.0523 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.18,"smiles":null,"spectrum_id":"CCMSLIB00017286027","spectrum_index":36737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 901.2521 Da; putative annotation: N/A; putative formula: C48H43N3O13S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1244.38,"smiles":null,"spectrum_id":"CCMSLIB00017286030","spectrum_index":36738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 114.0788 Da; putative annotation: N/A; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.165,"smiles":null,"spectrum_id":"CCMSLIB00017286033","spectrum_index":36739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1,2,3,4-tetrahydroquinoline (delta mass: 87.0317 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.144,"smiles":null,"spectrum_id":"CCMSLIB00017286035","spectrum_index":36740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 74.7413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.841,"smiles":null,"spectrum_id":"CCMSLIB00017286037","spectrum_index":36741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 326.1002 Da; putative annotation: N/A; putative formula: C22H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.191,"smiles":null,"spectrum_id":"CCMSLIB00017286040","spectrum_index":36742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 232.035 Da; putative annotation: N/A; putative formula: CH4N12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.1,"smiles":null,"spectrum_id":"CCMSLIB00017286043","spectrum_index":36743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mahanimbine (delta mass: 392.2461 Da; putative annotation: N/A; putative formula: C25H32N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.447,"smiles":null,"spectrum_id":"CCMSLIB00017286044","spectrum_index":36744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 280.24 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.348,"smiles":null,"spectrum_id":"CCMSLIB00017286047","spectrum_index":36745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reserpic acid (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.218,"smiles":null,"spectrum_id":"CCMSLIB00017286050","spectrum_index":36746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 320.1217 Da; putative annotation: N/A; putative formula: C12H20N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.197,"smiles":null,"spectrum_id":"CCMSLIB00017286052","spectrum_index":36747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-His (delta mass: 204.0897 Da; putative annotation: N/A; putative formula: C11H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.188,"smiles":null,"spectrum_id":"CCMSLIB00017286054","spectrum_index":36748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 8.988 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.075,"smiles":null,"spectrum_id":"CCMSLIB00017286057","spectrum_index":36749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 338.1214 Da; putative annotation: N/A; putative formula: C13H22O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.245,"smiles":null,"spectrum_id":"CCMSLIB00017286060","spectrum_index":36750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 322.385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.519,"smiles":null,"spectrum_id":"CCMSLIB00017286061","spectrum_index":36751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347865-02!4-[7-acetyloxy-5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxoisoquinolin-2-yl]-5-amino-5-oxopentanoic acid (delta mass: 578.2104 Da; putative annotation: N/A; putative formula: C19H38N4O14S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1097.4,"smiles":null,"spectrum_id":"CCMSLIB00017286064","spectrum_index":36752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 211.0954 Da; putative annotation: N/A; putative formula: C9H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.192,"smiles":null,"spectrum_id":"CCMSLIB00017286068","spectrum_index":36753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 11.985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.076,"smiles":null,"spectrum_id":"CCMSLIB00017286070","spectrum_index":36754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 220.2392 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.352,"smiles":null,"spectrum_id":"CCMSLIB00017286073","spectrum_index":36755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 17.019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.137,"smiles":null,"spectrum_id":"CCMSLIB00017286075","spectrum_index":36756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 204.9432 Da; putative annotation: N/A; putative formula: C4H3N3OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.102,"smiles":null,"spectrum_id":"CCMSLIB00017286078","spectrum_index":36757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ethylimidazoleacetic acid (delta mass: 28.9539 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.02,"smiles":null,"spectrum_id":"CCMSLIB00017286081","spectrum_index":36758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 70.0414 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.154,"smiles":null,"spectrum_id":"CCMSLIB00017286083","spectrum_index":36759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 108.0338 Da; putative annotation: N/A; putative formula: C5H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.109,"smiles":null,"spectrum_id":"CCMSLIB00017286086","spectrum_index":36760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 198.0938 Da; putative annotation: N/A; putative formula: C8H14N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.133,"smiles":null,"spectrum_id":"CCMSLIB00017286089","spectrum_index":36761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 161.0834 Da; putative annotation: N/A; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.133,"smiles":null,"spectrum_id":"CCMSLIB00017286090","spectrum_index":36762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 80.9265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.003,"smiles":null,"spectrum_id":"CCMSLIB00017286093","spectrum_index":36763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 151.2087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.269,"smiles":null,"spectrum_id":"CCMSLIB00017286096","spectrum_index":36764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of phenylethanolamine - 40.0 eV (delta mass: 373.7257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.817,"smiles":null,"spectrum_id":"CCMSLIB00017286097","spectrum_index":36765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 132.0995 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.395,"smiles":null,"spectrum_id":"CCMSLIB00017286100","spectrum_index":36766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 69.0579 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.155,"smiles":null,"spectrum_id":"CCMSLIB00017286103","spectrum_index":36767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 168.2231 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.32,"smiles":null,"spectrum_id":"CCMSLIB00017286105","spectrum_index":36768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 146.0581 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.145,"smiles":null,"spectrum_id":"CCMSLIB00017286107","spectrum_index":36769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melatonin - 30.0 eV (delta mass: 38.0514 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.18,"smiles":null,"spectrum_id":"CCMSLIB00017286110","spectrum_index":36770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-7-carboxylic acid (delta mass: 45.0087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.072,"smiles":null,"spectrum_id":"CCMSLIB00017286113","spectrum_index":36771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 279.1789 Da; putative annotation: N/A; putative formula: C11H25N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.333,"smiles":null,"spectrum_id":"CCMSLIB00017286114","spectrum_index":36772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 23.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017286117","spectrum_index":36773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 591.3076 Da; putative annotation: N/A; putative formula: C30H46N3O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.378,"smiles":null,"spectrum_id":"CCMSLIB00017286120","spectrum_index":36774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 48.0119 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.113,"smiles":null,"spectrum_id":"CCMSLIB00017286121","spectrum_index":36775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 117.0331 Da; putative annotation: N/A; putative formula: C6H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.161,"smiles":null,"spectrum_id":"CCMSLIB00017286124","spectrum_index":36776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 168.1522 Da; putative annotation: N/A; putative formula: C11H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.197,"smiles":null,"spectrum_id":"CCMSLIB00017286126","spectrum_index":36777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 475.3211 Da; putative annotation: N/A; putative formula: C28H46NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":720.417,"smiles":null,"spectrum_id":"CCMSLIB00017286128","spectrum_index":36778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 45.0435 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.119,"smiles":null,"spectrum_id":"CCMSLIB00017286131","spectrum_index":36779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 80.0799 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.16,"smiles":null,"spectrum_id":"CCMSLIB00017286134","spectrum_index":36780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 421.3236 Da; putative annotation: N/A; putative formula: C23H43N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.503,"smiles":null,"spectrum_id":"CCMSLIB00017286137","spectrum_index":36781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 121.0196 Da; putative annotation: N/A; putative formula: C3H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.116,"smiles":null,"spectrum_id":"CCMSLIB00017286138","spectrum_index":36782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 47.0492 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.114,"smiles":null,"spectrum_id":"CCMSLIB00017286141","spectrum_index":36783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 299.1214 Da; putative annotation: N/A; putative formula: C8H9N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.197,"smiles":null,"spectrum_id":"CCMSLIB00017286143","spectrum_index":36784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 676.5571 Da; putative annotation: N/A; putative formula: C49H72O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":862.628,"smiles":null,"spectrum_id":"CCMSLIB00017286146","spectrum_index":36785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 222.0645 Da; putative annotation: N/A; putative formula: C11H14N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.224,"smiles":null,"spectrum_id":"CCMSLIB00017286148","spectrum_index":36786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTAMINE - 20.0 eV (delta mass: 116.0474 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.134,"smiles":null,"spectrum_id":"CCMSLIB00017286151","spectrum_index":36787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2,5-Dihydroxyhexyl)oxolan-2-one (delta mass: 133.1103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.238,"smiles":null,"spectrum_id":"CCMSLIB00017286154","spectrum_index":36788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 602.3936 Da; putative annotation: N/A; putative formula: C35H58N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.48,"smiles":null,"spectrum_id":"CCMSLIB00017286156","spectrum_index":36789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptoline (delta mass: 43.9882 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.096,"smiles":null,"spectrum_id":"CCMSLIB00017286159","spectrum_index":36790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.117,"smiles":null,"spectrum_id":"CCMSLIB00017286162","spectrum_index":36791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 118.0779 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.174,"smiles":null,"spectrum_id":"CCMSLIB00017286164","spectrum_index":36792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 34.0209 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017286167","spectrum_index":36793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 192.0661 Da; putative annotation: N/A; putative formula: C6H13N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.205,"smiles":null,"spectrum_id":"CCMSLIB00017286170","spectrum_index":36794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 306.0145 Da; putative annotation: N/A; putative formula: C14H6N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.085,"smiles":null,"spectrum_id":"CCMSLIB00017286173","spectrum_index":36795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 29.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.123,"smiles":null,"spectrum_id":"CCMSLIB00017286175","spectrum_index":36796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 482.3016 Da; putative annotation: N/A; putative formula: C27H34N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.425,"smiles":null,"spectrum_id":"CCMSLIB00017286178","spectrum_index":36797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Phenylalanine (delta mass: 41.0264 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.113,"smiles":null,"spectrum_id":"CCMSLIB00017286181","spectrum_index":36798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rhodomyrtone (delta mass: 37.0464 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.289,"smiles":null,"spectrum_id":"CCMSLIB00017286183","spectrum_index":36799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 32.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.123,"smiles":null,"spectrum_id":"CCMSLIB00017286186","spectrum_index":36800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 244.1352 Da; putative annotation: N/A; putative formula: C12H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.274,"smiles":null,"spectrum_id":"CCMSLIB00017286187","spectrum_index":36801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 84.0912 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.256,"smiles":null,"spectrum_id":"CCMSLIB00017286190","spectrum_index":36802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhistamine (delta mass: 68.0373 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.14,"smiles":null,"spectrum_id":"CCMSLIB00017286193","spectrum_index":36803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 161.9898 Da; putative annotation: N/A; putative formula: C7H4N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.076,"smiles":null,"spectrum_id":"CCMSLIB00017286196","spectrum_index":36804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 115.0745 Da; putative annotation: N/A; putative formula: C4H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.113,"smiles":null,"spectrum_id":"CCMSLIB00017286199","spectrum_index":36805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 173.8939 Da; putative annotation: N/A; putative formula: CH2O2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.043,"smiles":null,"spectrum_id":"CCMSLIB00017286200","spectrum_index":36806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatol (delta mass: 74.0765 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.158,"smiles":null,"spectrum_id":"CCMSLIB00017286203","spectrum_index":36807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 56.0622 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.122,"smiles":null,"spectrum_id":"CCMSLIB00017286206","spectrum_index":36808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 960.0397 Da; putative annotation: N/A; putative formula: C34H28N10O14S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1115.11,"smiles":null,"spectrum_id":"CCMSLIB00017286207","spectrum_index":36809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 88.0246 Da; putative annotation: N/A; putative formula: C2H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.148,"smiles":null,"spectrum_id":"CCMSLIB00017286210","spectrum_index":36810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 172.0372 Da; putative annotation: N/A; putative formula: C7H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.103,"smiles":null,"spectrum_id":"CCMSLIB00017286213","spectrum_index":36811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 358.2872 Da; putative annotation: N/A; putative formula: C24H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.421,"smiles":null,"spectrum_id":"CCMSLIB00017286216","spectrum_index":36812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 261.1579 Da; putative annotation: N/A; putative formula: C12H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.27,"smiles":null,"spectrum_id":"CCMSLIB00017286219","spectrum_index":36813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00639 Kynurenine (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.087,"smiles":null,"spectrum_id":"CCMSLIB00017286220","spectrum_index":36814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 239.0655 Da; putative annotation: N/A; putative formula: C8H9N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.17,"smiles":null,"spectrum_id":"CCMSLIB00017286223","spectrum_index":36815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 57.0217 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017286225","spectrum_index":36816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 594.1797 Da; putative annotation: N/A; putative formula: C30H26N8O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.24,"smiles":null,"spectrum_id":"CCMSLIB00017286227","spectrum_index":36817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 23.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.139,"smiles":null,"spectrum_id":"CCMSLIB00017286230","spectrum_index":36818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 445.1581 Da; putative annotation: N/A; putative formula: C17H23N11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.218,"smiles":null,"spectrum_id":"CCMSLIB00017286231","spectrum_index":36819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-valine CollisionEnergy:102040 (delta mass: 100.0526 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017286234","spectrum_index":36820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 104.0983 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.163,"smiles":null,"spectrum_id":"CCMSLIB00017286235","spectrum_index":36821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 101.0705 Da; putative annotation: N/A; putative formula: C2H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.136,"smiles":null,"spectrum_id":"CCMSLIB00017286238","spectrum_index":36822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 45.009 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.137,"smiles":null,"spectrum_id":"CCMSLIB00017286241","spectrum_index":36823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 462.1472 Da; putative annotation: N/A; putative formula: C23H30N2O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1129.38,"smiles":null,"spectrum_id":"CCMSLIB00017286242","spectrum_index":36824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 349.1447 Da; putative annotation: N/A; putative formula: C18H24NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.231,"smiles":null,"spectrum_id":"CCMSLIB00017286245","spectrum_index":36825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 110.0367 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.112,"smiles":null,"spectrum_id":"CCMSLIB00017286246","spectrum_index":36826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-1H-indole-3-carbaldehyde (delta mass: 45.9958 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.017,"smiles":null,"spectrum_id":"CCMSLIB00017286249","spectrum_index":36827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(1H-1,2,3,4-tetraazol-5-yl)-4-[(4-hydroxy-3-methoxyphenyl)methylene]-3-methy l-1,2-diazolin-5-one CollisionEnergy:102040\"\" (delta mass: 53.0498 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.154,"smiles":null,"spectrum_id":"CCMSLIB00017286252","spectrum_index":36828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 15.0107 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.076,"smiles":null,"spectrum_id":"CCMSLIB00017286253","spectrum_index":36829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 129.079 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017286256","spectrum_index":36830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 420.1866 Da; putative annotation: N/A; putative formula: C17H32N4O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.257,"smiles":null,"spectrum_id":"CCMSLIB00017286257","spectrum_index":36831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 25.0567 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.179,"smiles":null,"spectrum_id":"CCMSLIB00017286260","spectrum_index":36832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 119.9877 Da; putative annotation: N/A; putative formula: C5HN2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.126,"smiles":null,"spectrum_id":"CCMSLIB00017286263","spectrum_index":36833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 66.0181 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.055,"smiles":null,"spectrum_id":"CCMSLIB00017286264","spectrum_index":36834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 372.1932 Da; putative annotation: N/A; putative formula: C22H28O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.311,"smiles":null,"spectrum_id":"CCMSLIB00017286267","spectrum_index":36835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 131.092 Da; putative annotation: N/A; putative formula: C2H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.199,"smiles":null,"spectrum_id":"CCMSLIB00017286270","spectrum_index":36836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenyl-1-(2,4,6-trihydroxyphenyl)nonan-1-one (delta mass: 32.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.253,"smiles":null,"spectrum_id":"CCMSLIB00017286271","spectrum_index":36837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 81.1259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.222,"smiles":null,"spectrum_id":"CCMSLIB00017286274","spectrum_index":36838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gly-Glu (delta mass: 111.0479 Da; putative annotation: N/A; putative formula: C9H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.172,"smiles":null,"spectrum_id":"CCMSLIB00017286276","spectrum_index":36839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 364.2015 Da; putative annotation: N/A; putative formula: C17H33O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.335,"smiles":null,"spectrum_id":"CCMSLIB00017286279","spectrum_index":36840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 31.1728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.274,"smiles":null,"spectrum_id":"CCMSLIB00017286281","spectrum_index":36841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N(6)-OH-Me-Adenosine (delta mass: 132.0424 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.157,"smiles":null,"spectrum_id":"CCMSLIB00017286284","spectrum_index":36842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 668.2675 Da; putative annotation: N/A; putative formula: C45H36N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":831.328,"smiles":null,"spectrum_id":"CCMSLIB00017286287","spectrum_index":36843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 659.4607 Da; putative annotation: N/A; putative formula: C35H65NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.609,"smiles":null,"spectrum_id":"CCMSLIB00017286290","spectrum_index":36844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310786 Glutamyl-S-(C4H7O2)-cysteinylglycine (delta mass: 129.0404 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.168,"smiles":null,"spectrum_id":"CCMSLIB00017286291","spectrum_index":36845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 141.0427 Da; putative annotation: N/A; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017286294","spectrum_index":36846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 161.0687 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.208,"smiles":null,"spectrum_id":"CCMSLIB00017286297","spectrum_index":36847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 18.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017286298","spectrum_index":36848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 111.0319 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.144,"smiles":null,"spectrum_id":"CCMSLIB00017286301","spectrum_index":36849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 630.3773 Da; putative annotation: N/A; putative formula: C37H58O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.464,"smiles":null,"spectrum_id":"CCMSLIB00017286304","spectrum_index":36850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 755.3683 Da; putative annotation: N/A; putative formula: C30H53N13O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.439,"smiles":null,"spectrum_id":"CCMSLIB00017286307","spectrum_index":36851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 427.0316 Da; putative annotation: N/A; putative formula: C20H9N7OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.069,"smiles":null,"spectrum_id":"CCMSLIB00017286308","spectrum_index":36852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 146.0214 Da; putative annotation: N/A; putative formula: C5H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.274,"smiles":null,"spectrum_id":"CCMSLIB00017286311","spectrum_index":36853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 59.0506 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.093,"smiles":null,"spectrum_id":"CCMSLIB00017286314","spectrum_index":36854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 99.0821 Da; putative annotation: N/A; putative formula: C4H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.169,"smiles":null,"spectrum_id":"CCMSLIB00017286316","spectrum_index":36855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 66.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.087,"smiles":null,"spectrum_id":"CCMSLIB00017286318","spectrum_index":36856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of eserine (delta mass: 18.0148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.185,"smiles":null,"spectrum_id":"CCMSLIB00017286321","spectrum_index":36857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 202.1688 Da; putative annotation: N/A; putative formula: C10H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.26,"smiles":null,"spectrum_id":"CCMSLIB00017286324","spectrum_index":36858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 199.062 Da; putative annotation: N/A; putative formula: C6H10N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.238,"smiles":null,"spectrum_id":"CCMSLIB00017286325","spectrum_index":36859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 95.0346 Da; putative annotation: N/A; putative formula: CHN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.188,"smiles":null,"spectrum_id":"CCMSLIB00017286328","spectrum_index":36860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 6.4196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017286330","spectrum_index":36861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 64.0673 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.159,"smiles":null,"spectrum_id":"CCMSLIB00017286332","spectrum_index":36862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 41.944 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.031,"smiles":null,"spectrum_id":"CCMSLIB00017286335","spectrum_index":36863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 27.0313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.133,"smiles":null,"spectrum_id":"CCMSLIB00017286338","spectrum_index":36864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 590.7021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.842,"smiles":null,"spectrum_id":"CCMSLIB00017286341","spectrum_index":36865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazole-2-thiol (delta mass: 30.017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017286342","spectrum_index":36866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 25.0103 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.102,"smiles":null,"spectrum_id":"CCMSLIB00017286345","spectrum_index":36867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of imbricatine (delta mass: 88.0513 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.148,"smiles":null,"spectrum_id":"CCMSLIB00017286348","spectrum_index":36868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 180.0287 Da; putative annotation: N/A; putative formula: C6H4N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.167,"smiles":null,"spectrum_id":"CCMSLIB00017286351","spectrum_index":36869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 152.0682 Da; putative annotation: N/A; putative formula: C2H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.128,"smiles":null,"spectrum_id":"CCMSLIB00017286352","spectrum_index":36870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074903 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 116.0262 Da; putative annotation: N/A; putative formula: C8H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.107,"smiles":null,"spectrum_id":"CCMSLIB00017286355","spectrum_index":36871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 19.0498 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.1,"smiles":null,"spectrum_id":"CCMSLIB00017286358","spectrum_index":36872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 268.1597 Da; putative annotation: N/A; putative formula: C15H25O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.246,"smiles":null,"spectrum_id":"CCMSLIB00017286360","spectrum_index":36873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-5-fluoropentanoic acid (delta mass: 27.9973 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.074,"smiles":null,"spectrum_id":"CCMSLIB00017286362","spectrum_index":36874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 147.0685 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.192,"smiles":null,"spectrum_id":"CCMSLIB00017286365","spectrum_index":36875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 116.0609 Da; putative annotation: N/A; putative formula: C3H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.132,"smiles":null,"spectrum_id":"CCMSLIB00017286366","spectrum_index":36876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Leu (delta mass: 226.168 Da; putative annotation: Leu-Ile; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.338,"smiles":null,"spectrum_id":"CCMSLIB00017286369","spectrum_index":36877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 116.0834 Da; putative annotation: Ethoxyethoxyethanol; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.143,"smiles":null,"spectrum_id":"CCMSLIB00017286372","spectrum_index":36878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 143.0584 Da; putative annotation: Acetyl-L-threonine; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.182,"smiles":null,"spectrum_id":"CCMSLIB00017286375","spectrum_index":36879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EUGENOL (delta mass: 102.0469 Da; putative annotation: 4-Vinylphenol; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.138,"smiles":null,"spectrum_id":"CCMSLIB00017286376","spectrum_index":36880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine; AIF; CE0; MS2Dec (delta mass: 695.4232 Da; putative annotation: N/A; putative formula: C34H53N11O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":917.52,"smiles":null,"spectrum_id":"CCMSLIB00017286379","spectrum_index":36881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 515.2946 Da; putative annotation: N/A; putative formula: C28H37N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.443,"smiles":null,"spectrum_id":"CCMSLIB00017286381","spectrum_index":36882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 286.0895 Da; putative annotation: N/A; putative formula: C6H20N6OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.295,"smiles":null,"spectrum_id":"CCMSLIB00017286383","spectrum_index":36883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 24.0207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017286386","spectrum_index":36884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 242.0794 Da; putative annotation: N/A; putative formula: C11H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.176,"smiles":null,"spectrum_id":"CCMSLIB00017286389","spectrum_index":36885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 196.1222 Da; putative annotation: N/A; putative formula: C10H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.299,"smiles":null,"spectrum_id":"CCMSLIB00017286392","spectrum_index":36886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 107.9756 Da; putative annotation: N/A; putative formula: C5HOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.015,"smiles":null,"spectrum_id":"CCMSLIB00017286393","spectrum_index":36887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 93.0432 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.098,"smiles":null,"spectrum_id":"CCMSLIB00017286396","spectrum_index":36888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 113.9071 Da; putative annotation: N/A; putative formula: C3H-2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.972,"smiles":null,"spectrum_id":"CCMSLIB00017286399","spectrum_index":36889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 130.0992 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.163,"smiles":null,"spectrum_id":"CCMSLIB00017286401","spectrum_index":36890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 296.147 Da; putative annotation: N/A; putative formula: C12H24O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.186,"smiles":null,"spectrum_id":"CCMSLIB00017286403","spectrum_index":36891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 270.1474 Da; putative annotation: N/A; putative formula: C15H26S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.218,"smiles":null,"spectrum_id":"CCMSLIB00017286406","spectrum_index":36892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 212.2347 Da; putative annotation: N/A; putative formula: C12H28N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.404,"smiles":null,"spectrum_id":"CCMSLIB00017286409","spectrum_index":36893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 18.0855 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.15,"smiles":null,"spectrum_id":"CCMSLIB00017286411","spectrum_index":36894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 100.0727 Da; putative annotation: N/A; putative formula: C6H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.211,"smiles":null,"spectrum_id":"CCMSLIB00017286413","spectrum_index":36895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 211.052 Da; putative annotation: N/A; putative formula: C6H13NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.133,"smiles":null,"spectrum_id":"CCMSLIB00017286416","spectrum_index":36896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-tyrosine (delta mass: 143.1307 Da; putative annotation: N/A; putative formula: C8H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.222,"smiles":null,"spectrum_id":"CCMSLIB00017286419","spectrum_index":36897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 343.1922 Da; putative annotation: N/A; putative formula: C18H26N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.289,"smiles":null,"spectrum_id":"CCMSLIB00017286420","spectrum_index":36898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetamide (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017286423","spectrum_index":36899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 299.1848 Da; putative annotation: N/A; putative formula: C14H25N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.282,"smiles":null,"spectrum_id":"CCMSLIB00017286426","spectrum_index":36900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 489.1758 Da; putative annotation: N/A; putative formula: C34H24N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.268,"smiles":null,"spectrum_id":"CCMSLIB00017286429","spectrum_index":36901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 57.0578 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.154,"smiles":null,"spectrum_id":"CCMSLIB00017286430","spectrum_index":36902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 332.1742 Da; putative annotation: N/A; putative formula: C11H24N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.292,"smiles":null,"spectrum_id":"CCMSLIB00017286433","spectrum_index":36903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 118.1357 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.222,"smiles":null,"spectrum_id":"CCMSLIB00017286436","spectrum_index":36904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORADRENALINE (delta mass: 45.0943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.176,"smiles":null,"spectrum_id":"CCMSLIB00017286437","spectrum_index":36905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 176.0321 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.113,"smiles":null,"spectrum_id":"CCMSLIB00017286440","spectrum_index":36906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 93.0461 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.113,"smiles":null,"spectrum_id":"CCMSLIB00017286442","spectrum_index":36907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 60.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017286445","spectrum_index":36908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 55.0356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.131,"smiles":null,"spectrum_id":"CCMSLIB00017286448","spectrum_index":36909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 84.0572 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017286451","spectrum_index":36910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 4.0133 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.11,"smiles":null,"spectrum_id":"CCMSLIB00017286454","spectrum_index":36911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 30.0098 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017286456","spectrum_index":36912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 185.0645 Da; putative annotation: N/A; putative formula: C4H7N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.31,"smiles":null,"spectrum_id":"CCMSLIB00017286458","spectrum_index":36913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-arginine (delta mass: 106.0419 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.171,"smiles":null,"spectrum_id":"CCMSLIB00017286461","spectrum_index":36914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Fluorobenzoyl)-5-amino-1H-indole (delta mass: 46.0136 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.106,"smiles":null,"spectrum_id":"CCMSLIB00017286464","spectrum_index":36915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-(methylthio)- (delta mass: 32.034 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.197,"smiles":null,"spectrum_id":"CCMSLIB00017286467","spectrum_index":36916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 100.0308 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017286468","spectrum_index":36917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 134.0912 Da; putative annotation: N/A; putative formula: C2H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.141,"smiles":null,"spectrum_id":"CCMSLIB00017286471","spectrum_index":36918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-MANNOSAMINE (delta mass: 894.3629 Da; putative annotation: N/A; putative formula: C55H50N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1116.46,"smiles":null,"spectrum_id":"CCMSLIB00017286474","spectrum_index":36919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 311.158 Da; putative annotation: N/A; putative formula: C12H25NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.213,"smiles":null,"spectrum_id":"CCMSLIB00017286477","spectrum_index":36920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 29.9923 Da; putative annotation: N/A; putative formula: CH2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.105,"smiles":null,"spectrum_id":"CCMSLIB00017286478","spectrum_index":36921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01040 Hexahydrocurcumin (delta mass: 105.1152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.295,"smiles":null,"spectrum_id":"CCMSLIB00017286481","spectrum_index":36922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 36.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.175,"smiles":null,"spectrum_id":"CCMSLIB00017286484","spectrum_index":36923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300738 Cephaeline (delta mass: 43.1206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.411,"smiles":null,"spectrum_id":"CCMSLIB00017286485","spectrum_index":36924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reticuline (delta mass: 136.1228 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.293,"smiles":null,"spectrum_id":"CCMSLIB00017286488","spectrum_index":36925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1315.6959 Da; putative annotation: N/A; putative formula: C68H101N9O13S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1478.76,"smiles":null,"spectrum_id":"CCMSLIB00017286491","spectrum_index":36926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 503.1843 Da; putative annotation: N/A; putative formula: C31H25N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.26,"smiles":null,"spectrum_id":"CCMSLIB00017286492","spectrum_index":36927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3695-24-7 CollisionEnergy:102040 (delta mass: 56.026 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.086,"smiles":null,"spectrum_id":"CCMSLIB00017286495","spectrum_index":36928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of XYLITOL (delta mass: 178.0264 Da; putative annotation: N/A; putative formula: C9H7ClN2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.102,"smiles":null,"spectrum_id":"CCMSLIB00017286498","spectrum_index":36929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 170.1664 Da; putative annotation: N/A; putative formula: C11H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.227,"smiles":null,"spectrum_id":"CCMSLIB00017286500","spectrum_index":36930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 45.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.154,"smiles":null,"spectrum_id":"CCMSLIB00017286502","spectrum_index":36931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 294.2894 Da; putative annotation: N/A; putative formula: C16H34N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.36,"smiles":null,"spectrum_id":"CCMSLIB00017286505","spectrum_index":36932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 114.9966 Da; putative annotation: N/A; putative formula: CHN5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.088,"smiles":null,"spectrum_id":"CCMSLIB00017286508","spectrum_index":36933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 56.0707 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.178,"smiles":null,"spectrum_id":"CCMSLIB00017286509","spectrum_index":36934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 673.3928 Da; putative annotation: N/A; putative formula: C41H51N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":862.541,"smiles":null,"spectrum_id":"CCMSLIB00017286512","spectrum_index":36935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 222.1105 Da; putative annotation: N/A; putative formula: C9H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.165,"smiles":null,"spectrum_id":"CCMSLIB00017286515","spectrum_index":36936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 813.4475 Da; putative annotation: N/A; putative formula: C50H63N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":976.508,"smiles":null,"spectrum_id":"CCMSLIB00017286516","spectrum_index":36937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 70.0381 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.114,"smiles":null,"spectrum_id":"CCMSLIB00017286519","spectrum_index":36938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 518.1697 Da; putative annotation: N/A; putative formula: C21H26N8O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.235,"smiles":null,"spectrum_id":"CCMSLIB00017286522","spectrum_index":36939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethanone, 1-[1-(4-hydroxypentyl)-1H-indol-3-yl]-2-(2-methoxyphenyl)- (delta mass: 39.018 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.209,"smiles":null,"spectrum_id":"CCMSLIB00017286523","spectrum_index":36940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(Leu-Pro) (delta mass: 45.9552 Da; putative annotation: N/A; putative formula: O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.099,"smiles":null,"spectrum_id":"CCMSLIB00017286526","spectrum_index":36941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 48.0459 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.341,"smiles":null,"spectrum_id":"CCMSLIB00017286529","spectrum_index":36942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 134.1101 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.386,"smiles":null,"spectrum_id":"CCMSLIB00017286532","spectrum_index":36943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 41.0258 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.154,"smiles":null,"spectrum_id":"CCMSLIB00017286533","spectrum_index":36944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 228.0298 Da; putative annotation: N/A; putative formula: C11N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.095,"smiles":null,"spectrum_id":"CCMSLIB00017286536","spectrum_index":36945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 162.0525 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.181,"smiles":null,"spectrum_id":"CCMSLIB00017286539","spectrum_index":36946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 2.0158 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.076,"smiles":null,"spectrum_id":"CCMSLIB00017286540","spectrum_index":36947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 34.9941 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.06,"smiles":null,"spectrum_id":"CCMSLIB00017286543","spectrum_index":36948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 150.2202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.311,"smiles":null,"spectrum_id":"CCMSLIB00017286546","spectrum_index":36949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017286549","spectrum_index":36950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 119.0374 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.103,"smiles":null,"spectrum_id":"CCMSLIB00017286550","spectrum_index":36951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 972.3978 Da; putative annotation: N/A; putative formula: C46H56N10O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1127.47,"smiles":null,"spectrum_id":"CCMSLIB00017286553","spectrum_index":36952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 388.1473 Da; putative annotation: N/A; putative formula: C18H29O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.245,"smiles":null,"spectrum_id":"CCMSLIB00017286555","spectrum_index":36953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 192.0876 Da; putative annotation: N/A; putative formula: C6H8N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.159,"smiles":null,"spectrum_id":"CCMSLIB00017286557","spectrum_index":36954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine 1-phosphate (delta mass: 369.1329 Da; putative annotation: N/A; putative formula: C11H25N5O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.186,"smiles":null,"spectrum_id":"CCMSLIB00017286560","spectrum_index":36955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 171.0533 Da; putative annotation: N/A; putative formula: C7H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.177,"smiles":null,"spectrum_id":"CCMSLIB00017286563","spectrum_index":36956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 50.9225 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.944,"smiles":null,"spectrum_id":"CCMSLIB00017286564","spectrum_index":36957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 63.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.109,"smiles":null,"spectrum_id":"CCMSLIB00017286567","spectrum_index":36958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 48.1471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.207,"smiles":null,"spectrum_id":"CCMSLIB00017286570","spectrum_index":36959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 331.1801 Da; putative annotation: N/A; putative formula: C20H21N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.266,"smiles":null,"spectrum_id":"CCMSLIB00017286571","spectrum_index":36960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 39.0676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.127,"smiles":null,"spectrum_id":"CCMSLIB00017286574","spectrum_index":36961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 61.0388 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.099,"smiles":null,"spectrum_id":"CCMSLIB00017286577","spectrum_index":36962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 51.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.175,"smiles":null,"spectrum_id":"CCMSLIB00017286578","spectrum_index":36963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 491.4011 Da; putative annotation: N/A; putative formula: C28H53N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.498,"smiles":null,"spectrum_id":"CCMSLIB00017286581","spectrum_index":36964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 294.1077 Da; putative annotation: N/A; putative formula: C11H14N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.284,"smiles":null,"spectrum_id":"CCMSLIB00017286582","spectrum_index":36965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00918 Demethoxycurcumin (delta mass: 217.0815 Da; putative annotation: N/A; putative formula: C6H11N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.204,"smiles":null,"spectrum_id":"CCMSLIB00017286585","spectrum_index":36966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zilpaterol (delta mass: 227.1136 Da; putative annotation: N/A; putative formula: C15H17NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.269,"smiles":null,"spectrum_id":"CCMSLIB00017286588","spectrum_index":36967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 194.1147 Da; putative annotation: N/A; putative formula: C5H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.169,"smiles":null,"spectrum_id":"CCMSLIB00017286590","spectrum_index":36968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 15.9264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.08,"smiles":null,"spectrum_id":"CCMSLIB00017286592","spectrum_index":36969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 629.3665 Da; putative annotation: N/A; putative formula: C31H43N13O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":818.515,"smiles":null,"spectrum_id":"CCMSLIB00017286595","spectrum_index":36970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 346.4456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.516,"smiles":null,"spectrum_id":"CCMSLIB00017286598","spectrum_index":36971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 42.0169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.087,"smiles":null,"spectrum_id":"CCMSLIB00017286601","spectrum_index":36972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000512 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 131.0694 Da; putative annotation: N/A; putative formula: C4H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.14,"smiles":null,"spectrum_id":"CCMSLIB00017286602","spectrum_index":36973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)acetamide (delta mass: 115.0266 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017286605","spectrum_index":36974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 90.0534 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.192,"smiles":null,"spectrum_id":"CCMSLIB00017286608","spectrum_index":36975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 75.1934 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.327,"smiles":null,"spectrum_id":"CCMSLIB00017286609","spectrum_index":36976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 58.0315 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.133,"smiles":null,"spectrum_id":"CCMSLIB00017286612","spectrum_index":36977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 138.0311 Da; putative annotation: N/A; putative formula: CH7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.144,"smiles":null,"spectrum_id":"CCMSLIB00017286614","spectrum_index":36978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MELATONIN - 20.0 eV (delta mass: 28.9949 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.123,"smiles":null,"spectrum_id":"CCMSLIB00017286616","spectrum_index":36979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 712.4197 Da; putative annotation: N/A; putative formula: C52H57P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":893.49,"smiles":null,"spectrum_id":"CCMSLIB00017286619","spectrum_index":36980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 533.2108 Da; putative annotation: N/A; putative formula: C21H23N15O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.323,"smiles":null,"spectrum_id":"CCMSLIB00017286621","spectrum_index":36981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 304.1426 Da; putative annotation: N/A; putative formula: C16H20N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.239,"smiles":null,"spectrum_id":"CCMSLIB00017286623","spectrum_index":36982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 639.224 Da; putative annotation: N/A; putative formula: C37H33N7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":820.265,"smiles":null,"spectrum_id":"CCMSLIB00017286626","spectrum_index":36983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 64.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.207,"smiles":null,"spectrum_id":"CCMSLIB00017286628","spectrum_index":36984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 44.0329 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.093,"smiles":null,"spectrum_id":"CCMSLIB00017286630","spectrum_index":36985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 791.2695 Da; putative annotation: N/A; putative formula: C30H49NO23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":954.33,"smiles":null,"spectrum_id":"CCMSLIB00017286633","spectrum_index":36986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 77.0455 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.15,"smiles":null,"spectrum_id":"CCMSLIB00017286635","spectrum_index":36987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-3-carboxylic acid (delta mass: 56.1352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.169,"smiles":null,"spectrum_id":"CCMSLIB00017286637","spectrum_index":36988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 240.1216 Da; putative annotation: N/A; putative formula: C12H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.218,"smiles":null,"spectrum_id":"CCMSLIB00017286640","spectrum_index":36989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 27.9867 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.146,"smiles":null,"spectrum_id":"CCMSLIB00017286642","spectrum_index":36990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 491.2155 Da; putative annotation: N/A; putative formula: C25H33NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.302,"smiles":null,"spectrum_id":"CCMSLIB00017286644","spectrum_index":36991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Pyrrole-2,5-dione, 3-(2,4-dichlorophenyl)-4-(1-methyl-1H-indol-3-yl)- (delta mass: 46.0094 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.044,"smiles":null,"spectrum_id":"CCMSLIB00017286647","spectrum_index":36992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 18.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.149,"smiles":null,"spectrum_id":"CCMSLIB00017286650","spectrum_index":36993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutaecarpine (delta mass: 145.0555 Da; putative annotation: N/A; putative formula: C6H11NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.169,"smiles":null,"spectrum_id":"CCMSLIB00017286652","spectrum_index":36994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 618.3706 Da; putative annotation: N/A; putative formula: C34H54N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.467,"smiles":null,"spectrum_id":"CCMSLIB00017286654","spectrum_index":36995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 468.3239 Da; putative annotation: N/A; putative formula: C30H44O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.5,"smiles":null,"spectrum_id":"CCMSLIB00017286657","spectrum_index":36996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 452.367 Da; putative annotation: N/A; putative formula: C24H48N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.438,"smiles":null,"spectrum_id":"CCMSLIB00017286659","spectrum_index":36997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 117.0821 Da; putative annotation: N/A; putative formula: C4H12N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.158,"smiles":null,"spectrum_id":"CCMSLIB00017286661","spectrum_index":36998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 132.0563 Da; putative annotation: N/A; putative formula: C3H9N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.164,"smiles":null,"spectrum_id":"CCMSLIB00017286664","spectrum_index":36999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 105.1027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.207,"smiles":null,"spectrum_id":"CCMSLIB00017286666","spectrum_index":37000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 439.2148 Da; putative annotation: N/A; putative formula: C29H29NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.312,"smiles":null,"spectrum_id":"CCMSLIB00017286668","spectrum_index":37001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 234.2688 Da; putative annotation: N/A; putative formula: C18H34O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.402,"smiles":null,"spectrum_id":"CCMSLIB00017286671","spectrum_index":37002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 18.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.149,"smiles":null,"spectrum_id":"CCMSLIB00017286674","spectrum_index":37003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Pro (delta mass: 41.0356 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.149,"smiles":null,"spectrum_id":"CCMSLIB00017286675","spectrum_index":37004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thelephoric acid (delta mass: 127.0857 Da; putative annotation: N/A; putative formula: C4H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.115,"smiles":null,"spectrum_id":"CCMSLIB00017286678","spectrum_index":37005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 383.1938 Da; putative annotation: N/A; putative formula: C19H29NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.265,"smiles":null,"spectrum_id":"CCMSLIB00017286681","spectrum_index":37006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 397.1362 Da; putative annotation: N/A; putative formula: C23H19N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.207,"smiles":null,"spectrum_id":"CCMSLIB00017286683","spectrum_index":37007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 831.3003 Da; putative annotation: N/A; putative formula: C46H45N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1053.4,"smiles":null,"spectrum_id":"CCMSLIB00017286685","spectrum_index":37008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 6.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.066,"smiles":null,"spectrum_id":"CCMSLIB00017286688","spectrum_index":37009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 174.0464 Da; putative annotation: N/A; putative formula: C6H10N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.138,"smiles":null,"spectrum_id":"CCMSLIB00017286691","spectrum_index":37010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 61.9435 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.03,"smiles":null,"spectrum_id":"CCMSLIB00017286694","spectrum_index":37011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 323.7871 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.858,"smiles":null,"spectrum_id":"CCMSLIB00017286697","spectrum_index":37012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 721.8429 Da; putative annotation: N/A; putative formula: C15H14O23S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.94,"smiles":null,"spectrum_id":"CCMSLIB00017286699","spectrum_index":37013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 204.0623 Da; putative annotation: N/A; putative formula: C12H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.211,"smiles":null,"spectrum_id":"CCMSLIB00017286701","spectrum_index":37014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-1H-pyrrole-2-carboxylic acid (delta mass: 36.0292 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.979,"smiles":null,"spectrum_id":"CCMSLIB00017286704","spectrum_index":37015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2,5-Dihydroxyhexyl)oxolan-2-one (delta mass: 161.1408 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.269,"smiles":null,"spectrum_id":"CCMSLIB00017286707","spectrum_index":37016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 339.2232 Da; putative annotation: N/A; putative formula: C19H33NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.283,"smiles":null,"spectrum_id":"CCMSLIB00017286710","spectrum_index":37017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 190.0995 Da; putative annotation: N/A; putative formula: C12H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.185,"smiles":null,"spectrum_id":"CCMSLIB00017286712","spectrum_index":37018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 42.0215 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.092,"smiles":null,"spectrum_id":"CCMSLIB00017286714","spectrum_index":37019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Val (delta mass: 87.0329 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.167,"smiles":null,"spectrum_id":"CCMSLIB00017286717","spectrum_index":37020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 115.0278 Da; putative annotation: N/A; putative formula: C5HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.177,"smiles":null,"spectrum_id":"CCMSLIB00017286720","spectrum_index":37021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 27.9166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.019,"smiles":null,"spectrum_id":"CCMSLIB00017286723","spectrum_index":37022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 1223.8571 Da; putative annotation: N/A; putative formula: C75H117NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1361.95,"smiles":null,"spectrum_id":"CCMSLIB00017286726","spectrum_index":37023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 344.1477 Da; putative annotation: N/A; putative formula: C19H25N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.292,"smiles":null,"spectrum_id":"CCMSLIB00017286728","spectrum_index":37024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 315.1217 Da; putative annotation: N/A; putative formula: C16H17N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.275,"smiles":null,"spectrum_id":"CCMSLIB00017286730","spectrum_index":37025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kasugamycin (delta mass: 67.0436 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.21,"smiles":null,"spectrum_id":"CCMSLIB00017286733","spectrum_index":37026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 66.0216 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.109,"smiles":null,"spectrum_id":"CCMSLIB00017286736","spectrum_index":37027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 46.0782 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.185,"smiles":null,"spectrum_id":"CCMSLIB00017286738","spectrum_index":37028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethyl L-glutamate (delta mass: 194.0482 Da; putative annotation: N/A; putative formula: C12H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.171,"smiles":null,"spectrum_id":"CCMSLIB00017286740","spectrum_index":37029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 64.0159 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.076,"smiles":null,"spectrum_id":"CCMSLIB00017286743","spectrum_index":37030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14,15-Dehydro-16-epi-vincamine (delta mass: 77.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.244,"smiles":null,"spectrum_id":"CCMSLIB00017286746","spectrum_index":37031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 90.0655 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.235,"smiles":null,"spectrum_id":"CCMSLIB00017286747","spectrum_index":37032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.117,"smiles":null,"spectrum_id":"CCMSLIB00017286750","spectrum_index":37033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 372.1316 Da; putative annotation: N/A; putative formula: C21H25O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.192,"smiles":null,"spectrum_id":"CCMSLIB00017286753","spectrum_index":37034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 223.0915 Da; putative annotation: N/A; putative formula: C15H14NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.15,"smiles":null,"spectrum_id":"CCMSLIB00017286755","spectrum_index":37035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 281.274 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.35,"smiles":null,"spectrum_id":"CCMSLIB00017286757","spectrum_index":37036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 125.0474 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.145,"smiles":null,"spectrum_id":"CCMSLIB00017286760","spectrum_index":37037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 300.1677 Da; putative annotation: N/A; putative formula: C16H29OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.337,"smiles":null,"spectrum_id":"CCMSLIB00017286763","spectrum_index":37038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140303 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 152.0473 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.144,"smiles":null,"spectrum_id":"CCMSLIB00017286765","spectrum_index":37039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(3-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]-, ethyl ester (delta mass: 60.0369 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.261,"smiles":null,"spectrum_id":"CCMSLIB00017286767","spectrum_index":37040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 366.9877 Da; putative annotation: N/A; putative formula: C9H10N3O9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.059,"smiles":null,"spectrum_id":"CCMSLIB00017286770","spectrum_index":37041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLPUTRESCINE (delta mass: 170.0935 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.211,"smiles":null,"spectrum_id":"CCMSLIB00017286772","spectrum_index":37042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 14.9989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017286774","spectrum_index":37043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-thiol (delta mass: 89.0522 Da; putative annotation: N/A; putative formula: C2H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.089,"smiles":null,"spectrum_id":"CCMSLIB00017286777","spectrum_index":37044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Pyrimidinylmethanol (delta mass: 46.0771 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.132,"smiles":null,"spectrum_id":"CCMSLIB00017286779","spectrum_index":37045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 218.0433 Da; putative annotation: N/A; putative formula: C11H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.145,"smiles":null,"spectrum_id":"CCMSLIB00017286781","spectrum_index":37046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 247.159 Da; putative annotation: N/A; putative formula: C14H22N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.256,"smiles":null,"spectrum_id":"CCMSLIB00017286784","spectrum_index":37047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 179.0795 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.166,"smiles":null,"spectrum_id":"CCMSLIB00017286786","spectrum_index":37048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 53.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.108,"smiles":null,"spectrum_id":"CCMSLIB00017286788","spectrum_index":37049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 309.1581 Da; putative annotation: N/A; putative formula: C9H23N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.229,"smiles":null,"spectrum_id":"CCMSLIB00017286791","spectrum_index":37050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 478.1909 Da; putative annotation: N/A; putative formula: C28H31O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.262,"smiles":null,"spectrum_id":"CCMSLIB00017286793","spectrum_index":37051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 218.0566 Da; putative annotation: N/A; putative formula: C6H11N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.132,"smiles":null,"spectrum_id":"CCMSLIB00017286795","spectrum_index":37052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 107.0363 Da; putative annotation: N/A; putative formula: H6N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.138,"smiles":null,"spectrum_id":"CCMSLIB00017286798","spectrum_index":37053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2,3-dimethyl-1H-indole (delta mass: 179.0183 Da; putative annotation: 2-Methoxy-4-nitrobenzoic acid; putative formula: C8H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.076,"smiles":null,"spectrum_id":"CCMSLIB00017286801","spectrum_index":37054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 127.0636 Da; putative annotation: N-Isobutyrylglycine; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.155,"smiles":null,"spectrum_id":"CCMSLIB00017286803","spectrum_index":37055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 120.0199 Da; putative annotation: Salicylic acid; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.08,"smiles":null,"spectrum_id":"CCMSLIB00017286805","spectrum_index":37056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 132.042 Da; putative annotation: D-Ribose; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.129,"smiles":null,"spectrum_id":"CCMSLIB00017286808","spectrum_index":37057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 202.0375 Da; putative annotation: (2,4-Dioxo-1,4-dihydro-3(2H)-quinazolinyl)acetic acid; putative formula: C10H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.113,"smiles":null,"spectrum_id":"CCMSLIB00017286811","spectrum_index":37058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 238.2299 Da; putative annotation: 2-Methylpentadecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.29,"smiles":null,"spectrum_id":"CCMSLIB00017286812","spectrum_index":37059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 102.0297 Da; putative annotation: L-(+)-Threose; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017286815","spectrum_index":37060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 98.074 Da; putative annotation: Diethylacetic acid; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.145,"smiles":null,"spectrum_id":"CCMSLIB00017286817","spectrum_index":37061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 113.8095 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.89,"smiles":null,"spectrum_id":"CCMSLIB00017286819","spectrum_index":37062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 66.0103 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.123,"smiles":null,"spectrum_id":"CCMSLIB00017286822","spectrum_index":37063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 86.0515 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.175,"smiles":null,"spectrum_id":"CCMSLIB00017286825","spectrum_index":37064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 170.1055 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.245,"smiles":null,"spectrum_id":"CCMSLIB00017286826","spectrum_index":37065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methylphenyl)-1H-indole (delta mass: 197.0423 Da; putative annotation: N/A; putative formula: C9H12NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.154,"smiles":null,"spectrum_id":"CCMSLIB00017286829","spectrum_index":37066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 92.0228 Da; putative annotation: N/A; putative formula: CH4N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.119,"smiles":null,"spectrum_id":"CCMSLIB00017286832","spectrum_index":37067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 246.0916 Da; putative annotation: N/A; putative formula: C13H15N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.245,"smiles":null,"spectrum_id":"CCMSLIB00017286833","spectrum_index":37068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 234.1115 Da; putative annotation: N/A; putative formula: C11H14N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.26,"smiles":null,"spectrum_id":"CCMSLIB00017286836","spectrum_index":37069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 56.0013 Da; putative annotation: N/A; putative formula: CN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.072,"smiles":null,"spectrum_id":"CCMSLIB00017286839","spectrum_index":37070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 110.0516 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.175,"smiles":null,"spectrum_id":"CCMSLIB00017286842","spectrum_index":37071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 14.0075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.053,"smiles":null,"spectrum_id":"CCMSLIB00017286843","spectrum_index":37072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 45.0287 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.136,"smiles":null,"spectrum_id":"CCMSLIB00017286846","spectrum_index":37073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1179.7722 Da; putative annotation: N/A; putative formula: C80H109NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1401.87,"smiles":null,"spectrum_id":"CCMSLIB00017286847","spectrum_index":37074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 248.0475 Da; putative annotation: N/A; putative formula: C14H7F3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.118,"smiles":null,"spectrum_id":"CCMSLIB00017286850","spectrum_index":37075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HNQ:db (delta mass: 286.0834 Da; putative annotation: N/A; putative formula: C8H18N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.269,"smiles":null,"spectrum_id":"CCMSLIB00017286853","spectrum_index":37076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 708.39 Da; putative annotation: N/A; putative formula: C43H48N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1037.58,"smiles":null,"spectrum_id":"CCMSLIB00017286854","spectrum_index":37077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 238.248 Da; putative annotation: N/A; putative formula: C14H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.334,"smiles":null,"spectrum_id":"CCMSLIB00017286857","spectrum_index":37078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Chlorobenzyl)-2-(1H-indol-3-yl)ethanamine (delta mass: 144.0168 Da; putative annotation: N/A; putative formula: C4H4N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.132,"smiles":null,"spectrum_id":"CCMSLIB00017286860","spectrum_index":37079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4-(Difluoromethoxy)-3-methoxyphenyl]methanamine (delta mass: 65.0303 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.113,"smiles":null,"spectrum_id":"CCMSLIB00017286861","spectrum_index":37080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 140.0986 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.164,"smiles":null,"spectrum_id":"CCMSLIB00017286864","spectrum_index":37081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 279.1581 Da; putative annotation: N/A; putative formula: C14H21N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.244,"smiles":null,"spectrum_id":"CCMSLIB00017286867","spectrum_index":37082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 27.0059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.083,"smiles":null,"spectrum_id":"CCMSLIB00017286868","spectrum_index":37083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Chloro-1-octanol (delta mass: 48.0436 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.148,"smiles":null,"spectrum_id":"CCMSLIB00017286871","spectrum_index":37084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam A (delta mass: 49.0983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.18,"smiles":null,"spectrum_id":"CCMSLIB00017286872","spectrum_index":37085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 13.9896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.078,"smiles":null,"spectrum_id":"CCMSLIB00017286875","spectrum_index":37086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 396.0773 Da; putative annotation: N/A; putative formula: C12H20N4O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.158,"smiles":null,"spectrum_id":"CCMSLIB00017286878","spectrum_index":37087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 252.3523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.464,"smiles":null,"spectrum_id":"CCMSLIB00017286879","spectrum_index":37088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 268.1371 Da; putative annotation: N/A; putative formula: C12H22N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.186,"smiles":null,"spectrum_id":"CCMSLIB00017286882","spectrum_index":37089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 42.1504 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.32,"smiles":null,"spectrum_id":"CCMSLIB00017286885","spectrum_index":37090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 130.0848 Da; putative annotation: N/A; putative formula: C4H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.38,"smiles":null,"spectrum_id":"CCMSLIB00017286886","spectrum_index":37091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 348.2154 Da; putative annotation: N/A; putative formula: C18H36O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.281,"smiles":null,"spectrum_id":"CCMSLIB00017286889","spectrum_index":37092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 141.0796 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.197,"smiles":null,"spectrum_id":"CCMSLIB00017286890","spectrum_index":37093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 197.0843 Da; putative annotation: N/A; putative formula: C13H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.254,"smiles":null,"spectrum_id":"CCMSLIB00017286893","spectrum_index":37094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 249.6303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.717,"smiles":null,"spectrum_id":"CCMSLIB00017286895","spectrum_index":37095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311116 Di-dihydrocaffeoyl spermidine (delta mass: 471.2352 Da; putative annotation: N/A; putative formula: C37H29NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.495,"smiles":null,"spectrum_id":"CCMSLIB00017286897","spectrum_index":37096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 214.0532 Da; putative annotation: N/A; putative formula: C15H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.15,"smiles":null,"spectrum_id":"CCMSLIB00017286900","spectrum_index":37097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:102040 (delta mass: 38.0505 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.146,"smiles":null,"spectrum_id":"CCMSLIB00017286902","spectrum_index":37098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosamine (delta mass: 224.537 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.634,"smiles":null,"spectrum_id":"CCMSLIB00017286904","spectrum_index":37099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.alpha.-Aminopimelic acid (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017286907","spectrum_index":37100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-butyric acid CollisionEnergy:102040 (delta mass: 44.0222 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.124,"smiles":null,"spectrum_id":"CCMSLIB00017286910","spectrum_index":37101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 228.209 Da; putative annotation: N/A; putative formula: C14H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.29,"smiles":null,"spectrum_id":"CCMSLIB00017286911","spectrum_index":37102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 152.055 Da; putative annotation: N/A; putative formula: C2H8N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.173,"smiles":null,"spectrum_id":"CCMSLIB00017286914","spectrum_index":37103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 387.1682 Da; putative annotation: N/A; putative formula: C21H25NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.239,"smiles":null,"spectrum_id":"CCMSLIB00017286916","spectrum_index":37104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 61.9829 Da; putative annotation: N/A; putative formula: CH2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.251,"smiles":null,"spectrum_id":"CCMSLIB00017286918","spectrum_index":37105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 155.0952 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.187,"smiles":null,"spectrum_id":"CCMSLIB00017286921","spectrum_index":37106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 108.0326 Da; putative annotation: N/A; putative formula: C5H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.119,"smiles":null,"spectrum_id":"CCMSLIB00017286922","spectrum_index":37107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 114.1113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.25,"smiles":null,"spectrum_id":"CCMSLIB00017286925","spectrum_index":37108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 41.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017286928","spectrum_index":37109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 38.0165 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.155,"smiles":null,"spectrum_id":"CCMSLIB00017286929","spectrum_index":37110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 155.0947 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.207,"smiles":null,"spectrum_id":"CCMSLIB00017286932","spectrum_index":37111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 161.0834 Da; putative annotation: N/A; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.175,"smiles":null,"spectrum_id":"CCMSLIB00017286935","spectrum_index":37112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 120.0577 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.17,"smiles":null,"spectrum_id":"CCMSLIB00017286936","spectrum_index":37113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 288.0981 Da; putative annotation: N/A; putative formula: C13H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.163,"smiles":null,"spectrum_id":"CCMSLIB00017286939","spectrum_index":37114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 3.3879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.5,"smiles":null,"spectrum_id":"CCMSLIB00017286942","spectrum_index":37115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C8:0 (delta mass: 162.0524 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.244,"smiles":null,"spectrum_id":"CCMSLIB00017286943","spectrum_index":37116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Chloromethyl)-4-(hydroxymethyl)-2-methyl-3-pyridinol (delta mass: 30.9999 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.047,"smiles":null,"spectrum_id":"CCMSLIB00017286946","spectrum_index":37117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 241.2399 Da; putative annotation: N/A; putative formula: C15H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.311,"smiles":null,"spectrum_id":"CCMSLIB00017286949","spectrum_index":37118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-fluoro-1H-indole-2-carboxylate (delta mass: 42.0299 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.107,"smiles":null,"spectrum_id":"CCMSLIB00017286952","spectrum_index":37119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 100.031 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017286953","spectrum_index":37120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 220.1657 Da; putative annotation: N/A; putative formula: C15H24O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.314,"smiles":null,"spectrum_id":"CCMSLIB00017286956","spectrum_index":37121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 90.0413 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.117,"smiles":null,"spectrum_id":"CCMSLIB00017286959","spectrum_index":37122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:KO009109 Glucose_6-phosphate|Glucose 6-phosphate|D-Glucose 6-phosphate|Robison ester (delta mass: 438.1054 Da; putative annotation: N/A; putative formula: C24H23O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.142,"smiles":null,"spectrum_id":"CCMSLIB00017286960","spectrum_index":37123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 151.994 Da; putative annotation: N/A; putative formula: C7H6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.159,"smiles":null,"spectrum_id":"CCMSLIB00017286963","spectrum_index":37124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 10.0305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017286966","spectrum_index":37125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 146.073 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.117,"smiles":null,"spectrum_id":"CCMSLIB00017286969","spectrum_index":37126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 111.0682 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.155,"smiles":null,"spectrum_id":"CCMSLIB00017286972","spectrum_index":37127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 47.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.149,"smiles":null,"spectrum_id":"CCMSLIB00017286973","spectrum_index":37128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 277.2399 Da; putative annotation: N/A; putative formula: C18H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.363,"smiles":null,"spectrum_id":"CCMSLIB00017286976","spectrum_index":37129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 480.0298 Da; putative annotation: N/A; putative formula: C19H16N2O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.09,"smiles":null,"spectrum_id":"CCMSLIB00017286979","spectrum_index":37130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 114.0193 Da; putative annotation: N/A; putative formula: C2H2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.111,"smiles":null,"spectrum_id":"CCMSLIB00017286982","spectrum_index":37131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 73.1463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.211,"smiles":null,"spectrum_id":"CCMSLIB00017286984","spectrum_index":37132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Diaminotoluene (delta mass: 16.0304 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.122,"smiles":null,"spectrum_id":"CCMSLIB00017286986","spectrum_index":37133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.Phaeophorbide a (delta mass: 286.231 Da; putative annotation: N/A; putative formula: C13H30N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.507,"smiles":null,"spectrum_id":"CCMSLIB00017286989","spectrum_index":37134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 44.0349 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.21,"smiles":null,"spectrum_id":"CCMSLIB00017286992","spectrum_index":37135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 100.0675 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017286995","spectrum_index":37136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 62.0467 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.129,"smiles":null,"spectrum_id":"CCMSLIB00017286998","spectrum_index":37137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 100.063 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.144,"smiles":null,"spectrum_id":"CCMSLIB00017286999","spectrum_index":37138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 259.1689 Da; putative annotation: N/A; putative formula: C8H21N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.281,"smiles":null,"spectrum_id":"CCMSLIB00017287002","spectrum_index":37139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sarcosine ethyl ester (delta mass: 230.0899 Da; putative annotation: N/A; putative formula: C9H14N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.176,"smiles":null,"spectrum_id":"CCMSLIB00017287004","spectrum_index":37140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 162.1767 Da; putative annotation: N/A; putative formula: C13H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.263,"smiles":null,"spectrum_id":"CCMSLIB00017287006","spectrum_index":37141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 96.0081 Da; putative annotation: N/A; putative formula: C2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.11,"smiles":null,"spectrum_id":"CCMSLIB00017287009","spectrum_index":37142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[1-(3-Aminopropyl)-1H-indol-3-yl]-4-(1-methyl-1H-indol-3-yl)-1H-pyrrole-2,5-dione (delta mass: 17.0068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.188,"smiles":null,"spectrum_id":"CCMSLIB00017287012","spectrum_index":37143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 79.038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.14,"smiles":null,"spectrum_id":"CCMSLIB00017287014","spectrum_index":37144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 224.1983 Da; putative annotation: N/A; putative formula: C12H24N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.285,"smiles":null,"spectrum_id":"CCMSLIB00017287016","spectrum_index":37145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 137.0632 Da; putative annotation: N/A; putative formula: C11H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.144,"smiles":null,"spectrum_id":"CCMSLIB00017287019","spectrum_index":37146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 190.0768 Da; putative annotation: N/A; putative formula: C9H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.194,"smiles":null,"spectrum_id":"CCMSLIB00017287022","spectrum_index":37147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 655.5687 Da; putative annotation: N/A; putative formula: C46H73NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":841.64,"smiles":null,"spectrum_id":"CCMSLIB00017287024","spectrum_index":37148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 1195.4812 Da; putative annotation: N/A; putative formula: C67H70N7O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1350.55,"smiles":null,"spectrum_id":"CCMSLIB00017287026","spectrum_index":37149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 160.0841 Da; putative annotation: N/A; putative formula: C8H17O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017287029","spectrum_index":37150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 137.0476 Da; putative annotation: N/A; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017287032","spectrum_index":37151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 55.0551 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.132,"smiles":null,"spectrum_id":"CCMSLIB00017287033","spectrum_index":37152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 204.1545 Da; putative annotation: N/A; putative formula: C7H20N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.233,"smiles":null,"spectrum_id":"CCMSLIB00017287036","spectrum_index":37153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 69.0488 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.099,"smiles":null,"spectrum_id":"CCMSLIB00017287039","spectrum_index":37154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 41.0271 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.103,"smiles":null,"spectrum_id":"CCMSLIB00017287041","spectrum_index":37155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Leu (delta mass: 95.0339 Da; putative annotation: N/A; putative formula: CHN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.195,"smiles":null,"spectrum_id":"CCMSLIB00017287044","spectrum_index":37156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 295.2874 Da; putative annotation: N/A; putative formula: C19H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.399,"smiles":null,"spectrum_id":"CCMSLIB00017287047","spectrum_index":37157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 64.015 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.095,"smiles":null,"spectrum_id":"CCMSLIB00017287049","spectrum_index":37158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 59.0563 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.137,"smiles":null,"spectrum_id":"CCMSLIB00017287052","spectrum_index":37159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 152.1221 Da; putative annotation: N/A; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.182,"smiles":null,"spectrum_id":"CCMSLIB00017287054","spectrum_index":37160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 355.309 Da; putative annotation: N/A; putative formula: C21H41NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.346,"smiles":null,"spectrum_id":"CCMSLIB00017287056","spectrum_index":37161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 23.9989 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.059,"smiles":null,"spectrum_id":"CCMSLIB00017287059","spectrum_index":37162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 158.0329 Da; putative annotation: N/A; putative formula: C5H6N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.114,"smiles":null,"spectrum_id":"CCMSLIB00017287061","spectrum_index":37163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-methoxyphenyl)propylamine CollisionEnergy:205060 (delta mass: 70.042 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.165,"smiles":null,"spectrum_id":"CCMSLIB00017287063","spectrum_index":37164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 403.1479 Da; putative annotation: N/A; putative formula: C17H25NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.261,"smiles":null,"spectrum_id":"CCMSLIB00017287066","spectrum_index":37165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 214.1333 Da; putative annotation: N/A; putative formula: C10H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.288,"smiles":null,"spectrum_id":"CCMSLIB00017287069","spectrum_index":37166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 142.0791 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.219,"smiles":null,"spectrum_id":"CCMSLIB00017287071","spectrum_index":37167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 120.0428 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.192,"smiles":null,"spectrum_id":"CCMSLIB00017287073","spectrum_index":37168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 123.0733 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.149,"smiles":null,"spectrum_id":"CCMSLIB00017287076","spectrum_index":37169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.139,"smiles":null,"spectrum_id":"CCMSLIB00017287079","spectrum_index":37170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 118.0646 Da; putative annotation: N/A; putative formula: C6H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.204,"smiles":null,"spectrum_id":"CCMSLIB00017287080","spectrum_index":37171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 163.0514 Da; putative annotation: N/A; putative formula: C4H10N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017287083","spectrum_index":37172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 185.1177 Da; putative annotation: N/A; putative formula: C8H15N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.225,"smiles":null,"spectrum_id":"CCMSLIB00017287086","spectrum_index":37173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 267.3209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.433,"smiles":null,"spectrum_id":"CCMSLIB00017287088","spectrum_index":37174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 257.1984 Da; putative annotation: N/A; putative formula: C14H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.347,"smiles":null,"spectrum_id":"CCMSLIB00017287090","spectrum_index":37175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 92.0267 Da; putative annotation: N/A; putative formula: C6H4O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.082,"smiles":null,"spectrum_id":"CCMSLIB00017287093","spectrum_index":37176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 57.0655 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.162,"smiles":null,"spectrum_id":"CCMSLIB00017287095","spectrum_index":37177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 66.7254 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.764,"smiles":null,"spectrum_id":"CCMSLIB00017287097","spectrum_index":37178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Thienyl)-1H-imidazole (delta mass: 28.0011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.033,"smiles":null,"spectrum_id":"CCMSLIB00017287100","spectrum_index":37179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 25.0178 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.077,"smiles":null,"spectrum_id":"CCMSLIB00017287102","spectrum_index":37180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 440.2624 Da; putative annotation: N/A; putative formula: C20H40O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.411,"smiles":null,"spectrum_id":"CCMSLIB00017287104","spectrum_index":37181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 294.2555 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.305,"smiles":null,"spectrum_id":"CCMSLIB00017287107","spectrum_index":37182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 373.1585 Da; putative annotation: N/A; putative formula: C18H25N5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.229,"smiles":null,"spectrum_id":"CCMSLIB00017287109","spectrum_index":37183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 348.2133 Da; putative annotation: N/A; putative formula: C14H24N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.372,"smiles":null,"spectrum_id":"CCMSLIB00017287111","spectrum_index":37184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 283.2859 Da; putative annotation: N/A; putative formula: C14H33N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.409,"smiles":null,"spectrum_id":"CCMSLIB00017287114","spectrum_index":37185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 207.0158 Da; putative annotation: N/A; putative formula: C9H5NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.118,"smiles":null,"spectrum_id":"CCMSLIB00017287116","spectrum_index":37186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 35.0394 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.118,"smiles":null,"spectrum_id":"CCMSLIB00017287118","spectrum_index":37187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 40.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.195,"smiles":null,"spectrum_id":"CCMSLIB00017287121","spectrum_index":37188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 928.4666 Da; putative annotation: N/A; putative formula: C44H60N14O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1135.55,"smiles":null,"spectrum_id":"CCMSLIB00017287124","spectrum_index":37189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 117.0762 Da; putative annotation: N/A; putative formula: CH7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.173,"smiles":null,"spectrum_id":"CCMSLIB00017287125","spectrum_index":37190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 4.1015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.271,"smiles":null,"spectrum_id":"CCMSLIB00017287128","spectrum_index":37191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 150.0645 Da; putative annotation: N/A; putative formula: C4H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.145,"smiles":null,"spectrum_id":"CCMSLIB00017287131","spectrum_index":37192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mycophenolic acid IV (delta mass: 348.1909 Da; putative annotation: N/A; putative formula: C16H24N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.387,"smiles":null,"spectrum_id":"CCMSLIB00017287134","spectrum_index":37193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 603.3454 Da; putative annotation: N/A; putative formula: C31H49N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.494,"smiles":null,"spectrum_id":"CCMSLIB00017287137","spectrum_index":37194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 510.0949 Da; putative annotation: N/A; putative formula: C24H23N4O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.166,"smiles":null,"spectrum_id":"CCMSLIB00017287138","spectrum_index":37195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 416.0751 Da; putative annotation: N/A; putative formula: C12H22N2O10P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.172,"smiles":null,"spectrum_id":"CCMSLIB00017287141","spectrum_index":37196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 287.167 Da; putative annotation: N/A; putative formula: C13H25N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.265,"smiles":null,"spectrum_id":"CCMSLIB00017287144","spectrum_index":37197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 529.3801 Da; putative annotation: N/A; putative formula: C29H55NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.451,"smiles":null,"spectrum_id":"CCMSLIB00017287147","spectrum_index":37198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 44.0132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.115,"smiles":null,"spectrum_id":"CCMSLIB00017287148","spectrum_index":37199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 114.0113 Da; putative annotation: N/A; putative formula: CH2N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.052,"smiles":null,"spectrum_id":"CCMSLIB00017287151","spectrum_index":37200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 592.4488 Da; putative annotation: N/A; putative formula: C39H60O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":935.572,"smiles":null,"spectrum_id":"CCMSLIB00017287154","spectrum_index":37201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 190.1204 Da; putative annotation: N/A; putative formula: C9H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.3,"smiles":null,"spectrum_id":"CCMSLIB00017287157","spectrum_index":37202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 164.0472 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.144,"smiles":null,"spectrum_id":"CCMSLIB00017287158","spectrum_index":37203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 163.1207 Da; putative annotation: N/A; putative formula: C8H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.207,"smiles":null,"spectrum_id":"CCMSLIB00017287161","spectrum_index":37204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 143.0079 Da; putative annotation: N/A; putative formula: C2HN5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.13,"smiles":null,"spectrum_id":"CCMSLIB00017287164","spectrum_index":37205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 158.0565 Da; putative annotation: N/A; putative formula: C11H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.226,"smiles":null,"spectrum_id":"CCMSLIB00017287166","spectrum_index":37206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 138.0759 Da; putative annotation: N/A; putative formula: C3H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.371,"smiles":null,"spectrum_id":"CCMSLIB00017287168","spectrum_index":37207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 71.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.255,"smiles":null,"spectrum_id":"CCMSLIB00017287171","spectrum_index":37208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.097,"smiles":null,"spectrum_id":"CCMSLIB00017287174","spectrum_index":37209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-3-pyridazinol (delta mass: 42.009 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.064,"smiles":null,"spectrum_id":"CCMSLIB00017287177","spectrum_index":37210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 507.2426 Da; putative annotation: N/A; putative formula: C21H37N3O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.313,"smiles":null,"spectrum_id":"CCMSLIB00017287179","spectrum_index":37211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1103.5593 Da; putative annotation: N/A; putative formula: C61H73N11O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1296.63,"smiles":null,"spectrum_id":"CCMSLIB00017287181","spectrum_index":37212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 15.023 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.188,"smiles":null,"spectrum_id":"CCMSLIB00017287186","spectrum_index":37213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 369.2734 Da; putative annotation: N/A; putative formula: C18H35N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.422,"smiles":null,"spectrum_id":"CCMSLIB00017287187","spectrum_index":37214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 11.0652 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.178,"smiles":null,"spectrum_id":"CCMSLIB00017287190","spectrum_index":37215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 58.9659 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.053,"smiles":null,"spectrum_id":"CCMSLIB00017287193","spectrum_index":37216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 50.054 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.12,"smiles":null,"spectrum_id":"CCMSLIB00017287196","spectrum_index":37217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 167.1033 Da; putative annotation: N/A; putative formula: C4H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.2,"smiles":null,"spectrum_id":"CCMSLIB00017287199","spectrum_index":37218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 190.0829 Da; putative annotation: N/A; putative formula: C5H6N10O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.153,"smiles":null,"spectrum_id":"CCMSLIB00017287200","spectrum_index":37219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Lys (delta mass: 163.0643 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.246,"smiles":null,"spectrum_id":"CCMSLIB00017287203","spectrum_index":37220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 76.031 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017287206","spectrum_index":37221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 785.5863 Da; putative annotation: N/A; putative formula: C53H75N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.735,"smiles":null,"spectrum_id":"CCMSLIB00017287209","spectrum_index":37222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 75.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.227,"smiles":null,"spectrum_id":"CCMSLIB00017287211","spectrum_index":37223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 113.034 Da; putative annotation: N/A; putative formula: C2H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.099,"smiles":null,"spectrum_id":"CCMSLIB00017287213","spectrum_index":37224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 81.0423 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.054,"smiles":null,"spectrum_id":"CCMSLIB00017287216","spectrum_index":37225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 306.0954 Da; putative annotation: N/A; putative formula: C15H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.197,"smiles":null,"spectrum_id":"CCMSLIB00017287218","spectrum_index":37226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Methoxycamptothecine (delta mass: 9.9839 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.113,"smiles":null,"spectrum_id":"CCMSLIB00017287221","spectrum_index":37227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 165.0283 Da; putative annotation: N/A; putative formula: C5H11NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.125,"smiles":null,"spectrum_id":"CCMSLIB00017287224","spectrum_index":37228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 87.0319 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.134,"smiles":null,"spectrum_id":"CCMSLIB00017287226","spectrum_index":37229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 70.0764 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.127,"smiles":null,"spectrum_id":"CCMSLIB00017287229","spectrum_index":37230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 215.0371 Da; putative annotation: N/A; putative formula: C15H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.1,"smiles":null,"spectrum_id":"CCMSLIB00017287232","spectrum_index":37231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sambutoxin (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.305,"smiles":null,"spectrum_id":"CCMSLIB00017287235","spectrum_index":37232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Caramboxin (delta mass: 41.0342 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.116,"smiles":null,"spectrum_id":"CCMSLIB00017287236","spectrum_index":37233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 173.0489 Da; putative annotation: N/A; putative formula: C3H7N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.151,"smiles":null,"spectrum_id":"CCMSLIB00017287239","spectrum_index":37234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 382.1093 Da; putative annotation: N/A; putative formula: C19H26O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.18,"smiles":null,"spectrum_id":"CCMSLIB00017287242","spectrum_index":37235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 264.0421 Da; putative annotation: N/A; putative formula: C16H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.166,"smiles":null,"spectrum_id":"CCMSLIB00017287245","spectrum_index":37236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 114.0093 Da; putative annotation: N/A; putative formula: C2H3N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.069,"smiles":null,"spectrum_id":"CCMSLIB00017287247","spectrum_index":37237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 99.0677 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.138,"smiles":null,"spectrum_id":"CCMSLIB00017287249","spectrum_index":37238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE10; MS2Dec (delta mass: 241.0488 Da; putative annotation: N/A; putative formula: C10H12NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.13,"smiles":null,"spectrum_id":"CCMSLIB00017287252","spectrum_index":37239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.beta.-Homoleucine (delta mass: 42.0111 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.129,"smiles":null,"spectrum_id":"CCMSLIB00017287255","spectrum_index":37240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 40.9766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.094,"smiles":null,"spectrum_id":"CCMSLIB00017287258","spectrum_index":37241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluorotryptamine (delta mass: 59.0456 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.143,"smiles":null,"spectrum_id":"CCMSLIB00017287260","spectrum_index":37242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 122.0731 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.16,"smiles":null,"spectrum_id":"CCMSLIB00017287262","spectrum_index":37243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 80.0517 Da; putative annotation: N/A; putative formula: C3H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.17,"smiles":null,"spectrum_id":"CCMSLIB00017287265","spectrum_index":37244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-1H-benzimidazole (delta mass: 64.0345 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.005,"smiles":null,"spectrum_id":"CCMSLIB00017287268","spectrum_index":37245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 324.2817 Da; putative annotation: N/A; putative formula: C24H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.342,"smiles":null,"spectrum_id":"CCMSLIB00017287269","spectrum_index":37246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 117.0425 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.113,"smiles":null,"spectrum_id":"CCMSLIB00017287272","spectrum_index":37247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbamazepine 10,11-epoxide (delta mass: 43.0056 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.103,"smiles":null,"spectrum_id":"CCMSLIB00017287275","spectrum_index":37248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 113.0798 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.182,"smiles":null,"spectrum_id":"CCMSLIB00017287277","spectrum_index":37249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 136.0377 Da; putative annotation: N/A; putative formula: C4H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.145,"smiles":null,"spectrum_id":"CCMSLIB00017287280","spectrum_index":37250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 176.0327 Da; putative annotation: N/A; putative formula: C7H12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.208,"smiles":null,"spectrum_id":"CCMSLIB00017287283","spectrum_index":37251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Ile (delta mass: 113.0841 Da; putative annotation: 2-Amino-2-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017287286","spectrum_index":37252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 136.0524 Da; putative annotation: (3,4-Dihydroxyphenyl)ethanol; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.139,"smiles":null,"spectrum_id":"CCMSLIB00017287288","spectrum_index":37253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Trp (delta mass: 186.08 Da; putative annotation: Massbank:RP000501 L-Tryptophan|(2S)-2-amino-3-(1H-indol-3-yl)propanoic acid; putative formula: C11H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.199,"smiles":null,"spectrum_id":"CCMSLIB00017287291","spectrum_index":37254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 151.0606 Da; putative annotation: Pyridoxine; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.1,"smiles":null,"spectrum_id":"CCMSLIB00017287294","spectrum_index":37255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 162.043 Da; putative annotation: Picolinuric acid; putative formula: C8H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.093,"smiles":null,"spectrum_id":"CCMSLIB00017287295","spectrum_index":37256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 109.992 Da; putative annotation: Massbank:EQ306602 4-Chlorophenol|4-chloranylphenol; putative formula: C6H3Cl)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.052,"smiles":null,"spectrum_id":"CCMSLIB00017287298","spectrum_index":37257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 358.287 Da; putative annotation: Massbank:RP007201 Isolithocholic acid|(4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid; putative formula: C24H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.421,"smiles":null,"spectrum_id":"CCMSLIB00017287301","spectrum_index":37258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 85.0533 Da; putative annotation: 2-Aminoisobutyric acid; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.093,"smiles":null,"spectrum_id":"CCMSLIB00017287304","spectrum_index":37259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 330.0944 Da; putative annotation: myo-Inositol 3,4,5,6-tetraacetate; putative formula: C14H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.165,"smiles":null,"spectrum_id":"CCMSLIB00017287307","spectrum_index":37260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 172.171 Da; putative annotation: N/A; putative formula: C8H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.274,"smiles":null,"spectrum_id":"CCMSLIB00017287310","spectrum_index":37261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Leu from NIST14 (delta mass: 113.0406 Da; putative annotation: N/A; putative formula: C4H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.19,"smiles":null,"spectrum_id":"CCMSLIB00017287311","spectrum_index":37262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 185.1048 Da; putative annotation: N/A; putative formula: C9H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.17,"smiles":null,"spectrum_id":"CCMSLIB00017287314","spectrum_index":37263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 498.267 Da; putative annotation: N/A; putative formula: C35H34N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.416,"smiles":null,"spectrum_id":"CCMSLIB00017287317","spectrum_index":37264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301587 Harmol (delta mass: 336.1281 Da; putative annotation: N/A; putative formula: C11H20N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.215,"smiles":null,"spectrum_id":"CCMSLIB00017287320","spectrum_index":37265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 213.0847 Da; putative annotation: N/A; putative formula: C9H16N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.218,"smiles":null,"spectrum_id":"CCMSLIB00017287321","spectrum_index":37266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 112.0671 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.191,"smiles":null,"spectrum_id":"CCMSLIB00017287324","spectrum_index":37267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 146.0574 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.211,"smiles":null,"spectrum_id":"CCMSLIB00017287327","spectrum_index":37268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimetidine amide (delta mass: 85.0733 Da; putative annotation: N/A; putative formula: C2H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.207,"smiles":null,"spectrum_id":"CCMSLIB00017287330","spectrum_index":37269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 407.152 Da; putative annotation: N/A; putative formula: C27H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.244,"smiles":null,"spectrum_id":"CCMSLIB00017287331","spectrum_index":37270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 359.2182 Da; putative annotation: N/A; putative formula: C16H25N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.277,"smiles":null,"spectrum_id":"CCMSLIB00017287334","spectrum_index":37271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 322.208 Da; putative annotation: N/A; putative formula: C18H30N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.273,"smiles":null,"spectrum_id":"CCMSLIB00017287337","spectrum_index":37272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 227.1527 Da; putative annotation: N/A; putative formula: C12H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.28,"smiles":null,"spectrum_id":"CCMSLIB00017287340","spectrum_index":37273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1042.5699 Da; putative annotation: N/A; putative formula: C50H78N10O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1385.69,"smiles":null,"spectrum_id":"CCMSLIB00017287343","spectrum_index":37274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine; AIF; CE30; MS2Dec (delta mass: 85.0312 Da; putative annotation: N/A; putative formula: C7H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.118,"smiles":null,"spectrum_id":"CCMSLIB00017287346","spectrum_index":37275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; CorrDec (delta mass: 95.0373 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.097,"smiles":null,"spectrum_id":"CCMSLIB00017287348","spectrum_index":37276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385408-01_C17H17N5O2_3-(1H-Imidazol-4-ylmethyl)-6-(1H-indol-3-ylmethyl)-2,5-piperazinedione (delta mass: 68.1445 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.29,"smiles":null,"spectrum_id":"CCMSLIB00017287351","spectrum_index":37277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 14.016 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.175,"smiles":null,"spectrum_id":"CCMSLIB00017287354","spectrum_index":37278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 331.3095 Da; putative annotation: N/A; putative formula: C20H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.458,"smiles":null,"spectrum_id":"CCMSLIB00017287357","spectrum_index":37279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311056 Glutamylphenylalanine (isomer of 1503) (delta mass: 115.0274 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.156,"smiles":null,"spectrum_id":"CCMSLIB00017287359","spectrum_index":37280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 172.0524 Da; putative annotation: N/A; putative formula: C11H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.112,"smiles":null,"spectrum_id":"CCMSLIB00017287362","spectrum_index":37281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 333.2907 Da; putative annotation: N/A; putative formula: C19H35N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.33,"smiles":null,"spectrum_id":"CCMSLIB00017287365","spectrum_index":37282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 285.115 Da; putative annotation: N/A; putative formula: C12H19N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.212,"smiles":null,"spectrum_id":"CCMSLIB00017287368","spectrum_index":37283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 324.2665 Da; putative annotation: N/A; putative formula: C20H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.342,"smiles":null,"spectrum_id":"CCMSLIB00017287370","spectrum_index":37284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 483.2208 Da; putative annotation: N/A; putative formula: C24H38NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.286,"smiles":null,"spectrum_id":"CCMSLIB00017287374","spectrum_index":37285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 53.0617 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.111,"smiles":null,"spectrum_id":"CCMSLIB00017287377","spectrum_index":37286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 37.0867 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.267,"smiles":null,"spectrum_id":"CCMSLIB00017287380","spectrum_index":37287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 240.1119 Da; putative annotation: N/A; putative formula: C12H20N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.271,"smiles":null,"spectrum_id":"CCMSLIB00017287383","spectrum_index":37288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 172.116 Da; putative annotation: N/A; putative formula: C7H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.255,"smiles":null,"spectrum_id":"CCMSLIB00017287386","spectrum_index":37289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 39.0547 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.172,"smiles":null,"spectrum_id":"CCMSLIB00017287388","spectrum_index":37290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 306.0934 Da; putative annotation: N/A; putative formula: C17H22O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":811.27,"smiles":null,"spectrum_id":"CCMSLIB00017287391","spectrum_index":37291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 58.0533 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.155,"smiles":null,"spectrum_id":"CCMSLIB00017287394","spectrum_index":37292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 72.0599 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.199,"smiles":null,"spectrum_id":"CCMSLIB00017287397","spectrum_index":37293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6H-2-Benzopyran-6-one, 5-chloro-3-(3,4-dihydroxy-3,5-dimethyl-1-hepten-1-yl)-7,8-dihydro-7,8-dihydroxy-7-methyl- (delta mass: 23.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.152,"smiles":null,"spectrum_id":"CCMSLIB00017287399","spectrum_index":37294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380084-01_C21H30O4_Benzo[b]cyclopenta[e]pyran-8(3H)-one, 3a,5,6,7,9,9a-hexahydro-7-hydroxy-1-[(4E)-6-hydroxy-1,5-dimethyl-4-hexen-1-yl]-3a-methyl- (delta mass: 42.0095 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.231,"smiles":null,"spectrum_id":"CCMSLIB00017287401","spectrum_index":37295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 206.0333 Da; putative annotation: N/A; putative formula: C10H10N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.06,"smiles":null,"spectrum_id":"CCMSLIB00017287404","spectrum_index":37296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 36.0122 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.166,"smiles":null,"spectrum_id":"CCMSLIB00017287407","spectrum_index":37297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 132.0637 Da; putative annotation: N/A; putative formula: C3H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.161,"smiles":null,"spectrum_id":"CCMSLIB00017287410","spectrum_index":37298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 31.9787 Da; putative annotation: N/A; putative formula: HP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017287411","spectrum_index":37299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 141.1041 Da; putative annotation: N/A; putative formula: C5H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.199,"smiles":null,"spectrum_id":"CCMSLIB00017287414","spectrum_index":37300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 181.3057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.366,"smiles":null,"spectrum_id":"CCMSLIB00017287417","spectrum_index":37301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 114.0314 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.102,"smiles":null,"spectrum_id":"CCMSLIB00017287420","spectrum_index":37302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 9.9846 Da; putative annotation: N/A; putative formula: C15H24N4O3S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.045,"smiles":null,"spectrum_id":"CCMSLIB00017287421","spectrum_index":37303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 138.0318 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.097,"smiles":null,"spectrum_id":"CCMSLIB00017287424","spectrum_index":37304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 101.063 Da; putative annotation: N/A; putative formula: C8H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017287427","spectrum_index":37305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 329.1288 Da; putative annotation: N/A; putative formula: C17H20N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.22,"smiles":null,"spectrum_id":"CCMSLIB00017287430","spectrum_index":37306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 42.0102 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.169,"smiles":null,"spectrum_id":"CCMSLIB00017287433","spectrum_index":37307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 208.1535 Da; putative annotation: N/A; putative formula: C8H16N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.276,"smiles":null,"spectrum_id":"CCMSLIB00017287435","spectrum_index":37308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1,2,3,4-tetrahydroquinoline (delta mass: 135.0354 Da; putative annotation: N/A; putative formula: C4H9NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.147,"smiles":null,"spectrum_id":"CCMSLIB00017287437","spectrum_index":37309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 92.0487 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.135,"smiles":null,"spectrum_id":"CCMSLIB00017287440","spectrum_index":37310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 29.0346 Da; putative annotation: N/A; putative formula: H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.121,"smiles":null,"spectrum_id":"CCMSLIB00017287443","spectrum_index":37311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 85.0243 Da; putative annotation: N/A; putative formula: C2H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.1,"smiles":null,"spectrum_id":"CCMSLIB00017287446","spectrum_index":37312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 64.0316 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.191,"smiles":null,"spectrum_id":"CCMSLIB00017287449","spectrum_index":37313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 797.6256 Da; putative annotation: N/A; putative formula: C44H79N9O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":986.774,"smiles":null,"spectrum_id":"CCMSLIB00017287452","spectrum_index":37314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 222.2359 Da; putative annotation: N/A; putative formula: C16H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.313,"smiles":null,"spectrum_id":"CCMSLIB00017287455","spectrum_index":37315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 129.0789 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017287458","spectrum_index":37316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 563.5415 Da; putative annotation: N/A; putative formula: C40H69N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.613,"smiles":null,"spectrum_id":"CCMSLIB00017287460","spectrum_index":37317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 130.1365 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.196,"smiles":null,"spectrum_id":"CCMSLIB00017287462","spectrum_index":37318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Thr-Arg (delta mass: 69.0588 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.31,"smiles":null,"spectrum_id":"CCMSLIB00017287465","spectrum_index":37319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 40.0309 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.091,"smiles":null,"spectrum_id":"CCMSLIB00017287468","spectrum_index":37320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 319.2353 Da; putative annotation: N/A; putative formula: C16H33NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.384,"smiles":null,"spectrum_id":"CCMSLIB00017287470","spectrum_index":37321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 93.0711 Da; putative annotation: N/A; putative formula: C5H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.114,"smiles":null,"spectrum_id":"CCMSLIB00017287473","spectrum_index":37322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 32.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.085,"smiles":null,"spectrum_id":"CCMSLIB00017287476","spectrum_index":37323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SODIUM D-GLUCONATE (delta mass: 101.0632 Da; putative annotation: N/A; putative formula: C8H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.129,"smiles":null,"spectrum_id":"CCMSLIB00017287479","spectrum_index":37324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 151.048 Da; putative annotation: N/A; putative formula: C4H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.16,"smiles":null,"spectrum_id":"CCMSLIB00017287481","spectrum_index":37325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 434.1046 Da; putative annotation: N/A; putative formula: C14H14N10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.228,"smiles":null,"spectrum_id":"CCMSLIB00017287484","spectrum_index":37326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 138.0721 Da; putative annotation: N/A; putative formula: C7H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.211,"smiles":null,"spectrum_id":"CCMSLIB00017287487","spectrum_index":37327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 719.8681 Da; putative annotation: N/A; putative formula: C22H12N10OS9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.938,"smiles":null,"spectrum_id":"CCMSLIB00017287491","spectrum_index":37328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 682.2971 Da; putative annotation: N/A; putative formula: C34H46N6O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":837.367,"smiles":null,"spectrum_id":"CCMSLIB00017287492","spectrum_index":37329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 156.1109 Da; putative annotation: N/A; putative formula: C5H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.218,"smiles":null,"spectrum_id":"CCMSLIB00017287495","spectrum_index":37330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 203.115 Da; putative annotation: N/A; putative formula: C9H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.301,"smiles":null,"spectrum_id":"CCMSLIB00017287498","spectrum_index":37331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 171.091 Da; putative annotation: N/A; putative formula: C9H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.245,"smiles":null,"spectrum_id":"CCMSLIB00017287501","spectrum_index":37332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 54.0474 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.129,"smiles":null,"spectrum_id":"CCMSLIB00017287503","spectrum_index":37333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 113.0254 Da; putative annotation: N/A; putative formula: C2H4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.179,"smiles":null,"spectrum_id":"CCMSLIB00017287506","spectrum_index":37334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 364.6747 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.761,"smiles":null,"spectrum_id":"CCMSLIB00017287508","spectrum_index":37335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 344.6844 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.771,"smiles":null,"spectrum_id":"CCMSLIB00017287511","spectrum_index":37336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 111.0681 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.143,"smiles":null,"spectrum_id":"CCMSLIB00017287514","spectrum_index":37337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(4-Fluorophenyl)-1H-indole (delta mass: 47.0671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.154,"smiles":null,"spectrum_id":"CCMSLIB00017287517","spectrum_index":37338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 156.1229 Da; putative annotation: N/A; putative formula: C4H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.222,"smiles":null,"spectrum_id":"CCMSLIB00017287520","spectrum_index":37339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 132.0425 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.129,"smiles":null,"spectrum_id":"CCMSLIB00017287522","spectrum_index":37340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 10.0092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017287524","spectrum_index":37341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 105.9007 Da; putative annotation: N/A; putative formula: CH-2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.961,"smiles":null,"spectrum_id":"CCMSLIB00017287527","spectrum_index":37342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 66.0107 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.086,"smiles":null,"spectrum_id":"CCMSLIB00017287530","spectrum_index":37343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 106.0781 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.154,"smiles":null,"spectrum_id":"CCMSLIB00017287532","spectrum_index":37344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 72.057 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017287534","spectrum_index":37345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 107.0947 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.15,"smiles":null,"spectrum_id":"CCMSLIB00017287537","spectrum_index":37346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 41.0328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.092,"smiles":null,"spectrum_id":"CCMSLIB00017287540","spectrum_index":37347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 96.0454 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.184,"smiles":null,"spectrum_id":"CCMSLIB00017287543","spectrum_index":37348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 168.0889 Da; putative annotation: N/A; putative formula: C8H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.17,"smiles":null,"spectrum_id":"CCMSLIB00017287546","spectrum_index":37349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 114.0425 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017287547","spectrum_index":37350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 55.0672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.154,"smiles":null,"spectrum_id":"CCMSLIB00017287550","spectrum_index":37351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 212.139 Da; putative annotation: N/A; putative formula: C8H16N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.22,"smiles":null,"spectrum_id":"CCMSLIB00017287553","spectrum_index":37352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 130.1446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.26,"smiles":null,"spectrum_id":"CCMSLIB00017287556","spectrum_index":37353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 317.1569 Da; putative annotation: N/A; putative formula: C25H19NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.264,"smiles":null,"spectrum_id":"CCMSLIB00017287557","spectrum_index":37354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 300.1576 Da; putative annotation: N/A; putative formula: C15H24O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.306,"smiles":null,"spectrum_id":"CCMSLIB00017287560","spectrum_index":37355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 162.049 Da; putative annotation: N/A; putative formula: C4H11N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.214,"smiles":null,"spectrum_id":"CCMSLIB00017287563","spectrum_index":37356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 911.4546 Da; putative annotation: N/A; putative formula: C63H61NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1118.54,"smiles":null,"spectrum_id":"CCMSLIB00017287566","spectrum_index":37357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Volinanserin (delta mass: 315.1667 Da; putative annotation: N/A; putative formula: C12H17N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.379,"smiles":null,"spectrum_id":"CCMSLIB00017287567","spectrum_index":37358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione (delta mass: 115.0396 Da; putative annotation: N/A; putative formula: C3H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.168,"smiles":null,"spectrum_id":"CCMSLIB00017287570","spectrum_index":37359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 114.5669 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.653,"smiles":null,"spectrum_id":"CCMSLIB00017287573","spectrum_index":37360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 559.3192 Da; putative annotation: N/A; putative formula: C29H45N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.468,"smiles":null,"spectrum_id":"CCMSLIB00017287576","spectrum_index":37361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 36.0384 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.14,"smiles":null,"spectrum_id":"CCMSLIB00017287577","spectrum_index":37362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 87.0275 Da; putative annotation: N/A; putative formula: C2H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.129,"smiles":null,"spectrum_id":"CCMSLIB00017287580","spectrum_index":37363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 132.0375 Da; putative annotation: N/A; putative formula: C4H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.14,"smiles":null,"spectrum_id":"CCMSLIB00017287583","spectrum_index":37364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 505.3244 Da; putative annotation: N/A; putative formula: C30H43N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.385,"smiles":null,"spectrum_id":"CCMSLIB00017287586","spectrum_index":37365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 75.0281 Da; putative annotation: N/A; putative formula: CH5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.126,"smiles":null,"spectrum_id":"CCMSLIB00017287587","spectrum_index":37366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 453.3653 Da; putative annotation: N/A; putative formula: C27H51NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.48,"smiles":null,"spectrum_id":"CCMSLIB00017287591","spectrum_index":37367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 61.0675 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.159,"smiles":null,"spectrum_id":"CCMSLIB00017287594","spectrum_index":37368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 18.0197 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.061,"smiles":null,"spectrum_id":"CCMSLIB00017287597","spectrum_index":37369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 27.9674 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.091,"smiles":null,"spectrum_id":"CCMSLIB00017287599","spectrum_index":37370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 92.0627 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017287602","spectrum_index":37371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 176.0418 Da; putative annotation: N/A; putative formula: C9H5FN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.191,"smiles":null,"spectrum_id":"CCMSLIB00017287605","spectrum_index":37372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 103.0517 Da; putative annotation: N/A; putative formula: C6H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.154,"smiles":null,"spectrum_id":"CCMSLIB00017287606","spectrum_index":37373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 479.1145 Da; putative annotation: N/A; putative formula: C16H25N5O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.212,"smiles":null,"spectrum_id":"CCMSLIB00017287609","spectrum_index":37374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 131.0912 Da; putative annotation: N/A; putative formula: C2H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.177,"smiles":null,"spectrum_id":"CCMSLIB00017287612","spectrum_index":37375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 119.0445 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.146,"smiles":null,"spectrum_id":"CCMSLIB00017287615","spectrum_index":37376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 36.0239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.163,"smiles":null,"spectrum_id":"CCMSLIB00017287616","spectrum_index":37377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 204.0417 Da; putative annotation: N/A; putative formula: C11H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.112,"smiles":null,"spectrum_id":"CCMSLIB00017287619","spectrum_index":37378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 198.0712 Da; putative annotation: N/A; putative formula: C2H10N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.21,"smiles":null,"spectrum_id":"CCMSLIB00017287622","spectrum_index":37379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine CollisionEnergy:102040 (delta mass: 344.2172 Da; putative annotation: N/A; putative formula: C14H28N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.314,"smiles":null,"spectrum_id":"CCMSLIB00017287625","spectrum_index":37380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 418.3053 Da; putative annotation: N/A; putative formula: C22H38N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.376,"smiles":null,"spectrum_id":"CCMSLIB00017287627","spectrum_index":37381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 12.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.174,"smiles":null,"spectrum_id":"CCMSLIB00017287629","spectrum_index":37382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1001.7137 Da; putative annotation: N/A; putative formula: C67H87N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1223.81,"smiles":null,"spectrum_id":"CCMSLIB00017287632","spectrum_index":37383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 237.1521 Da; putative annotation: N/A; putative formula: C17H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.233,"smiles":null,"spectrum_id":"CCMSLIB00017287635","spectrum_index":37384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 571.4074 Da; putative annotation: N/A; putative formula: C36H53N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.556,"smiles":null,"spectrum_id":"CCMSLIB00017287638","spectrum_index":37385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSAMINE (delta mass: 123.0474 Da; putative annotation: N/A; putative formula: C10H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017287639","spectrum_index":37386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 264.1574 Da; putative annotation: N/A; putative formula: C12H24O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.238,"smiles":null,"spectrum_id":"CCMSLIB00017287642","spectrum_index":37387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 180.0895 Da; putative annotation: N/A; putative formula: C9H12N2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.15,"smiles":null,"spectrum_id":"CCMSLIB00017287645","spectrum_index":37388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 80.028 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.109,"smiles":null,"spectrum_id":"CCMSLIB00017287648","spectrum_index":37389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 306.1757 Da; putative annotation: N/A; putative formula: C9H22N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.356,"smiles":null,"spectrum_id":"CCMSLIB00017287649","spectrum_index":37390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 541.3103 Da; putative annotation: N/A; putative formula: C24H47NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.459,"smiles":null,"spectrum_id":"CCMSLIB00017287652","spectrum_index":37391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 27.0118 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.098,"smiles":null,"spectrum_id":"CCMSLIB00017287655","spectrum_index":37392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.285,"smiles":null,"spectrum_id":"CCMSLIB00017287658","spectrum_index":37393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Piperazinediethanamine (delta mass: 86.0838 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.26,"smiles":null,"spectrum_id":"CCMSLIB00017287659","spectrum_index":37394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 145.1102 Da; putative annotation: N/A; putative formula: C7H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.254,"smiles":null,"spectrum_id":"CCMSLIB00017287662","spectrum_index":37395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 170.0656 Da; putative annotation: N/A; putative formula: C12H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.219,"smiles":null,"spectrum_id":"CCMSLIB00017287665","spectrum_index":37396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 27.064 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.156,"smiles":null,"spectrum_id":"CCMSLIB00017287668","spectrum_index":37397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 14.9992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.085,"smiles":null,"spectrum_id":"CCMSLIB00017287669","spectrum_index":37398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 193.1239 Da; putative annotation: N/A; putative formula: C15H15NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.21,"smiles":null,"spectrum_id":"CCMSLIB00017287672","spectrum_index":37399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 317.1863 Da; putative annotation: N/A; putative formula: C14H28N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.262,"smiles":null,"spectrum_id":"CCMSLIB00017287675","spectrum_index":37400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 162.068 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.197,"smiles":null,"spectrum_id":"CCMSLIB00017287678","spectrum_index":37401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 60.0 eV (delta mass: 80.026 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.102,"smiles":null,"spectrum_id":"CCMSLIB00017287679","spectrum_index":37402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 5.4182 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017287682","spectrum_index":37403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 62.0881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.148,"smiles":null,"spectrum_id":"CCMSLIB00017287685","spectrum_index":37404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 45.0666 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017287688","spectrum_index":37405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 155.1307 Da; putative annotation: N/A; putative formula: C9H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.211,"smiles":null,"spectrum_id":"CCMSLIB00017287689","spectrum_index":37406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 188.0793 Da; putative annotation: N/A; putative formula: C7H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.15,"smiles":null,"spectrum_id":"CCMSLIB00017287692","spectrum_index":37407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 71.0815 Da; putative annotation: N/A; putative formula: C3H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.147,"smiles":null,"spectrum_id":"CCMSLIB00017287695","spectrum_index":37408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 545.3414 Da; putative annotation: N/A; putative formula: C29H49N5OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":734.49,"smiles":null,"spectrum_id":"CCMSLIB00017287698","spectrum_index":37409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methylquinoline-2-carboxylic acid CollisionEnergy:205060 (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.097,"smiles":null,"spectrum_id":"CCMSLIB00017287700","spectrum_index":37410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 264.1053 Da; putative annotation: N/A; putative formula: C20H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.239,"smiles":null,"spectrum_id":"CCMSLIB00017287702","spectrum_index":37411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 96.0316 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.139,"smiles":null,"spectrum_id":"CCMSLIB00017287705","spectrum_index":37412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 280.1772 Da; putative annotation: N/A; putative formula: C9H25N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.332,"smiles":null,"spectrum_id":"CCMSLIB00017287708","spectrum_index":37413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 295.2621 Da; putative annotation: N/A; putative formula: C17H33N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.343,"smiles":null,"spectrum_id":"CCMSLIB00017287709","spectrum_index":37414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 63.0503 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.24,"smiles":null,"spectrum_id":"CCMSLIB00017287712","spectrum_index":37415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 80.0265 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.15,"smiles":null,"spectrum_id":"CCMSLIB00017287715","spectrum_index":37416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olodaterol (delta mass: 365.1978 Da; putative annotation: N/A; putative formula: C17H36NOPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.389,"smiles":null,"spectrum_id":"CCMSLIB00017287718","spectrum_index":37417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 184.1472 Da; putative annotation: N/A; putative formula: C11H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.228,"smiles":null,"spectrum_id":"CCMSLIB00017287721","spectrum_index":37418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 126.0308 Da; putative annotation: 3-Methyl-2-pentenedioic acid; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.102,"smiles":null,"spectrum_id":"CCMSLIB00017287722","spectrum_index":37419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 324.1055 Da; putative annotation: D-Turanose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.229,"smiles":null,"spectrum_id":"CCMSLIB00017287725","spectrum_index":37420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 88.0509 Da; putative annotation: Diethylene glycol; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017287728","spectrum_index":37421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 113.0841 Da; putative annotation: L-Leucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017287731","spectrum_index":37422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 143.0738 Da; putative annotation: 3-(2-Hydroxyethyl)indole; putative formula: C10H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.16,"smiles":null,"spectrum_id":"CCMSLIB00017287732","spectrum_index":37423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 146.0727 Da; putative annotation: Isoeugenol; putative formula: C10H10O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.133,"smiles":null,"spectrum_id":"CCMSLIB00017287735","spectrum_index":37424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 316.2406 Da; putative annotation: 5.beta.-Pregnane-3.alpha.,17-diol-20-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.364,"smiles":null,"spectrum_id":"CCMSLIB00017287738","spectrum_index":37425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 97.0508 Da; putative annotation: Pyrrolidine-3-carboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.132,"smiles":null,"spectrum_id":"CCMSLIB00017287739","spectrum_index":37426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 257.0463 Da; putative annotation: N/A; putative formula: C11H16NPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.148,"smiles":null,"spectrum_id":"CCMSLIB00017287742","spectrum_index":37427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 129.1699 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.25,"smiles":null,"spectrum_id":"CCMSLIB00017287745","spectrum_index":37428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 566.3677 Da; putative annotation: N/A; putative formula: C39H51OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.516,"smiles":null,"spectrum_id":"CCMSLIB00017287747","spectrum_index":37429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 24.0056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.117,"smiles":null,"spectrum_id":"CCMSLIB00017287749","spectrum_index":37430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 15.9892 Da; putative annotation: N/A; putative formula: HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.122,"smiles":null,"spectrum_id":"CCMSLIB00017287752","spectrum_index":37431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2,5-Dihydroxyhexyl)oxolan-2-one (delta mass: 31.0424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.17,"smiles":null,"spectrum_id":"CCMSLIB00017287755","spectrum_index":37432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 279.2573 Da; putative annotation: N/A; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.349,"smiles":null,"spectrum_id":"CCMSLIB00017287758","spectrum_index":37433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 53.0618 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.133,"smiles":null,"spectrum_id":"CCMSLIB00017287760","spectrum_index":37434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Corypalmine (delta mass: 17.07 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.24,"smiles":null,"spectrum_id":"CCMSLIB00017287762","spectrum_index":37435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 170.1059 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.177,"smiles":null,"spectrum_id":"CCMSLIB00017287765","spectrum_index":37436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isonicotinamide (delta mass: 14.961 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.016,"smiles":null,"spectrum_id":"CCMSLIB00017287768","spectrum_index":37437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 74.0359 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.096,"smiles":null,"spectrum_id":"CCMSLIB00017287771","spectrum_index":37438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 640.2199 Da; putative annotation: N/A; putative formula: C33H33N6O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":809.269,"smiles":null,"spectrum_id":"CCMSLIB00017287772","spectrum_index":37439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Asp (delta mass: 113.083 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.187,"smiles":null,"spectrum_id":"CCMSLIB00017287775","spectrum_index":37440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 73.054 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.187,"smiles":null,"spectrum_id":"CCMSLIB00017287778","spectrum_index":37441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 156.0306 Da; putative annotation: N/A; putative formula: C3H5N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.149,"smiles":null,"spectrum_id":"CCMSLIB00017287781","spectrum_index":37442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 126.0405 Da; putative annotation: N/A; putative formula: CH2N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.184,"smiles":null,"spectrum_id":"CCMSLIB00017287782","spectrum_index":37443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 132.0586 Da; putative annotation: N/A; putative formula: C2H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.213,"smiles":null,"spectrum_id":"CCMSLIB00017287785","spectrum_index":37444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 88.0198 Da; putative annotation: N/A; putative formula: C2H5N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.159,"smiles":null,"spectrum_id":"CCMSLIB00017287788","spectrum_index":37445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 62.0356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.185,"smiles":null,"spectrum_id":"CCMSLIB00017287791","spectrum_index":37446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 114.8597 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.946,"smiles":null,"spectrum_id":"CCMSLIB00017287792","spectrum_index":37447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 978.0505 Da; putative annotation: N/A; putative formula: C42H26N8O13S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1200.15,"smiles":null,"spectrum_id":"CCMSLIB00017287795","spectrum_index":37448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 30.9919 Da; putative annotation: N/A; putative formula: HNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.083,"smiles":null,"spectrum_id":"CCMSLIB00017287798","spectrum_index":37449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 583.2116 Da; putative annotation: N/A; putative formula: C37H33N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.272,"smiles":null,"spectrum_id":"CCMSLIB00017287800","spectrum_index":37450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 40.123 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.188,"smiles":null,"spectrum_id":"CCMSLIB00017287803","spectrum_index":37451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 49.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.093,"smiles":null,"spectrum_id":"CCMSLIB00017287806","spectrum_index":37452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.185,"smiles":null,"spectrum_id":"CCMSLIB00017287809","spectrum_index":37453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 564.2912 Da; putative annotation: N/A; putative formula: C34H44O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":744.393,"smiles":null,"spectrum_id":"CCMSLIB00017287812","spectrum_index":37454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 34.0309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.081,"smiles":null,"spectrum_id":"CCMSLIB00017287814","spectrum_index":37455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Pro from NIST14 (delta mass: 57.0208 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.123,"smiles":null,"spectrum_id":"CCMSLIB00017287817","spectrum_index":37456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 163.064 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.17,"smiles":null,"spectrum_id":"CCMSLIB00017287818","spectrum_index":37457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 100.1082 Da; putative annotation: N/A; putative formula: C4H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.245,"smiles":null,"spectrum_id":"CCMSLIB00017287821","spectrum_index":37458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 320.073 Da; putative annotation: N/A; putative formula: C16H18O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.165,"smiles":null,"spectrum_id":"CCMSLIB00017287824","spectrum_index":37459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1,9-dihydro-8-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-6H-purin-6-one (delta mass: 51.0671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.148,"smiles":null,"spectrum_id":"CCMSLIB00017287827","spectrum_index":37460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 148.0424 Da; putative annotation: N/A; putative formula: C11H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.123,"smiles":null,"spectrum_id":"CCMSLIB00017287828","spectrum_index":37461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 222.1607 Da; putative annotation: N/A; putative formula: C14H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.266,"smiles":null,"spectrum_id":"CCMSLIB00017287831","spectrum_index":37462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2,2,6,6-tetramethyl-4-[3-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]butyl]cyclohex-4-ene-1,3-dione (delta mass: 218.1309 Da; putative annotation: N/A; putative formula: C14H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.369,"smiles":null,"spectrum_id":"CCMSLIB00017287834","spectrum_index":37463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-7-methoxy-9H-pyrido[3,4-b]indol-8-yl)-2-methyl- (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.091,"smiles":null,"spectrum_id":"CCMSLIB00017287837","spectrum_index":37464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 88.0457 Da; putative annotation: N/A; putative formula: C3H8N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.106,"smiles":null,"spectrum_id":"CCMSLIB00017287838","spectrum_index":37465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381307-01!1-[2,4-dihydroxy-3-(2-hydroxyethyl)-6-methoxyphenyl]butan-1-one (delta mass: 163.0994 Da; putative annotation: N/A; putative formula: C10H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.222,"smiles":null,"spectrum_id":"CCMSLIB00017287841","spectrum_index":37466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bulbocapnine (delta mass: 133.0294 Da; putative annotation: N/A; putative formula: C4H8NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.168,"smiles":null,"spectrum_id":"CCMSLIB00017287844","spectrum_index":37467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 259.1488 Da; putative annotation: N/A; putative formula: C18H17N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.224,"smiles":null,"spectrum_id":"CCMSLIB00017287847","spectrum_index":37468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 34.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017287850","spectrum_index":37469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 110.0738 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.197,"smiles":null,"spectrum_id":"CCMSLIB00017287851","spectrum_index":37470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 181.0946 Da; putative annotation: N/A; putative formula: C3H7N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.196,"smiles":null,"spectrum_id":"CCMSLIB00017287854","spectrum_index":37471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 62.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.159,"smiles":null,"spectrum_id":"CCMSLIB00017287857","spectrum_index":37472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 214.6108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.702,"smiles":null,"spectrum_id":"CCMSLIB00017287859","spectrum_index":37473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 15.0232 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":125.083,"smiles":null,"spectrum_id":"CCMSLIB00017287861","spectrum_index":37474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 112.0255 Da; putative annotation: N/A; putative formula: N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.037,"smiles":null,"spectrum_id":"CCMSLIB00017287865","spectrum_index":37475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 104.0626 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.18,"smiles":null,"spectrum_id":"CCMSLIB00017287867","spectrum_index":37476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 15.0931 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.18,"smiles":null,"spectrum_id":"CCMSLIB00017287870","spectrum_index":37477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lactulose from NIST14 (delta mass: 288.2098 Da; putative annotation: N/A; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.333,"smiles":null,"spectrum_id":"CCMSLIB00017287873","spectrum_index":37478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 133.0525 Da; putative annotation: N/A; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.123,"smiles":null,"spectrum_id":"CCMSLIB00017287876","spectrum_index":37479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 421.2297 Da; putative annotation: N/A; putative formula: C16H27N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.3,"smiles":null,"spectrum_id":"CCMSLIB00017287877","spectrum_index":37480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 30.0 eV (delta mass: 972.3273 Da; putative annotation: N/A; putative formula: C46H48N14O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1315.45,"smiles":null,"spectrum_id":"CCMSLIB00017287880","spectrum_index":37481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM861001 Clozapine|3-chloro-6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine (delta mass: 17.0904 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017287883","spectrum_index":37482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 95.0374 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017287886","spectrum_index":37483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N',N''-Triacetylchitotriose (delta mass: 843.6036 Da; putative annotation: N/A; putative formula: C55H73N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1471.86,"smiles":null,"spectrum_id":"CCMSLIB00017287889","spectrum_index":37484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 196.1943 Da; putative annotation: N/A; putative formula: C12H24N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.306,"smiles":null,"spectrum_id":"CCMSLIB00017287891","spectrum_index":37485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 137.0318 Da; putative annotation: N/A; putative formula: C3H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.222,"smiles":null,"spectrum_id":"CCMSLIB00017287893","spectrum_index":37486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 62.0512 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017287896","spectrum_index":37487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 280.3013 Da; putative annotation: N/A; putative formula: C17H36N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":889.572,"smiles":null,"spectrum_id":"CCMSLIB00017287899","spectrum_index":37488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 506.2846 Da; putative annotation: N/A; putative formula: C24H46N2O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.355,"smiles":null,"spectrum_id":"CCMSLIB00017287902","spectrum_index":37489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 266.1905 Da; putative annotation: N/A; putative formula: C15H27N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.292,"smiles":null,"spectrum_id":"CCMSLIB00017287903","spectrum_index":37490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 41.0173 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.208,"smiles":null,"spectrum_id":"CCMSLIB00017287906","spectrum_index":37491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 118.028 Da; putative annotation: N/A; putative formula: C5H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.119,"smiles":null,"spectrum_id":"CCMSLIB00017287909","spectrum_index":37492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 74.0736 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.213,"smiles":null,"spectrum_id":"CCMSLIB00017287912","spectrum_index":37493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 304.2557 Da; putative annotation: N/A; putative formula: C24H32O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.316,"smiles":null,"spectrum_id":"CCMSLIB00017287913","spectrum_index":37494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 214.074 Da; putative annotation: N/A; putative formula: C12H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.208,"smiles":null,"spectrum_id":"CCMSLIB00017287916","spectrum_index":37495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 107.0584 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.139,"smiles":null,"spectrum_id":"CCMSLIB00017287919","spectrum_index":37496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 238.252 Da; putative annotation: N/A; putative formula: C14H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.331,"smiles":null,"spectrum_id":"CCMSLIB00017287922","spectrum_index":37497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 478.678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.764,"smiles":null,"spectrum_id":"CCMSLIB00017287925","spectrum_index":37498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 108.0416 Da; putative annotation: N/A; putative formula: C7H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017287926","spectrum_index":37499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; LC-tDDA; CE10 (delta mass: 368.2558 Da; putative annotation: N/A; putative formula: C21H36O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.353,"smiles":null,"spectrum_id":"CCMSLIB00017287929","spectrum_index":37500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 141.0193 Da; putative annotation: N/A; putative formula: C5H-1N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.272,"smiles":null,"spectrum_id":"CCMSLIB00017287932","spectrum_index":37501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 40.0381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.105,"smiles":null,"spectrum_id":"CCMSLIB00017287935","spectrum_index":37502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 124.0751 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.178,"smiles":null,"spectrum_id":"CCMSLIB00017287936","spectrum_index":37503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA283003 Naltrexone|(5alpha)-17-(Cyclopropylmethyl)-3,14-dihydroxy-4,5-epoxymorphinan-6-one (delta mass: 54.0276 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.198,"smiles":null,"spectrum_id":"CCMSLIB00017287939","spectrum_index":37504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 95.0736 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017287942","spectrum_index":37505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 74.0625 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.139,"smiles":null,"spectrum_id":"CCMSLIB00017287945","spectrum_index":37506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 82.05 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.13,"smiles":null,"spectrum_id":"CCMSLIB00017287946","spectrum_index":37507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 7.9873 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.068,"smiles":null,"spectrum_id":"CCMSLIB00017287949","spectrum_index":37508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 77.05 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.138,"smiles":null,"spectrum_id":"CCMSLIB00017287952","spectrum_index":37509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 78.0398 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.132,"smiles":null,"spectrum_id":"CCMSLIB00017287955","spectrum_index":37510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 359.2239 Da; putative annotation: N/A; putative formula: C19H30N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.336,"smiles":null,"spectrum_id":"CCMSLIB00017287956","spectrum_index":37511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 12.9994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.086,"smiles":null,"spectrum_id":"CCMSLIB00017287961","spectrum_index":37512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 155.0935 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.189,"smiles":null,"spectrum_id":"CCMSLIB00017287962","spectrum_index":37513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003358 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 187.1935 Da; putative annotation: N/A; putative formula: C7H21N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.233,"smiles":null,"spectrum_id":"CCMSLIB00017287965","spectrum_index":37514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 211.1054 Da; putative annotation: N/A; putative formula: C11H19NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.144,"smiles":null,"spectrum_id":"CCMSLIB00017287968","spectrum_index":37515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 234.1746 Da; putative annotation: N/A; putative formula: C14H22N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.25,"smiles":null,"spectrum_id":"CCMSLIB00017287969","spectrum_index":37516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100215 alpha-Methyl-DL-serine|DL-2-Methylserine|2-Amino-3-hydroxy-2-methylpropanoic Acid|DL-2-Amino-3-hydroxy-2-methylpropionic Acid|DL-alpha-(Hydroxymethyl)alanine|alpha-Methylserine (delta mass: 253.2395 Da; putative annotation: N/A; putative formula: C16H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.305,"smiles":null,"spectrum_id":"CCMSLIB00017287972","spectrum_index":37517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S)-4-hydroxy-2-(2-hydroxypropan-2-yl)-7-methyl-2,3-dihydrofuro[3,2-g]chromen-5-one (delta mass: 179.0798 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.187,"smiles":null,"spectrum_id":"CCMSLIB00017287975","spectrum_index":37518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Difenoxin (delta mass: 27.1143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.337,"smiles":null,"spectrum_id":"CCMSLIB00017287978","spectrum_index":37519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 98.0733 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.175,"smiles":null,"spectrum_id":"CCMSLIB00017287981","spectrum_index":37520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 290.1845 Da; putative annotation: N/A; putative formula: C15H33O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.245,"smiles":null,"spectrum_id":"CCMSLIB00017287982","spectrum_index":37521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 141.0361 Da; putative annotation: N/A; putative formula: C5H7N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.086,"smiles":null,"spectrum_id":"CCMSLIB00017287985","spectrum_index":37522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 78.0507 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.146,"smiles":null,"spectrum_id":"CCMSLIB00017287988","spectrum_index":37523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 113.0574 Da; putative annotation: N/A; putative formula: H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.155,"smiles":null,"spectrum_id":"CCMSLIB00017287991","spectrum_index":37524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 119.0583 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.235,"smiles":null,"spectrum_id":"CCMSLIB00017287992","spectrum_index":37525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 57.0554 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.168,"smiles":null,"spectrum_id":"CCMSLIB00017287995","spectrum_index":37526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 418.3056 Da; putative annotation: N/A; putative formula: C22H38N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.429,"smiles":null,"spectrum_id":"CCMSLIB00017287998","spectrum_index":37527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 340.216 Da; putative annotation: N/A; putative formula: C14H28N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.318,"smiles":null,"spectrum_id":"CCMSLIB00017288001","spectrum_index":37528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380167-01!3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015] (delta mass: 197.1053 Da; putative annotation: N/A; putative formula: C10H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.259,"smiles":null,"spectrum_id":"CCMSLIB00017288004","spectrum_index":37529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 367.1634 Da; putative annotation: N/A; putative formula: C21H26N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.224,"smiles":null,"spectrum_id":"CCMSLIB00017288005","spectrum_index":37530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 228.1159 Da; putative annotation: N/A; putative formula: C8H16N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.187,"smiles":null,"spectrum_id":"CCMSLIB00017288008","spectrum_index":37531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamyltyrosine (delta mass: 210.1995 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.323,"smiles":null,"spectrum_id":"CCMSLIB00017288011","spectrum_index":37532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNITOL - 60.0 eV (delta mass: 83.956 Da; putative annotation: N/A; putative formula: C3HO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.042,"smiles":null,"spectrum_id":"CCMSLIB00017288013","spectrum_index":37533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 17.0378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.14,"smiles":null,"spectrum_id":"CCMSLIB00017288016","spectrum_index":37534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 119.0501 Da; putative annotation: N/A; putative formula: C4H10NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.136,"smiles":null,"spectrum_id":"CCMSLIB00017288019","spectrum_index":37535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 487.4844 Da; putative annotation: N/A; putative formula: C32H61N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.593,"smiles":null,"spectrum_id":"CCMSLIB00017288021","spectrum_index":37536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 74.0324 Da; putative annotation: N/A; putative formula: C2H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.139,"smiles":null,"spectrum_id":"CCMSLIB00017288024","spectrum_index":37537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 41.0046 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.08,"smiles":null,"spectrum_id":"CCMSLIB00017288027","spectrum_index":37538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 211.1209 Da; putative annotation: N/A; putative formula: C11H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.197,"smiles":null,"spectrum_id":"CCMSLIB00017288028","spectrum_index":37539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 44.0414 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.128,"smiles":null,"spectrum_id":"CCMSLIB00017288031","spectrum_index":37540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 358.0061 Da; putative annotation: N/A; putative formula: C9H7N6O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":863.182,"smiles":null,"spectrum_id":"CCMSLIB00017288034","spectrum_index":37541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 109.0528 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.124,"smiles":null,"spectrum_id":"CCMSLIB00017288037","spectrum_index":37542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU128401 Methyldopa|(2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoic acid (delta mass: 194.0218 Da; putative annotation: N/A; putative formula: C9H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.113,"smiles":null,"spectrum_id":"CCMSLIB00017288040","spectrum_index":37543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 35.11 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.186,"smiles":null,"spectrum_id":"CCMSLIB00017288043","spectrum_index":37544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 187.0838 Da; putative annotation: N/A; putative formula: C8H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.155,"smiles":null,"spectrum_id":"CCMSLIB00017288045","spectrum_index":37545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-pentyl- (delta mass: 46.0051 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.138,"smiles":null,"spectrum_id":"CCMSLIB00017288048","spectrum_index":37546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Methoxybenzyl)(2-nitrophenyl)methanamine (delta mass: 28.0188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.142,"smiles":null,"spectrum_id":"CCMSLIB00017288051","spectrum_index":37547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 203.1917 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.314,"smiles":null,"spectrum_id":"CCMSLIB00017288053","spectrum_index":37548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Naphthyl)-1H-indole (delta mass: 59.047 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.159,"smiles":null,"spectrum_id":"CCMSLIB00017288056","spectrum_index":37549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 298.1201 Da; putative annotation: N/A; putative formula: C10H22N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.196,"smiles":null,"spectrum_id":"CCMSLIB00017288059","spectrum_index":37550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1003.6441 Da; putative annotation: N/A; putative formula: C50H81N15O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1225.74,"smiles":null,"spectrum_id":"CCMSLIB00017288060","spectrum_index":37551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 25.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017288063","spectrum_index":37552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 91.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017288066","spectrum_index":37553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 164.0377 Da; putative annotation: N/A; putative formula: C11H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.177,"smiles":null,"spectrum_id":"CCMSLIB00017288069","spectrum_index":37554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1258.6011 Da; putative annotation: N/A; putative formula: C62H102N10OS8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1451.67,"smiles":null,"spectrum_id":"CCMSLIB00017288070","spectrum_index":37555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Phenylalanine (delta mass: 50.0156 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.102,"smiles":null,"spectrum_id":"CCMSLIB00017288073","spectrum_index":37556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-pyruvic acid (delta mass: 75.0318 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.097,"smiles":null,"spectrum_id":"CCMSLIB00017288076","spectrum_index":37557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 222.1256 Da; putative annotation: N/A; putative formula: C13H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.196,"smiles":null,"spectrum_id":"CCMSLIB00017288079","spectrum_index":37558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 573.4373 Da; putative annotation: N/A; putative formula: C39H59NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.534,"smiles":null,"spectrum_id":"CCMSLIB00017288082","spectrum_index":37559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 96.9501 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.048,"smiles":null,"spectrum_id":"CCMSLIB00017288083","spectrum_index":37560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine hydrochloride (delta mass: 152.045 Da; putative annotation: N/A; putative formula: C4H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.124,"smiles":null,"spectrum_id":"CCMSLIB00017288086","spectrum_index":37561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 488.1902 Da; putative annotation: N/A; putative formula: C23H36O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.276,"smiles":null,"spectrum_id":"CCMSLIB00017288089","spectrum_index":37562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol CollisionEnergy:102040\"\" (delta mass: 41.0702 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.266,"smiles":null,"spectrum_id":"CCMSLIB00017288092","spectrum_index":37563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 640.7856 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":794.872,"smiles":null,"spectrum_id":"CCMSLIB00017288095","spectrum_index":37564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one (delta mass: 21.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.096,"smiles":null,"spectrum_id":"CCMSLIB00017288096","spectrum_index":37565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin Pr-LL (delta mass: 218.0714 Da; putative annotation: N/A; putative formula: C10H19O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.39,"smiles":null,"spectrum_id":"CCMSLIB00017288099","spectrum_index":37566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 169.081 Da; putative annotation: N/A; putative formula: C3H7N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.22,"smiles":null,"spectrum_id":"CCMSLIB00017288102","spectrum_index":37567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 497.4274 Da; putative annotation: N/A; putative formula: C23H51N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.581,"smiles":null,"spectrum_id":"CCMSLIB00017288104","spectrum_index":37568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 79.0421 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017288107","spectrum_index":37569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 18.0092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.148,"smiles":null,"spectrum_id":"CCMSLIB00017288109","spectrum_index":37570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 40.9038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.131,"smiles":null,"spectrum_id":"CCMSLIB00017288112","spectrum_index":37571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GALACTOSAMINE (delta mass: 102.9646 Da; putative annotation: N/A; putative formula: C2H2NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.051,"smiles":null,"spectrum_id":"CCMSLIB00017288115","spectrum_index":37572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 88.0696 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.312,"smiles":null,"spectrum_id":"CCMSLIB00017288117","spectrum_index":37573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 86.0528 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.181,"smiles":null,"spectrum_id":"CCMSLIB00017288119","spectrum_index":37574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 259.149 Da; putative annotation: N/A; putative formula: C16H22NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.209,"smiles":null,"spectrum_id":"CCMSLIB00017288122","spectrum_index":37575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 268.1245 Da; putative annotation: N/A; putative formula: C13H20N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.211,"smiles":null,"spectrum_id":"CCMSLIB00017288125","spectrum_index":37576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 478.176 Da; putative annotation: N/A; putative formula: C20H22N12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.273,"smiles":null,"spectrum_id":"CCMSLIB00017288128","spectrum_index":37577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 287.3158 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.387,"smiles":null,"spectrum_id":"CCMSLIB00017288130","spectrum_index":37578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl 2-(aminomethyl)phenylcarbamate (delta mass: 115.9933 Da; putative annotation: N/A; putative formula: C4H4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.137,"smiles":null,"spectrum_id":"CCMSLIB00017288132","spectrum_index":37579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 628.4008 Da; putative annotation: N/A; putative formula: C34H60O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.471,"smiles":null,"spectrum_id":"CCMSLIB00017288135","spectrum_index":37580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 185.1189 Da; putative annotation: N/A; putative formula: C7H16N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.221,"smiles":null,"spectrum_id":"CCMSLIB00017288138","spectrum_index":37581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CloxacillinNa (delta mass: 194.1158 Da; putative annotation: N/A; putative formula: C9H14N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.189,"smiles":null,"spectrum_id":"CCMSLIB00017288141","spectrum_index":37582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 615.4359 Da; putative annotation: N/A; putative formula: C34H57N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.584,"smiles":null,"spectrum_id":"CCMSLIB00017288143","spectrum_index":37583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 405.2513 Da; putative annotation: N/A; putative formula: C23H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.38,"smiles":null,"spectrum_id":"CCMSLIB00017288145","spectrum_index":37584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(4-Aminophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (delta mass: 211.0648 Da; putative annotation: N/A; putative formula: C6H9N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.135,"smiles":null,"spectrum_id":"CCMSLIB00017288148","spectrum_index":37585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 185.1048 Da; putative annotation: N/A; putative formula: C9H15NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.165,"smiles":null,"spectrum_id":"CCMSLIB00017288151","spectrum_index":37586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 382.2031 Da; putative annotation: N/A; putative formula: C20H27N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.331,"smiles":null,"spectrum_id":"CCMSLIB00017288154","spectrum_index":37587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE30; CorrDec (delta mass: 44.0983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":130.158,"smiles":null,"spectrum_id":"CCMSLIB00017288155","spectrum_index":37588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 82.0787 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.347,"smiles":null,"spectrum_id":"CCMSLIB00017288158","spectrum_index":37589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 585.3365 Da; putative annotation: N/A; putative formula: C32H43N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.485,"smiles":null,"spectrum_id":"CCMSLIB00017288161","spectrum_index":37590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 176.1077 Da; putative annotation: N/A; putative formula: C7H17N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.256,"smiles":null,"spectrum_id":"CCMSLIB00017288163","spectrum_index":37591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 87.0321 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.103,"smiles":null,"spectrum_id":"CCMSLIB00017288165","spectrum_index":37592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 30.9947 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017288168","spectrum_index":37593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 86.0524 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.305,"smiles":null,"spectrum_id":"CCMSLIB00017288171","spectrum_index":37594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 15.995 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.092,"smiles":null,"spectrum_id":"CCMSLIB00017288173","spectrum_index":37595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 16.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.149,"smiles":null,"spectrum_id":"CCMSLIB00017288175","spectrum_index":37596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 243.0385 Da; putative annotation: N/A; putative formula: C12H10N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.109,"smiles":null,"spectrum_id":"CCMSLIB00017288178","spectrum_index":37597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 200.0684 Da; putative annotation: N/A; putative formula: C9H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.129,"smiles":null,"spectrum_id":"CCMSLIB00017288182","spectrum_index":37598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Val (delta mass: 97.0529 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.187,"smiles":null,"spectrum_id":"CCMSLIB00017288184","spectrum_index":37599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Asp (delta mass: 115.026 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.098,"smiles":null,"spectrum_id":"CCMSLIB00017288187","spectrum_index":37600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 91.9924 Da; putative annotation: N/A; putative formula: C4HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.073,"smiles":null,"spectrum_id":"CCMSLIB00017288190","spectrum_index":37601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 246.0895 Da; putative annotation: N/A; putative formula: C14H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.197,"smiles":null,"spectrum_id":"CCMSLIB00017288193","spectrum_index":37602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anisomycin (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.133,"smiles":null,"spectrum_id":"CCMSLIB00017288194","spectrum_index":37603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 200.1595 Da; putative annotation: N/A; putative formula: C12H24S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.246,"smiles":null,"spectrum_id":"CCMSLIB00017288197","spectrum_index":37604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 133.1248 Da; putative annotation: N/A; putative formula: C10H15NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.211,"smiles":null,"spectrum_id":"CCMSLIB00017288200","spectrum_index":37605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 5.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.081,"smiles":null,"spectrum_id":"CCMSLIB00017288203","spectrum_index":37606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 17.0496 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.13,"smiles":null,"spectrum_id":"CCMSLIB00017288205","spectrum_index":37607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 18.1052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.182,"smiles":null,"spectrum_id":"CCMSLIB00017288207","spectrum_index":37608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 58.0443 Da; putative annotation: N/A; putative formula: C3H6O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.109,"smiles":null,"spectrum_id":"CCMSLIB00017288210","spectrum_index":37609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU203801 Carbamazepine-10,11-epoxide|Carbamazepine epoxide (delta mass: 16.0776 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017288213","spectrum_index":37610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 146.037 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.097,"smiles":null,"spectrum_id":"CCMSLIB00017288215","spectrum_index":37611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 47.0377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.118,"smiles":null,"spectrum_id":"CCMSLIB00017288217","spectrum_index":37612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mannitol (delta mass: 334.0485 Da; putative annotation: N/A; putative formula: C12H10N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.135,"smiles":null,"spectrum_id":"CCMSLIB00017288220","spectrum_index":37613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 76.0624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.143,"smiles":null,"spectrum_id":"CCMSLIB00017288223","spectrum_index":37614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 85.0525 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.176,"smiles":null,"spectrum_id":"CCMSLIB00017288226","spectrum_index":37615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 72.0216 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.076,"smiles":null,"spectrum_id":"CCMSLIB00017288228","spectrum_index":37616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 83.9524 Da; putative annotation: N/A; putative formula: C3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.012,"smiles":null,"spectrum_id":"CCMSLIB00017288230","spectrum_index":37617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 17.0188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.091,"smiles":null,"spectrum_id":"CCMSLIB00017288233","spectrum_index":37618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 11.9998 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.081,"smiles":null,"spectrum_id":"CCMSLIB00017288236","spectrum_index":37619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 7.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.097,"smiles":null,"spectrum_id":"CCMSLIB00017288238","spectrum_index":37620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 107.0045 Da; putative annotation: TAURINE; putative formula: C2H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.128,"smiles":null,"spectrum_id":"CCMSLIB00017288241","spectrum_index":37621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 113.0841 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017288243","spectrum_index":37622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 258.1987 Da; putative annotation: Stearidonic acid; putative formula: C18H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.28,"smiles":null,"spectrum_id":"CCMSLIB00017288246","spectrum_index":37623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 156.067 Da; putative annotation: [5-(Pyridin-3-yl)furan-2-yl]methanamine; putative formula: C10H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.138,"smiles":null,"spectrum_id":"CCMSLIB00017288249","spectrum_index":37624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 92.0262 Da; putative annotation: HYDROQUINONE; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.086,"smiles":null,"spectrum_id":"CCMSLIB00017288252","spectrum_index":37625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 135.0321 Da; putative annotation: 4-Aminosalicylic acid; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017288253","spectrum_index":37626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 175.0862 Da; putative annotation: 2-(methyl(2H-pyrazolo[3,4-d]pyrimidin-4-yl)amino)ethanol; putative formula: C8H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.199,"smiles":null,"spectrum_id":"CCMSLIB00017288256","spectrum_index":37627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-.beta.-alanine (delta mass: 29.0266 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.092,"smiles":null,"spectrum_id":"CCMSLIB00017288259","spectrum_index":37628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 90.089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.384,"smiles":null,"spectrum_id":"CCMSLIB00017288262","spectrum_index":37629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 123.0543 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.13,"smiles":null,"spectrum_id":"CCMSLIB00017288264","spectrum_index":37630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 69.0212 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.108,"smiles":null,"spectrum_id":"CCMSLIB00017288266","spectrum_index":37631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 111.0838 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.171,"smiles":null,"spectrum_id":"CCMSLIB00017288269","spectrum_index":37632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 132.1165 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.197,"smiles":null,"spectrum_id":"CCMSLIB00017288272","spectrum_index":37633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 224.1439 Da; putative annotation: N/A; putative formula: C13H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.283,"smiles":null,"spectrum_id":"CCMSLIB00017288274","spectrum_index":37634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 342.0738 Da; putative annotation: N/A; putative formula: C18H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.134,"smiles":null,"spectrum_id":"CCMSLIB00017288276","spectrum_index":37635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 59.0369 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.048,"smiles":null,"spectrum_id":"CCMSLIB00017288279","spectrum_index":37636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(4-Chlorophenyl)-7-hydroxy-2-methyl-4H-chromen-4-one (delta mass: 18.1631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.21,"smiles":null,"spectrum_id":"CCMSLIB00017288282","spectrum_index":37637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4-(Difluoromethoxy)-3-methoxyphenyl]methanamine (delta mass: 63.0848 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.168,"smiles":null,"spectrum_id":"CCMSLIB00017288285","spectrum_index":37638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 628.2158 Da; putative annotation: N/A; putative formula: C32H36O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.297,"smiles":null,"spectrum_id":"CCMSLIB00017288287","spectrum_index":37639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylserotonin (delta mass: 211.238 Da; putative annotation: N/A; putative formula: C13H29N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.351,"smiles":null,"spectrum_id":"CCMSLIB00017288289","spectrum_index":37640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-acetaldehyde CollisionEnergy:102040 (delta mass: 246.1003 Da; putative annotation: N/A; putative formula: C13H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.176,"smiles":null,"spectrum_id":"CCMSLIB00017288292","spectrum_index":37641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyltyramine (delta mass: 16.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.138,"smiles":null,"spectrum_id":"CCMSLIB00017288295","spectrum_index":37642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 378.1261 Da; putative annotation: N/A; putative formula: C18H24N2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.212,"smiles":null,"spectrum_id":"CCMSLIB00017288297","spectrum_index":37643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 201.0579 Da; putative annotation: N/A; putative formula: C15H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.17,"smiles":null,"spectrum_id":"CCMSLIB00017288299","spectrum_index":37644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 64.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.113,"smiles":null,"spectrum_id":"CCMSLIB00017288302","spectrum_index":37645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 158.1057 Da; putative annotation: N/A; putative formula: C7H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.282,"smiles":null,"spectrum_id":"CCMSLIB00017288305","spectrum_index":37646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 34.0202 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.138,"smiles":null,"spectrum_id":"CCMSLIB00017288307","spectrum_index":37647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 97.0213 Da; putative annotation: N/A; putative formula: C3H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.086,"smiles":null,"spectrum_id":"CCMSLIB00017288310","spectrum_index":37648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Camalexin (delta mass: 77.1215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.17,"smiles":null,"spectrum_id":"CCMSLIB00017288312","spectrum_index":37649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]cyclopropanecarboxamide (delta mass: 260.1242 Da; putative annotation: N/A; putative formula: C9H20N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.268,"smiles":null,"spectrum_id":"CCMSLIB00017288315","spectrum_index":37650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 491.3061 Da; putative annotation: N/A; putative formula: C20H41N7O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.496,"smiles":null,"spectrum_id":"CCMSLIB00017288318","spectrum_index":37651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloylputrescine (delta mass: 233.1055 Da; putative annotation: N/A; putative formula: C13H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.26,"smiles":null,"spectrum_id":"CCMSLIB00017288320","spectrum_index":37652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 173.0535 Da; putative annotation: N/A; putative formula: C6H12N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.094,"smiles":null,"spectrum_id":"CCMSLIB00017288323","spectrum_index":37653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORADRENALINE (delta mass: 24.0972 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.178,"smiles":null,"spectrum_id":"CCMSLIB00017288325","spectrum_index":37654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 96.0333 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.151,"smiles":null,"spectrum_id":"CCMSLIB00017288328","spectrum_index":37655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 129.079 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.271,"smiles":null,"spectrum_id":"CCMSLIB00017288331","spectrum_index":37656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 122.0732 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.149,"smiles":null,"spectrum_id":"CCMSLIB00017288333","spectrum_index":37657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 734.4606 Da; putative annotation: N/A; putative formula: C41H66O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.536,"smiles":null,"spectrum_id":"CCMSLIB00017288336","spectrum_index":37658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 113.0721 Da; putative annotation: N/A; putative formula: C3H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.122,"smiles":null,"spectrum_id":"CCMSLIB00017288338","spectrum_index":37659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 180.1397 Da; putative annotation: N/A; putative formula: C9H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.216,"smiles":null,"spectrum_id":"CCMSLIB00017288341","spectrum_index":37660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,8-dihydroxy-2,2,4,4-tetramethyl-7-(3-methylbutanoyl)-9-(2-methylpropyl)-9H-xanthene-1,3-dione (delta mass: 236.1412 Da; putative annotation: N/A; putative formula: C14H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.384,"smiles":null,"spectrum_id":"CCMSLIB00017288344","spectrum_index":37661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 36.924 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.042,"smiles":null,"spectrum_id":"CCMSLIB00017288347","spectrum_index":37662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 216.1052 Da; putative annotation: N/A; putative formula: C16H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.185,"smiles":null,"spectrum_id":"CCMSLIB00017288348","spectrum_index":37663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ramosetron (delta mass: 141.0385 Da; putative annotation: N/A; putative formula: C2H3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.183,"smiles":null,"spectrum_id":"CCMSLIB00017288351","spectrum_index":37664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-aminobutanoate (delta mass: 85.0526 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.154,"smiles":null,"spectrum_id":"CCMSLIB00017288354","spectrum_index":37665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 31.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.149,"smiles":null,"spectrum_id":"CCMSLIB00017288357","spectrum_index":37666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 333.0969 Da; putative annotation: N/A; putative formula: C16H19N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.292,"smiles":null,"spectrum_id":"CCMSLIB00017288358","spectrum_index":37667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 88.0772 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.216,"smiles":null,"spectrum_id":"CCMSLIB00017288361","spectrum_index":37668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 134.0306 Da; putative annotation: N/A; putative formula: C7H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.091,"smiles":null,"spectrum_id":"CCMSLIB00017288364","spectrum_index":37669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 312.0847 Da; putative annotation: N/A; putative formula: C9H13N8O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.166,"smiles":null,"spectrum_id":"CCMSLIB00017288366","spectrum_index":37670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 318.0016 Da; putative annotation: N/A; putative formula: C7H14N2O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.062,"smiles":null,"spectrum_id":"CCMSLIB00017288368","spectrum_index":37671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 98.0379 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.119,"smiles":null,"spectrum_id":"CCMSLIB00017288371","spectrum_index":37672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 51.9944 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.049,"smiles":null,"spectrum_id":"CCMSLIB00017288374","spectrum_index":37673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 57.0154 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.096,"smiles":null,"spectrum_id":"CCMSLIB00017288376","spectrum_index":37674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 15.0184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.198,"smiles":null,"spectrum_id":"CCMSLIB00017288378","spectrum_index":37675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 149.062 Da; putative annotation: N/A; putative formula: C4H11N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.148,"smiles":null,"spectrum_id":"CCMSLIB00017288381","spectrum_index":37676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 40.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017288384","spectrum_index":37677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 164.119 Da; putative annotation: N/A; putative formula: C11H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.2,"smiles":null,"spectrum_id":"CCMSLIB00017288387","spectrum_index":37678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 111.0313 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.102,"smiles":null,"spectrum_id":"CCMSLIB00017288389","spectrum_index":37679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 703.5323 Da; putative annotation: N/A; putative formula: C41H73N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1087.68,"smiles":null,"spectrum_id":"CCMSLIB00017288392","spectrum_index":37680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1H-Benzimidazol-2-ylsulfanyl)furan--2-carbaldehyde (delta mass: 220.1879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.226,"smiles":null,"spectrum_id":"CCMSLIB00017288394","spectrum_index":37681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 144.0208 Da; putative annotation: N/A; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.076,"smiles":null,"spectrum_id":"CCMSLIB00017288397","spectrum_index":37682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 244.1085 Da; putative annotation: N/A; putative formula: C9H17N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.179,"smiles":null,"spectrum_id":"CCMSLIB00017288400","spectrum_index":37683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 312.1462 Da; putative annotation: N/A; putative formula: C12H21N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.27,"smiles":null,"spectrum_id":"CCMSLIB00017288402","spectrum_index":37684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-pyrazol-4-yl)-1H-benzimidazole (delta mass: 82.9779 Da; putative annotation: N/A; putative formula: H-2N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.076,"smiles":null,"spectrum_id":"CCMSLIB00017288404","spectrum_index":37685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nonen-1-ol, (Z)- (delta mass: 56.0271 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.17,"smiles":null,"spectrum_id":"CCMSLIB00017288407","spectrum_index":37686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid; LC-tDDA; CE30 (delta mass: 70.0538 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.093,"smiles":null,"spectrum_id":"CCMSLIB00017288410","spectrum_index":37687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-nornuciferine (delta mass: 14.9265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.075,"smiles":null,"spectrum_id":"CCMSLIB00017288413","spectrum_index":37688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 198.1674 Da; putative annotation: N/A; putative formula: C11H23N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.344,"smiles":null,"spectrum_id":"CCMSLIB00017288415","spectrum_index":37689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 115.004 Da; putative annotation: N/A; putative formula: CH2N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.084,"smiles":null,"spectrum_id":"CCMSLIB00017288417","spectrum_index":37690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 119.0542 Da; putative annotation: N/A; putative formula: C6H6BNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.162,"smiles":null,"spectrum_id":"CCMSLIB00017288420","spectrum_index":37691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 65.0632 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.128,"smiles":null,"spectrum_id":"CCMSLIB00017288423","spectrum_index":37692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 76.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.091,"smiles":null,"spectrum_id":"CCMSLIB00017288426","spectrum_index":37693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 54.0717 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.169,"smiles":null,"spectrum_id":"CCMSLIB00017288428","spectrum_index":37694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 38.0413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.107,"smiles":null,"spectrum_id":"CCMSLIB00017288431","spectrum_index":37695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 366.0718 Da; putative annotation: N/A; putative formula: C17H22N2O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.158,"smiles":null,"spectrum_id":"CCMSLIB00017288433","spectrum_index":37696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 63.9928 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.074,"smiles":null,"spectrum_id":"CCMSLIB00017288436","spectrum_index":37697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 86.0632 Da; putative annotation: N/A; putative formula: C5H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.149,"smiles":null,"spectrum_id":"CCMSLIB00017288439","spectrum_index":37698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 381.1261 Da; putative annotation: N/A; putative formula: C12H27N7O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.229,"smiles":null,"spectrum_id":"CCMSLIB00017288441","spectrum_index":37699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 231.1311 Da; putative annotation: N/A; putative formula: C11H23NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.217,"smiles":null,"spectrum_id":"CCMSLIB00017288444","spectrum_index":37700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 61.0992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.159,"smiles":null,"spectrum_id":"CCMSLIB00017288447","spectrum_index":37701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 136.0523 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.128,"smiles":null,"spectrum_id":"CCMSLIB00017288450","spectrum_index":37702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 340.1297 Da; putative annotation: N/A; putative formula: C17H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.179,"smiles":null,"spectrum_id":"CCMSLIB00017288452","spectrum_index":37703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coniferaldehyde (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.081,"smiles":null,"spectrum_id":"CCMSLIB00017288455","spectrum_index":37704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 547.278 Da; putative annotation: N/A; putative formula: C27H29N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":892.411,"smiles":null,"spectrum_id":"CCMSLIB00017288458","spectrum_index":37705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017288460","spectrum_index":37706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 100.0423 Da; putative annotation: N/A; putative formula: C7H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.166,"smiles":null,"spectrum_id":"CCMSLIB00017288463","spectrum_index":37707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 766.413 Da; putative annotation: N/A; putative formula: C45H58N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.499,"smiles":null,"spectrum_id":"CCMSLIB00017288466","spectrum_index":37708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 397.3554 Da; putative annotation: N/A; putative formula: C24H47NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.426,"smiles":null,"spectrum_id":"CCMSLIB00017288469","spectrum_index":37709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 86.0102 Da; putative annotation: N/A; putative formula: C2H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.097,"smiles":null,"spectrum_id":"CCMSLIB00017288470","spectrum_index":37710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 323.1811 Da; putative annotation: N/A; putative formula: C12H21N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.34,"smiles":null,"spectrum_id":"CCMSLIB00017288473","spectrum_index":37711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 990.4186 Da; putative annotation: N/A; putative formula: C52H66N2O15S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1212.52,"smiles":null,"spectrum_id":"CCMSLIB00017288476","spectrum_index":37712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactose 1-phosphate - 30.0 eV (delta mass: 123.931 Da; putative annotation: N/A; putative formula: CH4O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.968,"smiles":null,"spectrum_id":"CCMSLIB00017288479","spectrum_index":37713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (Z,E)-Tetradeca-9,12-dienol from NIST14 (delta mass: 201.2095 Da; putative annotation: N/A; putative formula: C8H23N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.415,"smiles":null,"spectrum_id":"CCMSLIB00017288482","spectrum_index":37714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 38.0484 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017288485","spectrum_index":37715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 64.0561 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.195,"smiles":null,"spectrum_id":"CCMSLIB00017288486","spectrum_index":37716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 429.1645 Da; putative annotation: N/A; putative formula: C30H24NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.235,"smiles":null,"spectrum_id":"CCMSLIB00017288489","spectrum_index":37717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ331207 Gabapentin Related Compound E|1-(carboxymethyl)cyclohexanecarboxylic acid|1-(carboxymethyl)cyclohexane-1-carboxylic acid (delta mass: 94.0781 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.175,"smiles":null,"spectrum_id":"CCMSLIB00017288492","spectrum_index":37718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphylloside (delta mass: 150.0281 Da; putative annotation: N/A; putative formula: C5H13O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.24,"smiles":null,"spectrum_id":"CCMSLIB00017288494","spectrum_index":37719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 182.1096 Da; putative annotation: N/A; putative formula: C14H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.175,"smiles":null,"spectrum_id":"CCMSLIB00017288497","spectrum_index":37720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 95.039 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.11,"smiles":null,"spectrum_id":"CCMSLIB00017288500","spectrum_index":37721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 470.1219 Da; putative annotation: N/A; putative formula: C16H28N2O10P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.193,"smiles":null,"spectrum_id":"CCMSLIB00017288502","spectrum_index":37722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 291.2409 Da; putative annotation: N/A; putative formula: C16H29N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.322,"smiles":null,"spectrum_id":"CCMSLIB00017288504","spectrum_index":37723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 115.0869 Da; putative annotation: N/A; putative formula: C3H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.128,"smiles":null,"spectrum_id":"CCMSLIB00017288507","spectrum_index":37724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Cyclopropyl-2-quinolinecarboxamide (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017288510","spectrum_index":37725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 159.0895 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.155,"smiles":null,"spectrum_id":"CCMSLIB00017288512","spectrum_index":37726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 560.2246 Da; putative annotation: N/A; putative formula: C34H32N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":753.295,"smiles":null,"spectrum_id":"CCMSLIB00017288515","spectrum_index":37727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 132.0164 Da; putative annotation: N/A; putative formula: C5H9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.17,"smiles":null,"spectrum_id":"CCMSLIB00017288518","spectrum_index":37728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 23.0235 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.063,"smiles":null,"spectrum_id":"CCMSLIB00017288520","spectrum_index":37729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Bromo-5-fluoroindole (delta mass: 18.0127 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.979,"smiles":null,"spectrum_id":"CCMSLIB00017288522","spectrum_index":37730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 248.053 Da; putative annotation: N/A; putative formula: C9H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.181,"smiles":null,"spectrum_id":"CCMSLIB00017288525","spectrum_index":37731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 258.1328 Da; putative annotation: N/A; putative formula: C10H18N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.203,"smiles":null,"spectrum_id":"CCMSLIB00017288528","spectrum_index":37732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 71.0747 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.251,"smiles":null,"spectrum_id":"CCMSLIB00017288531","spectrum_index":37733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 67.9899 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.071,"smiles":null,"spectrum_id":"CCMSLIB00017288533","spectrum_index":37734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyltyramine (delta mass: 46.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.149,"smiles":null,"spectrum_id":"CCMSLIB00017288536","spectrum_index":37735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 32.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.164,"smiles":null,"spectrum_id":"CCMSLIB00017288539","spectrum_index":37736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 374.2817 Da; putative annotation: N/A; putative formula: C24H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.389,"smiles":null,"spectrum_id":"CCMSLIB00017288540","spectrum_index":37737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.155,"smiles":null,"spectrum_id":"CCMSLIB00017288543","spectrum_index":37738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 882.7605 Da; putative annotation: N/A; putative formula: C9H18NO29P9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1004.86,"smiles":null,"spectrum_id":"CCMSLIB00017288546","spectrum_index":37739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 303.1473 Da; putative annotation: N/A; putative formula: C17H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.259,"smiles":null,"spectrum_id":"CCMSLIB00017288549","spectrum_index":37740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 739.0233 Da; putative annotation: N/A; putative formula: C23H9N13O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":961.12,"smiles":null,"spectrum_id":"CCMSLIB00017288552","spectrum_index":37741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 164.0472 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.107,"smiles":null,"spectrum_id":"CCMSLIB00017288554","spectrum_index":37742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 46.0803 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.14,"smiles":null,"spectrum_id":"CCMSLIB00017288557","spectrum_index":37743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 481.4636 Da; putative annotation: N/A; putative formula: C34H59N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.506,"smiles":null,"spectrum_id":"CCMSLIB00017288559","spectrum_index":37744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 167.0587 Da; putative annotation: N/A; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.199,"smiles":null,"spectrum_id":"CCMSLIB00017288562","spectrum_index":37745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYLTYRAMINE (delta mass: 305.393 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.5,"smiles":null,"spectrum_id":"CCMSLIB00017288565","spectrum_index":37746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 48.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017288567","spectrum_index":37747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzyl-1H-indole (delta mass: 75.039 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.151,"smiles":null,"spectrum_id":"CCMSLIB00017288570","spectrum_index":37748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 90.064 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.162,"smiles":null,"spectrum_id":"CCMSLIB00017288572","spectrum_index":37749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 77.1055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.186,"smiles":null,"spectrum_id":"CCMSLIB00017288575","spectrum_index":37750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aceroside VII (delta mass: 182.1162 Da; putative annotation: N/A; putative formula: C8H14N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.349,"smiles":null,"spectrum_id":"CCMSLIB00017288578","spectrum_index":37751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethoxyphenol (delta mass: 74.0373 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.108,"smiles":null,"spectrum_id":"CCMSLIB00017288580","spectrum_index":37752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 641.3045 Da; putative annotation: N/A; putative formula: C37H47N5O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.375,"smiles":null,"spectrum_id":"CCMSLIB00017288582","spectrum_index":37753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 32.0615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.142,"smiles":null,"spectrum_id":"CCMSLIB00017288585","spectrum_index":37754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 59.057 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.128,"smiles":null,"spectrum_id":"CCMSLIB00017288588","spectrum_index":37755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 56.0241 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.063,"smiles":null,"spectrum_id":"CCMSLIB00017288591","spectrum_index":37756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 81.0786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.191,"smiles":null,"spectrum_id":"CCMSLIB00017288594","spectrum_index":37757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 30.0469 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.127,"smiles":null,"spectrum_id":"CCMSLIB00017288596","spectrum_index":37758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 50.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017288598","spectrum_index":37759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 184.1256 Da; putative annotation: N/A; putative formula: C14H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.181,"smiles":null,"spectrum_id":"CCMSLIB00017288601","spectrum_index":37760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 5.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.103,"smiles":null,"spectrum_id":"CCMSLIB00017288604","spectrum_index":37761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 102.0858 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.177,"smiles":null,"spectrum_id":"CCMSLIB00017288606","spectrum_index":37762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 173.0476 Da; putative annotation: N/A; putative formula: C10H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.129,"smiles":null,"spectrum_id":"CCMSLIB00017288609","spectrum_index":37763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-guanidinobutanamide (delta mass: 44.9975 Da; putative annotation: N/A; putative formula: C4H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.106,"smiles":null,"spectrum_id":"CCMSLIB00017288612","spectrum_index":37764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 74.0308 Da; putative annotation: N/A; putative formula: C2H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.117,"smiles":null,"spectrum_id":"CCMSLIB00017288615","spectrum_index":37765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 258.1268 Da; putative annotation: N/A; putative formula: C17H14N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.164,"smiles":null,"spectrum_id":"CCMSLIB00017288617","spectrum_index":37766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 264.2114 Da; putative annotation: N/A; putative formula: C16H29N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.252,"smiles":null,"spectrum_id":"CCMSLIB00017288620","spectrum_index":37767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 34.0234 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.089,"smiles":null,"spectrum_id":"CCMSLIB00017288623","spectrum_index":37768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of UNII-UGT5535REQ (delta mass: 2.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.141,"smiles":null,"spectrum_id":"CCMSLIB00017288626","spectrum_index":37769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 150.061 Da; putative annotation: N/A; putative formula: C8H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.2,"smiles":null,"spectrum_id":"CCMSLIB00017288628","spectrum_index":37770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 60.0353 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.288,"smiles":null,"spectrum_id":"CCMSLIB00017288631","spectrum_index":37771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 110.0365 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.16,"smiles":null,"spectrum_id":"CCMSLIB00017288633","spectrum_index":37772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 55.066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.168,"smiles":null,"spectrum_id":"CCMSLIB00017288636","spectrum_index":37773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.beta.-Homoserine (delta mass: 144.0054 Da; putative annotation: N/A; putative formula: C5H4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.071,"smiles":null,"spectrum_id":"CCMSLIB00017288639","spectrum_index":37774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 402.3725 Da; putative annotation: N/A; putative formula: C25H46N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.411,"smiles":null,"spectrum_id":"CCMSLIB00017288642","spectrum_index":37775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 157.1461 Da; putative annotation: N/A; putative formula: C9H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.206,"smiles":null,"spectrum_id":"CCMSLIB00017288644","spectrum_index":37776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 115.049 Da; putative annotation: N/A; putative formula: C2H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.121,"smiles":null,"spectrum_id":"CCMSLIB00017288646","spectrum_index":37777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 60.0135 Da; putative annotation: N/A; putative formula: C2H5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.094,"smiles":null,"spectrum_id":"CCMSLIB00017288649","spectrum_index":37778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2,5-Dihydroxyhexyl)oxolan-2-one (delta mass: 89.0828 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.211,"smiles":null,"spectrum_id":"CCMSLIB00017288652","spectrum_index":37779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 127.0994 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.159,"smiles":null,"spectrum_id":"CCMSLIB00017288655","spectrum_index":37780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 46.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.154,"smiles":null,"spectrum_id":"CCMSLIB00017288657","spectrum_index":37781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 80.0496 Da; putative annotation: N/A; putative formula: C3H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.114,"smiles":null,"spectrum_id":"CCMSLIB00017288659","spectrum_index":37782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 91.0366 Da; putative annotation: N/A; putative formula: CH5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.117,"smiles":null,"spectrum_id":"CCMSLIB00017288662","spectrum_index":37783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 11.0047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.102,"smiles":null,"spectrum_id":"CCMSLIB00017288665","spectrum_index":37784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 283.2868 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.4,"smiles":null,"spectrum_id":"CCMSLIB00017288667","spectrum_index":37785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 90.0534 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.134,"smiles":null,"spectrum_id":"CCMSLIB00017288669","spectrum_index":37786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Formoterol (delta mass: 30.9907 Da; putative annotation: N/A; putative formula: HNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.172,"smiles":null,"spectrum_id":"CCMSLIB00017288672","spectrum_index":37787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 481.2867 Da; putative annotation: N/A; putative formula: C27H47NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.384,"smiles":null,"spectrum_id":"CCMSLIB00017288675","spectrum_index":37788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 238.2293 Da; putative annotation: 2-Hexyldecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.498,"smiles":null,"spectrum_id":"CCMSLIB00017288678","spectrum_index":37789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380743-01!4-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-3-hydroxy-2-methyl-2H-furan-5-one (delta mass: 178.0619 Da; putative annotation: Divaric acid; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.164,"smiles":null,"spectrum_id":"CCMSLIB00017288680","spectrum_index":37790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 284.2136 Da; putative annotation: NCGC00169715-02_C20H30O2_Abieta-8(14),9(11),12-triene-7,18-diol; putative formula: C20H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.337,"smiles":null,"spectrum_id":"CCMSLIB00017288682","spectrum_index":37791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 115.0267 Da; putative annotation: D-Aspartic acid; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.108,"smiles":null,"spectrum_id":"CCMSLIB00017288685","spectrum_index":37792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 113.0836 Da; putative annotation: 2-Amino-2-ethylbutanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.149,"smiles":null,"spectrum_id":"CCMSLIB00017288688","spectrum_index":37793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 41.0168 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.156,"smiles":null,"spectrum_id":"CCMSLIB00017288691","spectrum_index":37794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 172.0849 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.224,"smiles":null,"spectrum_id":"CCMSLIB00017288693","spectrum_index":37795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 64.067 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.341,"smiles":null,"spectrum_id":"CCMSLIB00017288696","spectrum_index":37796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 347.2162 Da; putative annotation: N/A; putative formula: C16H34N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.286,"smiles":null,"spectrum_id":"CCMSLIB00017288699","spectrum_index":37797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 405.3475 Da; putative annotation: N/A; putative formula: C23H43N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.496,"smiles":null,"spectrum_id":"CCMSLIB00017288702","spectrum_index":37798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 209.0566 Da; putative annotation: N/A; putative formula: C5H12N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.096,"smiles":null,"spectrum_id":"CCMSLIB00017288703","spectrum_index":37799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 176.1413 Da; putative annotation: N/A; putative formula: C10H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.191,"smiles":null,"spectrum_id":"CCMSLIB00017288706","spectrum_index":37800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 109.0738 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.113,"smiles":null,"spectrum_id":"CCMSLIB00017288709","spectrum_index":37801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 104.0264 Da; putative annotation: N/A; putative formula: C7H4O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.092,"smiles":null,"spectrum_id":"CCMSLIB00017288712","spectrum_index":37802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017288714","spectrum_index":37803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:102040 (delta mass: 136.034 Da; putative annotation: N/A; putative formula: C8H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.129,"smiles":null,"spectrum_id":"CCMSLIB00017288716","spectrum_index":37804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 210.1006 Da; putative annotation: N/A; putative formula: C10H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.261,"smiles":null,"spectrum_id":"CCMSLIB00017288719","spectrum_index":37805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.164,"smiles":null,"spectrum_id":"CCMSLIB00017288722","spectrum_index":37806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 74.0725 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.122,"smiles":null,"spectrum_id":"CCMSLIB00017288725","spectrum_index":37807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 46.0717 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.13,"smiles":null,"spectrum_id":"CCMSLIB00017288727","spectrum_index":37808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 112.0251 Da; putative annotation: N/A; putative formula: N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.107,"smiles":null,"spectrum_id":"CCMSLIB00017288729","spectrum_index":37809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 224.1506 Da; putative annotation: N/A; putative formula: C8H16N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.185,"smiles":null,"spectrum_id":"CCMSLIB00017288732","spectrum_index":37810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 22.0166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.077,"smiles":null,"spectrum_id":"CCMSLIB00017288735","spectrum_index":37811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 179.1513 Da; putative annotation: N/A; putative formula: C9H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.232,"smiles":null,"spectrum_id":"CCMSLIB00017288738","spectrum_index":37812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 285.2594 Da; putative annotation: N/A; putative formula: C16H35N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.294,"smiles":null,"spectrum_id":"CCMSLIB00017288740","spectrum_index":37813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dehydrocoelenterazine (delta mass: 167.0579 Da; putative annotation: N/A; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.208,"smiles":null,"spectrum_id":"CCMSLIB00017288743","spectrum_index":37814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 222.0684 Da; putative annotation: N/A; putative formula: C8H18N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.134,"smiles":null,"spectrum_id":"CCMSLIB00017288746","spectrum_index":37815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 346.1316 Da; putative annotation: N/A; putative formula: C21H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.206,"smiles":null,"spectrum_id":"CCMSLIB00017288749","spectrum_index":37816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 91.0051 Da; putative annotation: N/A; putative formula: C5HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.091,"smiles":null,"spectrum_id":"CCMSLIB00017288751","spectrum_index":37817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 74.0508 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.111,"smiles":null,"spectrum_id":"CCMSLIB00017288754","spectrum_index":37818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 86.0433 Da; putative annotation: N/A; putative formula: C3H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.197,"smiles":null,"spectrum_id":"CCMSLIB00017288757","spectrum_index":37819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 244.0965 Da; putative annotation: N/A; putative formula: C5H12N10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.22,"smiles":null,"spectrum_id":"CCMSLIB00017288760","spectrum_index":37820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 627.3201 Da; putative annotation: N/A; putative formula: C41H46N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":940.464,"smiles":null,"spectrum_id":"CCMSLIB00017288763","spectrum_index":37821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 586.3502 Da; putative annotation: N/A; putative formula: C34H50O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.479,"smiles":null,"spectrum_id":"CCMSLIB00017288765","spectrum_index":37822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 127.0996 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.175,"smiles":null,"spectrum_id":"CCMSLIB00017288768","spectrum_index":37823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 179.1683 Da; putative annotation: N/A; putative formula: C12H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.26,"smiles":null,"spectrum_id":"CCMSLIB00017288771","spectrum_index":37824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 24.0361 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.163,"smiles":null,"spectrum_id":"CCMSLIB00017288773","spectrum_index":37825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 59.0732 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.143,"smiles":null,"spectrum_id":"CCMSLIB00017288776","spectrum_index":37826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 148.1135 Da; putative annotation: N/A; putative formula: C8H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.226,"smiles":null,"spectrum_id":"CCMSLIB00017288779","spectrum_index":37827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380970-01!3-hydroxy-2-[[3-(3-hydroxy-6-methylheptanoyl)oxy-8-methylnonanoyl]amino]propanoic acid (delta mass: 417.265 Da; putative annotation: N/A; putative formula: C21H40NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":835.545,"smiles":null,"spectrum_id":"CCMSLIB00017288782","spectrum_index":37828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 63.0325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.186,"smiles":null,"spectrum_id":"CCMSLIB00017288784","spectrum_index":37829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 34.9751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.035,"smiles":null,"spectrum_id":"CCMSLIB00017288787","spectrum_index":37830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of imbricatine (delta mass: 14.015 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.112,"smiles":null,"spectrum_id":"CCMSLIB00017288790","spectrum_index":37831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 1.9134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":113.964,"smiles":null,"spectrum_id":"CCMSLIB00017288792","spectrum_index":37832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 663.5271 Da; putative annotation: N/A; putative formula: C33H65N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":852.676,"smiles":null,"spectrum_id":"CCMSLIB00017288795","spectrum_index":37833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 75.9977 Da; putative annotation: N/A; putative formula: C2H4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.095,"smiles":null,"spectrum_id":"CCMSLIB00017288798","spectrum_index":37834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 48.0361 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.331,"smiles":null,"spectrum_id":"CCMSLIB00017288801","spectrum_index":37835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 40.0353 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.169,"smiles":null,"spectrum_id":"CCMSLIB00017288803","spectrum_index":37836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 28.0499 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.141,"smiles":null,"spectrum_id":"CCMSLIB00017288805","spectrum_index":37837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-.alpha.-Cyclohexylglycine (delta mass: 56.0617 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.179,"smiles":null,"spectrum_id":"CCMSLIB00017288808","spectrum_index":37838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 98.0214 Da; putative annotation: N/A; putative formula: C2H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.212,"smiles":null,"spectrum_id":"CCMSLIB00017288811","spectrum_index":37839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 83.072 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.122,"smiles":null,"spectrum_id":"CCMSLIB00017288814","spectrum_index":37840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 126.0318 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.144,"smiles":null,"spectrum_id":"CCMSLIB00017288815","spectrum_index":37841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 193.074 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.15,"smiles":null,"spectrum_id":"CCMSLIB00017288818","spectrum_index":37842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 237.0998 Da; putative annotation: N/A; putative formula: C12H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.197,"smiles":null,"spectrum_id":"CCMSLIB00017288821","spectrum_index":37843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 73.0237 Da; putative annotation: N/A; putative formula: CH3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.089,"smiles":null,"spectrum_id":"CCMSLIB00017288824","spectrum_index":37844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 106.1692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.302,"smiles":null,"spectrum_id":"CCMSLIB00017288826","spectrum_index":37845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 84.1623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.322,"smiles":null,"spectrum_id":"CCMSLIB00017288828","spectrum_index":37846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 11.07 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.113,"smiles":null,"spectrum_id":"CCMSLIB00017288831","spectrum_index":37847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 429.2373 Da; putative annotation: N/A; putative formula: C22H39NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.308,"smiles":null,"spectrum_id":"CCMSLIB00017288834","spectrum_index":37848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 127.0127 Da; putative annotation: N/A; putative formula: C2HN5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.068,"smiles":null,"spectrum_id":"CCMSLIB00017288837","spectrum_index":37849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 294.1696 Da; putative annotation: N/A; putative formula: C14H22N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.318,"smiles":null,"spectrum_id":"CCMSLIB00017288838","spectrum_index":37850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 68.0517 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.17,"smiles":null,"spectrum_id":"CCMSLIB00017288841","spectrum_index":37851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-methoxybenzyl)ethanamine (delta mass: 838.8955 Da; putative annotation: N/A; putative formula: C24H17N5O17S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1099.04,"smiles":null,"spectrum_id":"CCMSLIB00017288844","spectrum_index":37852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 150.0318 Da; putative annotation: N/A; putative formula: C8H6O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.123,"smiles":null,"spectrum_id":"CCMSLIB00017288847","spectrum_index":37853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.248,"smiles":null,"spectrum_id":"CCMSLIB00017288849","spectrum_index":37854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 59.0379 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.177,"smiles":null,"spectrum_id":"CCMSLIB00017288851","spectrum_index":37855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCURONOLACTONE (delta mass: 98.0315 Da; putative annotation: N/A; putative formula: C4H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.081,"smiles":null,"spectrum_id":"CCMSLIB00017288854","spectrum_index":37856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 282.0729 Da; putative annotation: N/A; putative formula: C7H15N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.159,"smiles":null,"spectrum_id":"CCMSLIB00017288857","spectrum_index":37857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 116.1088 Da; putative annotation: N/A; putative formula: C4H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.196,"smiles":null,"spectrum_id":"CCMSLIB00017288860","spectrum_index":37858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,7-dimethoxy-4-oxochromen-2-yl)propanoic acid (delta mass: 50.0355 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.122,"smiles":null,"spectrum_id":"CCMSLIB00017288862","spectrum_index":37859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 333.2168 Da; putative annotation: N/A; putative formula: C17H27N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.287,"smiles":null,"spectrum_id":"CCMSLIB00017288865","spectrum_index":37860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 26.014 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.11,"smiles":null,"spectrum_id":"CCMSLIB00017288867","spectrum_index":37861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 29.0845 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.165,"smiles":null,"spectrum_id":"CCMSLIB00017288870","spectrum_index":37862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 84.0649 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.141,"smiles":null,"spectrum_id":"CCMSLIB00017288873","spectrum_index":37863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 334.5221 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.608,"smiles":null,"spectrum_id":"CCMSLIB00017288874","spectrum_index":37864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 334.2369 Da; putative annotation: N/A; putative formula: C18H30N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.323,"smiles":null,"spectrum_id":"CCMSLIB00017288878","spectrum_index":37865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 103.1423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.238,"smiles":null,"spectrum_id":"CCMSLIB00017288880","spectrum_index":37866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00160291-01!Tropan-3-yl-carboxylic acid (2-hydroxy-1-phenyl)-ethyl ester (delta mass: 78.0189 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.194,"smiles":null,"spectrum_id":"CCMSLIB00017288883","spectrum_index":37867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 133.0648 Da; putative annotation: N/A; putative formula: C7H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.156,"smiles":null,"spectrum_id":"CCMSLIB00017288886","spectrum_index":37868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 34.0056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.124,"smiles":null,"spectrum_id":"CCMSLIB00017288889","spectrum_index":37869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 66.0106 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.076,"smiles":null,"spectrum_id":"CCMSLIB00017288891","spectrum_index":37870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 18.0506 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.117,"smiles":null,"spectrum_id":"CCMSLIB00017288894","spectrum_index":37871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 359.2207 Da; putative annotation: N/A; putative formula: C20H29N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.344,"smiles":null,"spectrum_id":"CCMSLIB00017288896","spectrum_index":37872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cellobiose (D[+]) (delta mass: 499.33 Da; putative annotation: N/A; putative formula: C30H45NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":842.453,"smiles":null,"spectrum_id":"CCMSLIB00017288899","spectrum_index":37873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 60.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.159,"smiles":null,"spectrum_id":"CCMSLIB00017288902","spectrum_index":37874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 206.0411 Da; putative annotation: N/A; putative formula: C4H2N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.143,"smiles":null,"spectrum_id":"CCMSLIB00017288905","spectrum_index":37875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 383.3251 Da; putative annotation: N/A; putative formula: C20H41N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.385,"smiles":null,"spectrum_id":"CCMSLIB00017288907","spectrum_index":37876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 282.0879 Da; putative annotation: N/A; putative formula: C11H23O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.236,"smiles":null,"spectrum_id":"CCMSLIB00017288910","spectrum_index":37877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 485.2827 Da; putative annotation: N/A; putative formula: C26H39N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.348,"smiles":null,"spectrum_id":"CCMSLIB00017288913","spectrum_index":37878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 64.1106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017288916","spectrum_index":37879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 130.0419 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.18,"smiles":null,"spectrum_id":"CCMSLIB00017288917","spectrum_index":37880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300526 Hordenine (delta mass: 394.1117 Da; putative annotation: N/A; putative formula: C18H23N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.234,"smiles":null,"spectrum_id":"CCMSLIB00017288921","spectrum_index":37881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 105.9725 Da; putative annotation: N/A; putative formula: C2H2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.012,"smiles":null,"spectrum_id":"CCMSLIB00017288923","spectrum_index":37882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 77.0903 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.202,"smiles":null,"spectrum_id":"CCMSLIB00017288926","spectrum_index":37883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,5S)-9-Methyl-9-azabicyclo[3.3.1]nonan-3-amine (delta mass: 17.8227 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.977,"smiles":null,"spectrum_id":"CCMSLIB00017288929","spectrum_index":37884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 26.8806 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.956,"smiles":null,"spectrum_id":"CCMSLIB00017288932","spectrum_index":37885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 958.4773 Da; putative annotation: N/A; putative formula: C45H62N14O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1165.56,"smiles":null,"spectrum_id":"CCMSLIB00017288935","spectrum_index":37886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 106.0424 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.108,"smiles":null,"spectrum_id":"CCMSLIB00017288938","spectrum_index":37887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 125.0477 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.17,"smiles":null,"spectrum_id":"CCMSLIB00017288940","spectrum_index":37888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ser-Leu from NIST14 (delta mass: 114.0415 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.175,"smiles":null,"spectrum_id":"CCMSLIB00017288943","spectrum_index":37889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 518.1943 Da; putative annotation: N/A; putative formula: C23H38N2O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.275,"smiles":null,"spectrum_id":"CCMSLIB00017288946","spectrum_index":37890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Methoxy-5H-dibenzo[b,f]azepine (delta mass: 15.023 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.13,"smiles":null,"spectrum_id":"CCMSLIB00017288949","spectrum_index":37891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 208.1833 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.27,"smiles":null,"spectrum_id":"CCMSLIB00017288952","spectrum_index":37892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"6-(2-methylpropoxy)-2,3,4,9-tetrahydro-4aH-carbazol-1-one CollisionEnergy:205060\"\" (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.155,"smiles":null,"spectrum_id":"CCMSLIB00017288954","spectrum_index":37893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 29.0484 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.124,"smiles":null,"spectrum_id":"CCMSLIB00017288957","spectrum_index":37894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 127.1203 Da; putative annotation: N/A; putative formula: C5H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.18,"smiles":null,"spectrum_id":"CCMSLIB00017288960","spectrum_index":37895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 87.5487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.62,"smiles":null,"spectrum_id":"CCMSLIB00017288963","spectrum_index":37896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 458.2278 Da; putative annotation: N/A; putative formula: C22H30N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.325,"smiles":null,"spectrum_id":"CCMSLIB00017288965","spectrum_index":37897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Methylamino)-2,4,6-cycloheptatriene-1-thione (delta mass: 85.0261 Da; putative annotation: N/A; putative formula: C2H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.079,"smiles":null,"spectrum_id":"CCMSLIB00017288968","spectrum_index":37898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 94.0359 Da; putative annotation: N/A; putative formula: C6H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.096,"smiles":null,"spectrum_id":"CCMSLIB00017288971","spectrum_index":37899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-2-carbaldehyde (delta mass: 76.031 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.086,"smiles":null,"spectrum_id":"CCMSLIB00017288973","spectrum_index":37900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 268.0879 Da; putative annotation: N/A; putative formula: C14H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.237,"smiles":null,"spectrum_id":"CCMSLIB00017288976","spectrum_index":37901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 287.1847 Da; putative annotation: N/A; putative formula: C8H22N11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.339,"smiles":null,"spectrum_id":"CCMSLIB00017288979","spectrum_index":37902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 238.1204 Da; putative annotation: N/A; putative formula: C13H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.202,"smiles":null,"spectrum_id":"CCMSLIB00017288982","spectrum_index":37903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutaecarpine (delta mass: 17.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.134,"smiles":null,"spectrum_id":"CCMSLIB00017288985","spectrum_index":37904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 1036.2641 Da; putative annotation: N/A; putative formula: C53H48O22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1541.44,"smiles":null,"spectrum_id":"CCMSLIB00017288987","spectrum_index":37905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 1041.2543 Da; putative annotation: N/A; putative formula: C41H54N7O17P3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1546.43,"smiles":null,"spectrum_id":"CCMSLIB00017288990","spectrum_index":37906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 435.8974 Da; putative annotation: N/A; putative formula: C14H13O2PS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.984,"smiles":null,"spectrum_id":"CCMSLIB00017288993","spectrum_index":37907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 100.0722 Da; putative annotation: N/A; putative formula: C6H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.153,"smiles":null,"spectrum_id":"CCMSLIB00017288995","spectrum_index":37908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 35.0375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.202,"smiles":null,"spectrum_id":"CCMSLIB00017288998","spectrum_index":37909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 149.0783 Da; putative annotation: N/A; putative formula: C4H11N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.182,"smiles":null,"spectrum_id":"CCMSLIB00017289001","spectrum_index":37910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 30.0 eV (delta mass: 238.0085 Da; putative annotation: N/A; putative formula: C6H2N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.079,"smiles":null,"spectrum_id":"CCMSLIB00017289003","spectrum_index":37911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine (delta mass: 284.1403 Da; putative annotation: N/A; putative formula: C12H21N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.248,"smiles":null,"spectrum_id":"CCMSLIB00017289006","spectrum_index":37912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 36.0247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.13,"smiles":null,"spectrum_id":"CCMSLIB00017289009","spectrum_index":37913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00017 Biotin (delta mass: 107.033 Da; putative annotation: N/A; putative formula: CH5N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.128,"smiles":null,"spectrum_id":"CCMSLIB00017289012","spectrum_index":37914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 162.0675 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017289014","spectrum_index":37915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-MANNOSAMINE - 30.0 eV (delta mass: 689.5509 Da; putative annotation: N/A; putative formula: C42H76NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.638,"smiles":null,"spectrum_id":"CCMSLIB00017289017","spectrum_index":37916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N'-(7-Fluoropyrrolo[1,2-a]quinoxalin-4-yl)pyrazinohydrazide (delta mass: 161.0378 Da; putative annotation: N/A; putative formula: C11H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.143,"smiles":null,"spectrum_id":"CCMSLIB00017289020","spectrum_index":37917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017289023","spectrum_index":37918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 20.0 eV (delta mass: 453.6496 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.763,"smiles":null,"spectrum_id":"CCMSLIB00017289025","spectrum_index":37919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 115.0253 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.117,"smiles":null,"spectrum_id":"CCMSLIB00017289028","spectrum_index":37920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C15:1 (delta mass: 16.0304 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.394,"smiles":null,"spectrum_id":"CCMSLIB00017289030","spectrum_index":37921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1114.6677 Da; putative annotation: N/A; putative formula: C60H90N8O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1336.76,"smiles":null,"spectrum_id":"CCMSLIB00017289034","spectrum_index":37922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 56.0264 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.118,"smiles":null,"spectrum_id":"CCMSLIB00017289036","spectrum_index":37923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 15.0482 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.098,"smiles":null,"spectrum_id":"CCMSLIB00017289039","spectrum_index":37924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 463.1051 Da; putative annotation: N/A; putative formula: C20H21N3O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.255,"smiles":null,"spectrum_id":"CCMSLIB00017289042","spectrum_index":37925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 180.0724 Da; putative annotation: N/A; putative formula: C9H12N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.16,"smiles":null,"spectrum_id":"CCMSLIB00017289043","spectrum_index":37926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 146.0729 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.237,"smiles":null,"spectrum_id":"CCMSLIB00017289046","spectrum_index":37927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 438.1343 Da; putative annotation: N/A; putative formula: C26H14N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.21,"smiles":null,"spectrum_id":"CCMSLIB00017289049","spectrum_index":37928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 479.2736 Da; putative annotation: N/A; putative formula: C25H42N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.328,"smiles":null,"spectrum_id":"CCMSLIB00017289052","spectrum_index":37929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NL3680000 - 40.0 eV (delta mass: 168.0997 Da; putative annotation: N/A; putative formula: C3H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.17,"smiles":null,"spectrum_id":"CCMSLIB00017289053","spectrum_index":37930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 137.0559 Da; putative annotation: N/A; putative formula: C2H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.12,"smiles":null,"spectrum_id":"CCMSLIB00017289056","spectrum_index":37931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 76.0424 Da; putative annotation: N/A; putative formula: C5H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.165,"smiles":null,"spectrum_id":"CCMSLIB00017289059","spectrum_index":37932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 829.612 Da; putative annotation: N/A; putative formula: C55H79N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1018.76,"smiles":null,"spectrum_id":"CCMSLIB00017289062","spectrum_index":37933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 90.0641 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.13,"smiles":null,"spectrum_id":"CCMSLIB00017289063","spectrum_index":37934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 213.0334 Da; putative annotation: N/A; putative formula: C4H12N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.12,"smiles":null,"spectrum_id":"CCMSLIB00017289066","spectrum_index":37935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 243.2564 Da; putative annotation: N/A; putative formula: C11H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.405,"smiles":null,"spectrum_id":"CCMSLIB00017289069","spectrum_index":37936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 51.0439 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.104,"smiles":null,"spectrum_id":"CCMSLIB00017289072","spectrum_index":37937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 172.0064 Da; putative annotation: N/A; putative formula: C4H4N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.098,"smiles":null,"spectrum_id":"CCMSLIB00017289073","spectrum_index":37938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:102040 (delta mass: 90.0313 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.112,"smiles":null,"spectrum_id":"CCMSLIB00017289076","spectrum_index":37939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 76.0674 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.2,"smiles":null,"spectrum_id":"CCMSLIB00017289079","spectrum_index":37940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 306.0019 Da; putative annotation: N/A; putative formula: C6H6N6O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.14,"smiles":null,"spectrum_id":"CCMSLIB00017289082","spectrum_index":37941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 102.0312 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.191,"smiles":null,"spectrum_id":"CCMSLIB00017289083","spectrum_index":37942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 120.0934 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.331,"smiles":null,"spectrum_id":"CCMSLIB00017289086","spectrum_index":37943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 64.0314 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017289089","spectrum_index":37944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 102.0725 Da; putative annotation: N/A; putative formula: C4H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.16,"smiles":null,"spectrum_id":"CCMSLIB00017289092","spectrum_index":37945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 358.1972 Da; putative annotation: N/A; putative formula: C22H30O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.294,"smiles":null,"spectrum_id":"CCMSLIB00017289095","spectrum_index":37946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Arabinose (delta mass: 352.0734 Da; putative annotation: N/A; putative formula: C23H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.134,"smiles":null,"spectrum_id":"CCMSLIB00017289097","spectrum_index":37947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 201.1115 Da; putative annotation: N/A; putative formula: C8H15N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.214,"smiles":null,"spectrum_id":"CCMSLIB00017289100","spectrum_index":37948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol CollisionEnergy:102040\"\" (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.212,"smiles":null,"spectrum_id":"CCMSLIB00017289103","spectrum_index":37949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 512.4575 Da; putative annotation: N/A; putative formula: C31H56N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.554,"smiles":null,"spectrum_id":"CCMSLIB00017289105","spectrum_index":37950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 5.012 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.034,"smiles":null,"spectrum_id":"CCMSLIB00017289108","spectrum_index":37951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 70.0051 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.107,"smiles":null,"spectrum_id":"CCMSLIB00017289111","spectrum_index":37952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 62.0162 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.262,"smiles":null,"spectrum_id":"CCMSLIB00017289113","spectrum_index":37953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Ala (delta mass: 113.0861 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.2,"smiles":null,"spectrum_id":"CCMSLIB00017289116","spectrum_index":37954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 86.0488 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.124,"smiles":null,"spectrum_id":"CCMSLIB00017289119","spectrum_index":37955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 77.0629 Da; putative annotation: N/A; putative formula: C6H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.144,"smiles":null,"spectrum_id":"CCMSLIB00017289122","spectrum_index":37956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 17.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.09,"smiles":null,"spectrum_id":"CCMSLIB00017289125","spectrum_index":37957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 98.0934 Da; putative annotation: N/A; putative formula: C4H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.164,"smiles":null,"spectrum_id":"CCMSLIB00017289127","spectrum_index":37958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 199.1194 Da; putative annotation: N/A; putative formula: C6H13N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.215,"smiles":null,"spectrum_id":"CCMSLIB00017289129","spectrum_index":37959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-N-phenyl-1H-indole-2-carboxamide (delta mass: 53.0688 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.187,"smiles":null,"spectrum_id":"CCMSLIB00017289132","spectrum_index":37960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 115.0993 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.164,"smiles":null,"spectrum_id":"CCMSLIB00017289135","spectrum_index":37961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 24.966 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.042,"smiles":null,"spectrum_id":"CCMSLIB00017289136","spectrum_index":37962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid (delta mass: 384.1215 Da; putative annotation: N/A; putative formula: C13H26N2O7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.217,"smiles":null,"spectrum_id":"CCMSLIB00017289139","spectrum_index":37963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 266.7635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.876,"smiles":null,"spectrum_id":"CCMSLIB00017289142","spectrum_index":37964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 104.0296 Da; putative annotation: N/A; putative formula: C4H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.084,"smiles":null,"spectrum_id":"CCMSLIB00017289145","spectrum_index":37965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 148.0781 Da; putative annotation: N/A; putative formula: C4H12N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.217,"smiles":null,"spectrum_id":"CCMSLIB00017289147","spectrum_index":37966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 466.2442 Da; putative annotation: N/A; putative formula: C23H30N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.325,"smiles":null,"spectrum_id":"CCMSLIB00017289149","spectrum_index":37967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 91.0253 Da; putative annotation: N/A; putative formula: C2H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.107,"smiles":null,"spectrum_id":"CCMSLIB00017289152","spectrum_index":37968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 163.0646 Da; putative annotation: L-Tyrosine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.135,"smiles":null,"spectrum_id":"CCMSLIB00017289155","spectrum_index":37969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 53.0625 Da; putative annotation: Pyrrolidine; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.154,"smiles":null,"spectrum_id":"CCMSLIB00017289156","spectrum_index":37970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 348.2291 Da; putative annotation: 3.beta.-Allotetrahydrocortisol; putative formula: C21H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.289,"smiles":null,"spectrum_id":"CCMSLIB00017289160","spectrum_index":37971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 265.045 Da; putative annotation: 1,4-Diamino-2-nitroanthraquinone; putative formula: C14H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.105,"smiles":null,"spectrum_id":"CCMSLIB00017289162","spectrum_index":37972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 190.0264 Da; putative annotation: 2-((3-Hydroxybenzoyl)oxy)prop-2-enoic acid; putative formula: C10H6O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.092,"smiles":null,"spectrum_id":"CCMSLIB00017289165","spectrum_index":37973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match] (delta mass: 303.256 Da; putative annotation: .gamma.-Linolenoyl ethanolamide; putative formula: C20H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.525,"smiles":null,"spectrum_id":"CCMSLIB00017289168","spectrum_index":37974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 286.1936 Da; putative annotation: h_118_4_hydroxytestosterone; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.264,"smiles":null,"spectrum_id":"CCMSLIB00017289170","spectrum_index":37975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 190.0986 Da; putative annotation: N/A; putative formula: C6H15N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.185,"smiles":null,"spectrum_id":"CCMSLIB00017289172","spectrum_index":37976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 94.0566 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.18,"smiles":null,"spectrum_id":"CCMSLIB00017289175","spectrum_index":37977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 102.0312 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.185,"smiles":null,"spectrum_id":"CCMSLIB00017289178","spectrum_index":37978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MEVALONOLACTONE (delta mass: 142.0453 Da; putative annotation: N/A; putative formula: C7H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.116,"smiles":null,"spectrum_id":"CCMSLIB00017289180","spectrum_index":37979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 380.2323 Da; putative annotation: N/A; putative formula: C21H28N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.357,"smiles":null,"spectrum_id":"CCMSLIB00017289183","spectrum_index":37980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 150.0797 Da; putative annotation: N/A; putative formula: C8H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.193,"smiles":null,"spectrum_id":"CCMSLIB00017289186","spectrum_index":37981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 78.0448 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.1,"smiles":null,"spectrum_id":"CCMSLIB00017289189","spectrum_index":37982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 184.0626 Da; putative annotation: N/A; putative formula: C5H9N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.202,"smiles":null,"spectrum_id":"CCMSLIB00017289191","spectrum_index":37983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 16.9041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.991,"smiles":null,"spectrum_id":"CCMSLIB00017289194","spectrum_index":37984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 98.0674 Da; putative annotation: N/A; putative formula: C6H11O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.221,"smiles":null,"spectrum_id":"CCMSLIB00017289197","spectrum_index":37985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 89.081 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.176,"smiles":null,"spectrum_id":"CCMSLIB00017289199","spectrum_index":37986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 198.162 Da; putative annotation: N/A; putative formula: C12H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.238,"smiles":null,"spectrum_id":"CCMSLIB00017289202","spectrum_index":37987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 425.2777 Da; putative annotation: N/A; putative formula: C23H39NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.348,"smiles":null,"spectrum_id":"CCMSLIB00017289204","spectrum_index":37988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 28.0017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.073,"smiles":null,"spectrum_id":"CCMSLIB00017289207","spectrum_index":37989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 138.0429 Da; putative annotation: N/A; putative formula: C6H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.119,"smiles":null,"spectrum_id":"CCMSLIB00017289209","spectrum_index":37990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 221.1055 Da; putative annotation: N/A; putative formula: C12H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.181,"smiles":null,"spectrum_id":"CCMSLIB00017289212","spectrum_index":37991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 342.2346 Da; putative annotation: N/A; putative formula: C26H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.394,"smiles":null,"spectrum_id":"CCMSLIB00017289215","spectrum_index":37992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 782.4819 Da; putative annotation: N/A; putative formula: C42H70O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.542,"smiles":null,"spectrum_id":"CCMSLIB00017289217","spectrum_index":37993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 270.8371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.913,"smiles":null,"spectrum_id":"CCMSLIB00017289219","spectrum_index":37994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 95.0727 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.196,"smiles":null,"spectrum_id":"CCMSLIB00017289222","spectrum_index":37995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 281.1908 Da; putative annotation: N/A; putative formula: C16H28NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.36,"smiles":null,"spectrum_id":"CCMSLIB00017289225","spectrum_index":37996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 298.2716 Da; putative annotation: N/A; putative formula: C12H30N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.425,"smiles":null,"spectrum_id":"CCMSLIB00017289226","spectrum_index":37997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 93.076 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.158,"smiles":null,"spectrum_id":"CCMSLIB00017289229","spectrum_index":37998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 77.037 Da; putative annotation: N/A; putative formula: C4H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.108,"smiles":null,"spectrum_id":"CCMSLIB00017289232","spectrum_index":37999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 260.1313 Da; putative annotation: N/A; putative formula: C18H16N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.218,"smiles":null,"spectrum_id":"CCMSLIB00017289235","spectrum_index":38000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 310.1784 Da; putative annotation: N/A; putative formula: C10H26N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.249,"smiles":null,"spectrum_id":"CCMSLIB00017289237","spectrum_index":38001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 180.0788 Da; putative annotation: N/A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017289239","spectrum_index":38002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 111.0554 Da; putative annotation: N/A; putative formula: C3H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.173,"smiles":null,"spectrum_id":"CCMSLIB00017289242","spectrum_index":38003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 313.1173 Da; putative annotation: N/A; putative formula: C15H15N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.271,"smiles":null,"spectrum_id":"CCMSLIB00017289245","spectrum_index":38004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084605 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 116.0542 Da; putative annotation: N/A; putative formula: C3H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.109,"smiles":null,"spectrum_id":"CCMSLIB00017289248","spectrum_index":38005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 242.987 Da; putative annotation: N/A; putative formula: C5H9NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.078,"smiles":null,"spectrum_id":"CCMSLIB00017289249","spectrum_index":38006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 88.0161 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017289252","spectrum_index":38007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 226.0624 Da; putative annotation: N/A; putative formula: C14H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.185,"smiles":null,"spectrum_id":"CCMSLIB00017289255","spectrum_index":38008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 327.1165 Da; putative annotation: N/A; putative formula: C11H21NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.281,"smiles":null,"spectrum_id":"CCMSLIB00017289258","spectrum_index":38009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 205.007 Da; putative annotation: N/A; putative formula: C7H5N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.088,"smiles":null,"spectrum_id":"CCMSLIB00017289260","spectrum_index":38010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 165.0793 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.185,"smiles":null,"spectrum_id":"CCMSLIB00017289262","spectrum_index":38011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 809.2802 Da; putative annotation: N/A; putative formula: C30H51NO24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.34,"smiles":null,"spectrum_id":"CCMSLIB00017289265","spectrum_index":38012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2'-Deoxycytidine (delta mass: 93.025 Da; putative annotation: N/A; putative formula: C5H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.123,"smiles":null,"spectrum_id":"CCMSLIB00017289268","spectrum_index":38013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 140.0187 Da; putative annotation: N/A; putative formula: H4N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.09,"smiles":null,"spectrum_id":"CCMSLIB00017289271","spectrum_index":38014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 244.8028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.989,"smiles":null,"spectrum_id":"CCMSLIB00017289273","spectrum_index":38015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 194.0251 Da; putative annotation: N/A; putative formula: C6H10O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.179,"smiles":null,"spectrum_id":"CCMSLIB00017289275","spectrum_index":38016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 229.1279 Da; putative annotation: N/A; putative formula: C7H15N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.205,"smiles":null,"spectrum_id":"CCMSLIB00017289278","spectrum_index":38017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 207.1468 Da; putative annotation: N/A; putative formula: C10H17N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.295,"smiles":null,"spectrum_id":"CCMSLIB00017289281","spectrum_index":38018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 328.1739 Da; putative annotation: N/A; putative formula: C14H24N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.271,"smiles":null,"spectrum_id":"CCMSLIB00017289283","spectrum_index":38019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norharmane (delta mass: 62.1183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.194,"smiles":null,"spectrum_id":"CCMSLIB00017289285","spectrum_index":38020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 113.0801 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.166,"smiles":null,"spectrum_id":"CCMSLIB00017289288","spectrum_index":38021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 115.0632 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.123,"smiles":null,"spectrum_id":"CCMSLIB00017289291","spectrum_index":38022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 97.967 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.053,"smiles":null,"spectrum_id":"CCMSLIB00017289294","spectrum_index":38023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 400.1753 Da; putative annotation: N/A; putative formula: C21H28N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.256,"smiles":null,"spectrum_id":"CCMSLIB00017289295","spectrum_index":38024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 295.2728 Da; putative annotation: N/A; putative formula: C16H33N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.339,"smiles":null,"spectrum_id":"CCMSLIB00017289298","spectrum_index":38025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 35.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.201,"smiles":null,"spectrum_id":"CCMSLIB00017289301","spectrum_index":38026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 102.0043 Da; putative annotation: N/A; putative formula: C4H7O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.106,"smiles":null,"spectrum_id":"CCMSLIB00017289304","spectrum_index":38027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 260.1128 Da; putative annotation: N/A; putative formula: C10H20N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.266,"smiles":null,"spectrum_id":"CCMSLIB00017289305","spectrum_index":38028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 152.1186 Da; putative annotation: N/A; putative formula: C6H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.262,"smiles":null,"spectrum_id":"CCMSLIB00017289308","spectrum_index":38029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-3-(1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole (delta mass: 63.0403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.124,"smiles":null,"spectrum_id":"CCMSLIB00017289311","spectrum_index":38030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 74.0746 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.146,"smiles":null,"spectrum_id":"CCMSLIB00017289314","spectrum_index":38031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5S,6R)-2-[(3R)-1,7-bis(3,4-dihydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 78.0404 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.263,"smiles":null,"spectrum_id":"CCMSLIB00017289316","spectrum_index":38032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU277306 Creatinine|2-amino-3-methyl-4H-imidazol-5-one (delta mass: 44.0882 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.154,"smiles":null,"spectrum_id":"CCMSLIB00017289318","spectrum_index":38033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 264.2452 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.332,"smiles":null,"spectrum_id":"CCMSLIB00017289321","spectrum_index":38034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 16-hydroxy-4,4,8,12,16-pentamethyl-15,17,19-trioxo-3,19-epoxyandrost-11-ene-14-carboxylate (delta mass: 422.1888 Da; putative annotation: N/A; putative formula: C22H26N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.427,"smiles":null,"spectrum_id":"CCMSLIB00017289323","spectrum_index":38035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 72.0554 Da; putative annotation: N/A; putative formula: H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.126,"smiles":null,"spectrum_id":"CCMSLIB00017289326","spectrum_index":38036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 67.0933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.158,"smiles":null,"spectrum_id":"CCMSLIB00017289329","spectrum_index":38037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 132.0474 Da; putative annotation: N/A; putative formula: C8H5FN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.108,"smiles":null,"spectrum_id":"CCMSLIB00017289331","spectrum_index":38038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 273.2677 Da; putative annotation: N/A; putative formula: C12H31N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.364,"smiles":null,"spectrum_id":"CCMSLIB00017289333","spectrum_index":38039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 146.0787 Da; putative annotation: N/A; putative formula: C7H16O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.177,"smiles":null,"spectrum_id":"CCMSLIB00017289336","spectrum_index":38040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 227.2608 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.332,"smiles":null,"spectrum_id":"CCMSLIB00017289339","spectrum_index":38041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(1H-Indazol-5-yl)-2-(6-methyl-2-pyridinyl)-4-quinazolinamine (delta mass: 61.0622 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.213,"smiles":null,"spectrum_id":"CCMSLIB00017289340","spectrum_index":38042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 294.0919 Da; putative annotation: N/A; putative formula: C17H15N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.251,"smiles":null,"spectrum_id":"CCMSLIB00017289343","spectrum_index":38043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 9.9846 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.092,"smiles":null,"spectrum_id":"CCMSLIB00017289345","spectrum_index":38044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-3-carboxylic acid (delta mass: 110.037 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.071,"smiles":null,"spectrum_id":"CCMSLIB00017289348","spectrum_index":38045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 211.0957 Da; putative annotation: N/A; putative formula: C9H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.16,"smiles":null,"spectrum_id":"CCMSLIB00017289351","spectrum_index":38046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 130.1357 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.243,"smiles":null,"spectrum_id":"CCMSLIB00017289353","spectrum_index":38047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 66.0509 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.21,"smiles":null,"spectrum_id":"CCMSLIB00017289355","spectrum_index":38048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE (delta mass: 61.0045 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017289358","spectrum_index":38049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NL3680000 - 40.0 eV (delta mass: 126.0827 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.153,"smiles":null,"spectrum_id":"CCMSLIB00017289360","spectrum_index":38050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 32.0329 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017289363","spectrum_index":38051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 39.0837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.18,"smiles":null,"spectrum_id":"CCMSLIB00017289365","spectrum_index":38052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2,3-dimethyl-1H-indole (delta mass: 143.0816 Da; putative annotation: N/A; putative formula: C4H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.139,"smiles":null,"spectrum_id":"CCMSLIB00017289368","spectrum_index":38053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4H-Pyrrolo[3,2-c]pyridin-4-one, 1,5,6,7-tetrahydro-2-[2-(3-quinolinyl)-4-pyridinyl]- (delta mass: 18.0123 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.152,"smiles":null,"spectrum_id":"CCMSLIB00017289371","spectrum_index":38054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 228.1365 Da; putative annotation: N/A; putative formula: C12H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.265,"smiles":null,"spectrum_id":"CCMSLIB00017289373","spectrum_index":38055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 89.0418 Da; putative annotation: N/A; putative formula: C2H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.138,"smiles":null,"spectrum_id":"CCMSLIB00017289376","spectrum_index":38056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 311.2824 Da; putative annotation: N/A; putative formula: C19H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.415,"smiles":null,"spectrum_id":"CCMSLIB00017289379","spectrum_index":38057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epinephrine (delta mass: 248.2518 Da; putative annotation: N/A; putative formula: C18H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.349,"smiles":null,"spectrum_id":"CCMSLIB00017289381","spectrum_index":38058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 344.1606 Da; putative annotation: N/A; putative formula: C17H16N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.247,"smiles":null,"spectrum_id":"CCMSLIB00017289383","spectrum_index":38059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 218.0277 Da; putative annotation: N/A; putative formula: C9H8N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.087,"smiles":null,"spectrum_id":"CCMSLIB00017289386","spectrum_index":38060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 147.0482 Da; putative annotation: N/A; putative formula: C4H11N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.124,"smiles":null,"spectrum_id":"CCMSLIB00017289388","spectrum_index":38061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 106.0263 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.128,"smiles":null,"spectrum_id":"CCMSLIB00017289390","spectrum_index":38062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017289393","spectrum_index":38063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 109.0529 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.155,"smiles":null,"spectrum_id":"CCMSLIB00017289396","spectrum_index":38064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 74.0369 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.097,"smiles":null,"spectrum_id":"CCMSLIB00017289398","spectrum_index":38065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 123.099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.175,"smiles":null,"spectrum_id":"CCMSLIB00017289401","spectrum_index":38066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 114.0832 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.326,"smiles":null,"spectrum_id":"CCMSLIB00017289403","spectrum_index":38067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 31.043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.166,"smiles":null,"spectrum_id":"CCMSLIB00017289405","spectrum_index":38068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 271.1628 Da; putative annotation: N/A; putative formula: C13H26N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.233,"smiles":null,"spectrum_id":"CCMSLIB00017289408","spectrum_index":38069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 187.0273 Da; putative annotation: N/A; putative formula: C3H5N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.156,"smiles":null,"spectrum_id":"CCMSLIB00017289411","spectrum_index":38070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-aminobenzoic acid (delta mass: 94.0423 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.097,"smiles":null,"spectrum_id":"CCMSLIB00017289413","spectrum_index":38071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 702.4829 Da; putative annotation: N/A; putative formula: C41H62N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.57,"smiles":null,"spectrum_id":"CCMSLIB00017289415","spectrum_index":38072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 248.1778 Da; putative annotation: N/A; putative formula: C16H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.259,"smiles":null,"spectrum_id":"CCMSLIB00017289418","spectrum_index":38073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ332502 Epinephrine|4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol (delta mass: 135.0687 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017289420","spectrum_index":38074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 12.0113 Da; putative annotation: N/A; putative formula: N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017289423","spectrum_index":38075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 316.1657 Da; putative annotation: N/A; putative formula: C13H25N4O3P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.257,"smiles":null,"spectrum_id":"CCMSLIB00017289425","spectrum_index":38076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 204.1332 Da; putative annotation: N/A; putative formula: C6H16N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.214,"smiles":null,"spectrum_id":"CCMSLIB00017289427","spectrum_index":38077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one (delta mass: 46.0616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.143,"smiles":null,"spectrum_id":"CCMSLIB00017289430","spectrum_index":38078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 69.0464 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.097,"smiles":null,"spectrum_id":"CCMSLIB00017289432","spectrum_index":38079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 105.2245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.337,"smiles":null,"spectrum_id":"CCMSLIB00017289435","spectrum_index":38080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 356.2704 Da; putative annotation: N/A; putative formula: C18H37N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.357,"smiles":null,"spectrum_id":"CCMSLIB00017289438","spectrum_index":38081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 145.0538 Da; putative annotation: N/A; putative formula: C2H7N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.149,"smiles":null,"spectrum_id":"CCMSLIB00017289440","spectrum_index":38082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 167.1094 Da; putative annotation: N/A; putative formula: C13H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.191,"smiles":null,"spectrum_id":"CCMSLIB00017289443","spectrum_index":38083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 527.2004 Da; putative annotation: N/A; putative formula: C30H25N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.271,"smiles":null,"spectrum_id":"CCMSLIB00017289445","spectrum_index":38084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 337.1236 Da; putative annotation: N/A; putative formula: C10H19N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.199,"smiles":null,"spectrum_id":"CCMSLIB00017289448","spectrum_index":38085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 403.304 Da; putative annotation: N/A; putative formula: C20H41N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.395,"smiles":null,"spectrum_id":"CCMSLIB00017289451","spectrum_index":38086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylserotonin (delta mass: 98.0211 Da; putative annotation: N/A; putative formula: C2H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.134,"smiles":null,"spectrum_id":"CCMSLIB00017289453","spectrum_index":38087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 314.2164 Da; putative annotation: N/A; putative formula: C21H31P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.288,"smiles":null,"spectrum_id":"CCMSLIB00017289455","spectrum_index":38088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 823.2958 Da; putative annotation: N/A; putative formula: C31H53NO24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":986.356,"smiles":null,"spectrum_id":"CCMSLIB00017289458","spectrum_index":38089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyltapentadol (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.196,"smiles":null,"spectrum_id":"CCMSLIB00017289460","spectrum_index":38090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 54.0828 Da; putative annotation: N/A; putative formula: C5H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.179,"smiles":null,"spectrum_id":"CCMSLIB00017289463","spectrum_index":38091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 45.021 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.097,"smiles":null,"spectrum_id":"CCMSLIB00017289466","spectrum_index":38092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 837.5746 Da; putative annotation: N/A; putative formula: C45H84N5O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1082.67,"smiles":null,"spectrum_id":"CCMSLIB00017289467","spectrum_index":38093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 42.9884 Da; putative annotation: N/A; putative formula: CHNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.075,"smiles":null,"spectrum_id":"CCMSLIB00017289470","spectrum_index":38094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 248.2494 Da; putative annotation: N/A; putative formula: C18H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.336,"smiles":null,"spectrum_id":"CCMSLIB00017289473","spectrum_index":38095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 895.2994 Da; putative annotation: N/A; putative formula: C53H41N11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1562.53,"smiles":null,"spectrum_id":"CCMSLIB00017289475","spectrum_index":38096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 134.0802 Da; putative annotation: N/A; putative formula: C3H10N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.176,"smiles":null,"spectrum_id":"CCMSLIB00017289478","spectrum_index":38097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 84.0153 Da; putative annotation: N/A; putative formula: C3H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.192,"smiles":null,"spectrum_id":"CCMSLIB00017289481","spectrum_index":38098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 206.1153 Da; putative annotation: N/A; putative formula: C9H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.285,"smiles":null,"spectrum_id":"CCMSLIB00017289484","spectrum_index":38099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 375.2114 Da; putative annotation: N/A; putative formula: C25H30NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.282,"smiles":null,"spectrum_id":"CCMSLIB00017289485","spectrum_index":38100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-(Desmorpholinopropyl)gefitinib (delta mass: 59.0576 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.117,"smiles":null,"spectrum_id":"CCMSLIB00017289488","spectrum_index":38101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 697.5323 Da; putative annotation: N/A; putative formula: C40H75NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.604,"smiles":null,"spectrum_id":"CCMSLIB00017289491","spectrum_index":38102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Ethynyl-1H-indole (delta mass: 70.0166 Da; putative annotation: N/A; putative formula: C2H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.082,"smiles":null,"spectrum_id":"CCMSLIB00017289493","spectrum_index":38103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 104.0678 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.165,"smiles":null,"spectrum_id":"CCMSLIB00017289496","spectrum_index":38104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 107.0405 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.142,"smiles":null,"spectrum_id":"CCMSLIB00017289498","spectrum_index":38105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 41.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.117,"smiles":null,"spectrum_id":"CCMSLIB00017289501","spectrum_index":38106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 227.2451 Da; putative annotation: N/A; putative formula: C12H29N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.291,"smiles":null,"spectrum_id":"CCMSLIB00017289503","spectrum_index":38107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 67.0444 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.183,"smiles":null,"spectrum_id":"CCMSLIB00017289506","spectrum_index":38108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 8.0044 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.174,"smiles":null,"spectrum_id":"CCMSLIB00017289508","spectrum_index":38109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-[(4-methyl-1-piperazinyl)carbonyl]-1H-indole (delta mass: 58.0515 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.212,"smiles":null,"spectrum_id":"CCMSLIB00017289510","spectrum_index":38110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Ile (delta mass: 156.09 Da; putative annotation: N/A; putative formula: C7H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.26,"smiles":null,"spectrum_id":"CCMSLIB00017289513","spectrum_index":38111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 103.0405 Da; putative annotation: N/A; putative formula: C7H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.143,"smiles":null,"spectrum_id":"CCMSLIB00017289514","spectrum_index":38112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 47.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.191,"smiles":null,"spectrum_id":"CCMSLIB00017289517","spectrum_index":38113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 855.5339 Da; putative annotation: N/A; putative formula: C58H69N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1080.65,"smiles":null,"spectrum_id":"CCMSLIB00017289520","spectrum_index":38114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 103.0657 Da; putative annotation: N/A; putative formula: C3H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.14,"smiles":null,"spectrum_id":"CCMSLIB00017289522","spectrum_index":38115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 105.0757 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.15,"smiles":null,"spectrum_id":"CCMSLIB00017289524","spectrum_index":38116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 23.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017289527","spectrum_index":38117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 29.9986 Da; putative annotation: N/A; putative formula: CH3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.101,"smiles":null,"spectrum_id":"CCMSLIB00017289529","spectrum_index":38118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 289.1388 Da; putative annotation: N/A; putative formula: C10H19N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.319,"smiles":null,"spectrum_id":"CCMSLIB00017289532","spectrum_index":38119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 52.0306 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.111,"smiles":null,"spectrum_id":"CCMSLIB00017289534","spectrum_index":38120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 347.1754 Da; putative annotation: N/A; putative formula: C13H21N11O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.272,"smiles":null,"spectrum_id":"CCMSLIB00017289537","spectrum_index":38121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltotriose from NIST14 (delta mass: 318.2559 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":823.432,"smiles":null,"spectrum_id":"CCMSLIB00017289539","spectrum_index":38122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 187.1354 Da; putative annotation: N/A; putative formula: C13H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.206,"smiles":null,"spectrum_id":"CCMSLIB00017289542","spectrum_index":38123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 148.087 Da; putative annotation: N/A; putative formula: C4H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.236,"smiles":null,"spectrum_id":"CCMSLIB00017289545","spectrum_index":38124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU022001 Labetalol|2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide (delta mass: 105.0358 Da; putative annotation: N/A; putative formula: C2H7N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.222,"smiles":null,"spectrum_id":"CCMSLIB00017289546","spectrum_index":38125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 149.1053 Da; putative annotation: N/A; putative formula: C7H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.186,"smiles":null,"spectrum_id":"CCMSLIB00017289549","spectrum_index":38126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 274.1698 Da; putative annotation: N/A; putative formula: C14H27O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.204,"smiles":null,"spectrum_id":"CCMSLIB00017289552","spectrum_index":38127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 262.2507 Da; putative annotation: N/A; putative formula: C16H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.41,"smiles":null,"spectrum_id":"CCMSLIB00017289554","spectrum_index":38128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 61.0178 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.213,"smiles":null,"spectrum_id":"CCMSLIB00017289556","spectrum_index":38129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 398.2014 Da; putative annotation: N/A; putative formula: C14H30N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.298,"smiles":null,"spectrum_id":"CCMSLIB00017289559","spectrum_index":38130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 319.3088 Da; putative annotation: N/A; putative formula: C19H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.369,"smiles":null,"spectrum_id":"CCMSLIB00017289562","spectrum_index":38131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 30.0098 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.159,"smiles":null,"spectrum_id":"CCMSLIB00017289563","spectrum_index":38132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 51.1629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.258,"smiles":null,"spectrum_id":"CCMSLIB00017289566","spectrum_index":38133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 45.9332 Da; putative annotation: N/A; putative formula: H-2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.01,"smiles":null,"spectrum_id":"CCMSLIB00017289569","spectrum_index":38134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olodaterol (delta mass: 186.0611 Da; putative annotation: N/A; putative formula: C3H6N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.253,"smiles":null,"spectrum_id":"CCMSLIB00017289571","spectrum_index":38135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 8.0052 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.065,"smiles":null,"spectrum_id":"CCMSLIB00017289573","spectrum_index":38136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zilpaterol (delta mass: 174.0432 Da; putative annotation: N/A; putative formula: C9H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.198,"smiles":null,"spectrum_id":"CCMSLIB00017289576","spectrum_index":38137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 84.0444 Da; putative annotation: N/A; putative formula: C2H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.23,"smiles":null,"spectrum_id":"CCMSLIB00017289578","spectrum_index":38138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 312.1723 Da; putative annotation: N/A; putative formula: C20H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.253,"smiles":null,"spectrum_id":"CCMSLIB00017289580","spectrum_index":38139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 73.0864 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.188,"smiles":null,"spectrum_id":"CCMSLIB00017289582","spectrum_index":38140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 239.2606 Da; putative annotation: N/A; putative formula: C16H33N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.347,"smiles":null,"spectrum_id":"CCMSLIB00017289585","spectrum_index":38141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 39.049 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.115,"smiles":null,"spectrum_id":"CCMSLIB00017289586","spectrum_index":38142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 14.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.197,"smiles":null,"spectrum_id":"CCMSLIB00017289589","spectrum_index":38143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 217.1313 Da; putative annotation: N/A; putative formula: C10H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.202,"smiles":null,"spectrum_id":"CCMSLIB00017289592","spectrum_index":38144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 57.0102 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017289594","spectrum_index":38145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aflatoxin M1 (delta mass: 46.0058 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.071,"smiles":null,"spectrum_id":"CCMSLIB00017289596","spectrum_index":38146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 19.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017289599","spectrum_index":38147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 131.0582 Da; putative annotation: N/A; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017289601","spectrum_index":38148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 194.1787 Da; putative annotation: N/A; putative formula: C12H22N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.25,"smiles":null,"spectrum_id":"CCMSLIB00017289604","spectrum_index":38149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucine butyl ester (delta mass: 113.0839 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.248,"smiles":null,"spectrum_id":"CCMSLIB00017289607","spectrum_index":38150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 131.0707 Da; putative annotation: N/A; putative formula: C4H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.158,"smiles":null,"spectrum_id":"CCMSLIB00017289608","spectrum_index":38151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 54.0472 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.149,"smiles":null,"spectrum_id":"CCMSLIB00017289611","spectrum_index":38152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 12.0366 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017289612","spectrum_index":38153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 174.1047 Da; putative annotation: N/A; putative formula: C12H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.228,"smiles":null,"spectrum_id":"CCMSLIB00017289615","spectrum_index":38154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 112.0603 Da; putative annotation: N/A; putative formula: CH4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.136,"smiles":null,"spectrum_id":"CCMSLIB00017289617","spectrum_index":38155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 70.0 eV (delta mass: 73.0748 Da; putative annotation: N/A; putative formula: CH7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.177,"smiles":null,"spectrum_id":"CCMSLIB00017289620","spectrum_index":38156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 272.2328 Da; putative annotation: N/A; putative formula: C12H28N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.33,"smiles":null,"spectrum_id":"CCMSLIB00017289623","spectrum_index":38157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ruboxistaurin (delta mass: 58.0749 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.298,"smiles":null,"spectrum_id":"CCMSLIB00017289624","spectrum_index":38158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 214.1722 Da; putative annotation: N/A; putative formula: C16H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.232,"smiles":null,"spectrum_id":"CCMSLIB00017289627","spectrum_index":38159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 35.8956 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.008,"smiles":null,"spectrum_id":"CCMSLIB00017289629","spectrum_index":38160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Difenoxin (delta mass: 176.0332 Da; putative annotation: N/A; putative formula: C7H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.256,"smiles":null,"spectrum_id":"CCMSLIB00017289631","spectrum_index":38161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 120.0455 Da; putative annotation: N/A; putative formula: C3H9N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.153,"smiles":null,"spectrum_id":"CCMSLIB00017289634","spectrum_index":38162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 182.1053 Da; putative annotation: N/A; putative formula: C9H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.187,"smiles":null,"spectrum_id":"CCMSLIB00017289636","spectrum_index":38163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 113.0841 Da; putative annotation: Massbank:PB000396 Isoleucine|2-amino-3-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017289638","spectrum_index":38164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 102.0467 Da; putative annotation: 4-Vinylphenol; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017289641","spectrum_index":38165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 200.1161 Da; putative annotation: Ser-Ile; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.229,"smiles":null,"spectrum_id":"CCMSLIB00017289643","spectrum_index":38166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 200.1156 Da; putative annotation: Leu-Ser; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.25,"smiles":null,"spectrum_id":"CCMSLIB00017289646","spectrum_index":38167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 122.0334 Da; putative annotation: 3,5-Dihydroxybenzenemethanol; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.156,"smiles":null,"spectrum_id":"CCMSLIB00017289649","spectrum_index":38168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLPUTRESCINE (delta mass: 114.0778 Da; putative annotation: DL-Ornithine; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.196,"smiles":null,"spectrum_id":"CCMSLIB00017289650","spectrum_index":38169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 119.0735 Da; putative annotation: 3-Dimethylaminophenol; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.15,"smiles":null,"spectrum_id":"CCMSLIB00017289653","spectrum_index":38170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 690.4999 Da; putative annotation: Ionomycin; putative formula: C41H70O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":935.595,"smiles":null,"spectrum_id":"CCMSLIB00017289656","spectrum_index":38171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 245.0886 Da; putative annotation: 2-[(E)-2-(4-Hydroxyphenyl)ethenyl]quinolin-8-ol; putative formula: C17H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.159,"smiles":null,"spectrum_id":"CCMSLIB00017289658","spectrum_index":38172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:205060 (delta mass: 333.83 Da; putative annotation: N/A; putative formula: C3H4N4O-1P2S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.925,"smiles":null,"spectrum_id":"CCMSLIB00017289660","spectrum_index":38173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 169.0946 Da; putative annotation: N/A; putative formula: C2H7N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.197,"smiles":null,"spectrum_id":"CCMSLIB00017289663","spectrum_index":38174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 145.0532 Da; putative annotation: N/A; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017289665","spectrum_index":38175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 41.9742 Da; putative annotation: N/A; putative formula: CH-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.097,"smiles":null,"spectrum_id":"CCMSLIB00017289668","spectrum_index":38176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 361.2325 Da; putative annotation: N/A; putative formula: C15H31N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.303,"smiles":null,"spectrum_id":"CCMSLIB00017289670","spectrum_index":38177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 361.3207 Da; putative annotation: N/A; putative formula: C21H39N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.469,"smiles":null,"spectrum_id":"CCMSLIB00017289673","spectrum_index":38178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 31.0089 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.089,"smiles":null,"spectrum_id":"CCMSLIB00017289675","spectrum_index":38179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"9H-Pyrido[3,4-B]indole CollisionEnergy:205060\"\" (delta mass: 43.024 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.1,"smiles":null,"spectrum_id":"CCMSLIB00017289678","spectrum_index":38180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 226.0949 Da; putative annotation: N/A; putative formula: C15H14O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.155,"smiles":null,"spectrum_id":"CCMSLIB00017289680","spectrum_index":38181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 407.1764 Da; putative annotation: N/A; putative formula: C23H26N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.272,"smiles":null,"spectrum_id":"CCMSLIB00017289683","spectrum_index":38182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 323.1864 Da; putative annotation: N/A; putative formula: C14H30NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.283,"smiles":null,"spectrum_id":"CCMSLIB00017289686","spectrum_index":38183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 282.1089 Da; putative annotation: N/A; putative formula: C11H10N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.258,"smiles":null,"spectrum_id":"CCMSLIB00017289687","spectrum_index":38184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 76.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.368,"smiles":null,"spectrum_id":"CCMSLIB00017289690","spectrum_index":38185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 40.0079 Da; putative annotation: N/A; putative formula: CN2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.079,"smiles":null,"spectrum_id":"CCMSLIB00017289693","spectrum_index":38186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 261.1325 Da; putative annotation: N/A; putative formula: C10H19N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.219,"smiles":null,"spectrum_id":"CCMSLIB00017289696","spectrum_index":38187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 270.1311 Da; putative annotation: N/A; putative formula: C13H23N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.201,"smiles":null,"spectrum_id":"CCMSLIB00017289697","spectrum_index":38188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 73.0409 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017289700","spectrum_index":38189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 441.1428 Da; putative annotation: N/A; putative formula: C26H24N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.214,"smiles":null,"spectrum_id":"CCMSLIB00017289703","spectrum_index":38190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 411.4444 Da; putative annotation: N/A; putative formula: C23H53N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.52,"smiles":null,"spectrum_id":"CCMSLIB00017289706","spectrum_index":38191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 67.086 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.209,"smiles":null,"spectrum_id":"CCMSLIB00017289707","spectrum_index":38192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 339.3458 Da; putative annotation: N/A; putative formula: C18H41N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.422,"smiles":null,"spectrum_id":"CCMSLIB00017289710","spectrum_index":38193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 64.0154 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017289713","spectrum_index":38194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 44.0258 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.123,"smiles":null,"spectrum_id":"CCMSLIB00017289716","spectrum_index":38195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fenoterol (delta mass: 102.0892 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.243,"smiles":null,"spectrum_id":"CCMSLIB00017289717","spectrum_index":38196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 73.0565 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.143,"smiles":null,"spectrum_id":"CCMSLIB00017289720","spectrum_index":38197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 794.2389 Da; putative annotation: N/A; putative formula: C57H34N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.299,"smiles":null,"spectrum_id":"CCMSLIB00017289723","spectrum_index":38198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 234.053 Da; putative annotation: N/A; putative formula: C12H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.177,"smiles":null,"spectrum_id":"CCMSLIB00017289726","spectrum_index":38199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 314.2835 Da; putative annotation: N/A; putative formula: C20H34N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.38,"smiles":null,"spectrum_id":"CCMSLIB00017289727","spectrum_index":38200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 309.1878 Da; putative annotation: N/A; putative formula: C24H23NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.274,"smiles":null,"spectrum_id":"CCMSLIB00017289730","spectrum_index":38201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 307.1978 Da; putative annotation: N/A; putative formula: C18H31NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.284,"smiles":null,"spectrum_id":"CCMSLIB00017289733","spectrum_index":38202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 135.0537 Da; putative annotation: N/A; putative formula: C4H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.182,"smiles":null,"spectrum_id":"CCMSLIB00017289735","spectrum_index":38203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 140.0445 Da; putative annotation: N/A; putative formula: C3H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.079,"smiles":null,"spectrum_id":"CCMSLIB00017289738","spectrum_index":38204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 56.0117 Da; putative annotation: N/A; putative formula: N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017289740","spectrum_index":38205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 135.1041 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.175,"smiles":null,"spectrum_id":"CCMSLIB00017289743","spectrum_index":38206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 77.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.18,"smiles":null,"spectrum_id":"CCMSLIB00017289746","spectrum_index":38207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 69.0973 Da; putative annotation: N/A; putative formula: C5H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.07,"smiles":null,"spectrum_id":"CCMSLIB00017289747","spectrum_index":38208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 27.9728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.08,"smiles":null,"spectrum_id":"CCMSLIB00017289750","spectrum_index":38209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 131.0943 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.197,"smiles":null,"spectrum_id":"CCMSLIB00017289753","spectrum_index":38210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 230.0793 Da; putative annotation: N/A; putative formula: C10H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.15,"smiles":null,"spectrum_id":"CCMSLIB00017289755","spectrum_index":38211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 795.6058 Da; putative annotation: N/A; putative formula: C46H87NO5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":984.754,"smiles":null,"spectrum_id":"CCMSLIB00017289757","spectrum_index":38212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 981.6065 Da; putative annotation: N/A; putative formula: C63H79N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1136.64,"smiles":null,"spectrum_id":"CCMSLIB00017289760","spectrum_index":38213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 173.0974 Da; putative annotation: N/A; putative formula: C8H16NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.2,"smiles":null,"spectrum_id":"CCMSLIB00017289763","spectrum_index":38214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 509.27 Da; putative annotation: N/A; putative formula: C20H39N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.34,"smiles":null,"spectrum_id":"CCMSLIB00017289764","spectrum_index":38215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 71.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.17,"smiles":null,"spectrum_id":"CCMSLIB00017289767","spectrum_index":38216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 394.2122 Da; putative annotation: N/A; putative formula: C18H35O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.299,"smiles":null,"spectrum_id":"CCMSLIB00017289770","spectrum_index":38217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 156.0771 Da; putative annotation: N/A; putative formula: C4H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.174,"smiles":null,"spectrum_id":"CCMSLIB00017289772","spectrum_index":38218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Butyl-2,4-dinitroaniline (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.16,"smiles":null,"spectrum_id":"CCMSLIB00017289775","spectrum_index":38219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ser-Lys (delta mass: 110.0769 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.249,"smiles":null,"spectrum_id":"CCMSLIB00017289778","spectrum_index":38220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 74.0535 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.129,"smiles":null,"spectrum_id":"CCMSLIB00017289780","spectrum_index":38221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 154.0026 Da; putative annotation: N/A; putative formula: C6H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.151,"smiles":null,"spectrum_id":"CCMSLIB00017289783","spectrum_index":38222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 386.2027 Da; putative annotation: N/A; putative formula: C22H30N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.314,"smiles":null,"spectrum_id":"CCMSLIB00017289786","spectrum_index":38223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine (delta mass: 133.0429 Da; putative annotation: N/A; putative formula: C2H7N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.307,"smiles":null,"spectrum_id":"CCMSLIB00017289788","spectrum_index":38224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 114.0844 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.15,"smiles":null,"spectrum_id":"CCMSLIB00017289790","spectrum_index":38225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 51.0483 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.124,"smiles":null,"spectrum_id":"CCMSLIB00017289793","spectrum_index":38226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhistamine (delta mass: 13.0193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.122,"smiles":null,"spectrum_id":"CCMSLIB00017289796","spectrum_index":38227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Aminobutyl)urea (delta mass: 24.0239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.137,"smiles":null,"spectrum_id":"CCMSLIB00017289798","spectrum_index":38228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN - 30.0 eV (delta mass: 124.0346 Da; putative annotation: N/A; putative formula: C7H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.13,"smiles":null,"spectrum_id":"CCMSLIB00017289801","spectrum_index":38229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .gamma.-L-Glutamyl-L-alanine (delta mass: 182.1665 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.264,"smiles":null,"spectrum_id":"CCMSLIB00017289805","spectrum_index":38230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 209.0532 Da; putative annotation: N/A; putative formula: C6H11NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.087,"smiles":null,"spectrum_id":"CCMSLIB00017289807","spectrum_index":38231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 46.0087 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.08,"smiles":null,"spectrum_id":"CCMSLIB00017289811","spectrum_index":38232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 207.0896 Da; putative annotation: N/A; putative formula: C11H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.144,"smiles":null,"spectrum_id":"CCMSLIB00017289813","spectrum_index":38233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 78.0115 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.109,"smiles":null,"spectrum_id":"CCMSLIB00017289816","spectrum_index":38234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 223.0692 Da; putative annotation: N/A; putative formula: C7H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.103,"smiles":null,"spectrum_id":"CCMSLIB00017289819","spectrum_index":38235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PRENOL (delta mass: 48.036 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.116,"smiles":null,"spectrum_id":"CCMSLIB00017289821","spectrum_index":38236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 372.2519 Da; putative annotation: N/A; putative formula: C21H40OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.385,"smiles":null,"spectrum_id":"CCMSLIB00017289823","spectrum_index":38237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 60.0311 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017289826","spectrum_index":38238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of codeine (delta mass: 44.0262 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.186,"smiles":null,"spectrum_id":"CCMSLIB00017289828","spectrum_index":38239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 172.0998 Da; putative annotation: N/A; putative formula: C11H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.207,"smiles":null,"spectrum_id":"CCMSLIB00017289831","spectrum_index":38240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrocodeine (delta mass: 97.9724 Da; putative annotation: N/A; putative formula: C4H3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.147,"smiles":null,"spectrum_id":"CCMSLIB00017289834","spectrum_index":38241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 11.9684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.07,"smiles":null,"spectrum_id":"CCMSLIB00017289836","spectrum_index":38242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 334.5716 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.658,"smiles":null,"spectrum_id":"CCMSLIB00017289839","spectrum_index":38243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 194.0737 Da; putative annotation: N/A; putative formula: C6H16N2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.118,"smiles":null,"spectrum_id":"CCMSLIB00017289841","spectrum_index":38244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 606.345 Da; putative annotation: N/A; putative formula: C30H56O8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.441,"smiles":null,"spectrum_id":"CCMSLIB00017289844","spectrum_index":38245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 53.0661 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.093,"smiles":null,"spectrum_id":"CCMSLIB00017289847","spectrum_index":38246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 47.0193 Da; putative annotation: N/A; putative formula: C4HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.168,"smiles":null,"spectrum_id":"CCMSLIB00017289849","spectrum_index":38247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 16.9997 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.088,"smiles":null,"spectrum_id":"CCMSLIB00017289851","spectrum_index":38248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 257.0649 Da; putative annotation: N/A; putative formula: C9H11N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.104,"smiles":null,"spectrum_id":"CCMSLIB00017289854","spectrum_index":38249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Difluoromethoxy)-1H-benzimidazole-2-thiol (delta mass: 175.1675 Da; putative annotation: N/A; putative formula: C4H17N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.192,"smiles":null,"spectrum_id":"CCMSLIB00017289857","spectrum_index":38250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 137.014 Da; putative annotation: N/A; putative formula: C5H4N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.074,"smiles":null,"spectrum_id":"CCMSLIB00017289858","spectrum_index":38251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 41.0254 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.129,"smiles":null,"spectrum_id":"CCMSLIB00017289861","spectrum_index":38252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 449.7495 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.873,"smiles":null,"spectrum_id":"CCMSLIB00017289864","spectrum_index":38253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 448.2435 Da; putative annotation: N/A; putative formula: C29H36O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.367,"smiles":null,"spectrum_id":"CCMSLIB00017289866","spectrum_index":38254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 308.0529 Da; putative annotation: N/A; putative formula: C9H17N4O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.201,"smiles":null,"spectrum_id":"CCMSLIB00017289868","spectrum_index":38255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 716.4995 Da; putative annotation: N/A; putative formula: C39H73O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.586,"smiles":null,"spectrum_id":"CCMSLIB00017289871","spectrum_index":38256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 133.9921 Da; putative annotation: N/A; putative formula: C7H3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.107,"smiles":null,"spectrum_id":"CCMSLIB00017289874","spectrum_index":38257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 135.0923 Da; putative annotation: N/A; putative formula: C6H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.181,"smiles":null,"spectrum_id":"CCMSLIB00017289875","spectrum_index":38258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 304.2027 Da; putative annotation: N/A; putative formula: C19H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.326,"smiles":null,"spectrum_id":"CCMSLIB00017289879","spectrum_index":38259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 93.9646 Da; putative annotation: N/A; putative formula: CH3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.023,"smiles":null,"spectrum_id":"CCMSLIB00017289881","spectrum_index":38260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile (delta mass: 504.5913 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.603,"smiles":null,"spectrum_id":"CCMSLIB00017289884","spectrum_index":38261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 306.089 Da; putative annotation: N/A; putative formula: C19H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.227,"smiles":null,"spectrum_id":"CCMSLIB00017289887","spectrum_index":38262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 214.1197 Da; putative annotation: N/A; putative formula: C11H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.2,"smiles":null,"spectrum_id":"CCMSLIB00017289889","spectrum_index":38263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 283.2871 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.411,"smiles":null,"spectrum_id":"CCMSLIB00017289891","spectrum_index":38264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}-1,3,4-thiadiazole-2-thiol (delta mass: 76.0283 Da; putative annotation: N/A; putative formula: CH4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.096,"smiles":null,"spectrum_id":"CCMSLIB00017289894","spectrum_index":38265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.123,"smiles":null,"spectrum_id":"CCMSLIB00017289897","spectrum_index":38266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Fluoro-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 74.051 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.149,"smiles":null,"spectrum_id":"CCMSLIB00017289900","spectrum_index":38267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 510.3253 Da; putative annotation: N/A; putative formula: C27H42N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.396,"smiles":null,"spectrum_id":"CCMSLIB00017289901","spectrum_index":38268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin E (delta mass: 193.0596 Da; putative annotation: N/A; putative formula: C7H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.25,"smiles":null,"spectrum_id":"CCMSLIB00017289904","spectrum_index":38269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-5-(3,3-dimethylguanidine-1-yl)pentanoic acid (delta mass: 193.9914 Da; putative annotation: N/A; putative formula: C4H7N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.11,"smiles":null,"spectrum_id":"CCMSLIB00017289907","spectrum_index":38270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 174.031 Da; putative annotation: N/A; putative formula: C4H7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.154,"smiles":null,"spectrum_id":"CCMSLIB00017289909","spectrum_index":38271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 301.2164 Da; putative annotation: N/A; putative formula: C11H27N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.329,"smiles":null,"spectrum_id":"CCMSLIB00017289911","spectrum_index":38272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 285.1072 Da; putative annotation: N/A; putative formula: C20H16NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.261,"smiles":null,"spectrum_id":"CCMSLIB00017289913","spectrum_index":38273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 259.0786 Da; putative annotation: N/A; putative formula: C21H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.119,"smiles":null,"spectrum_id":"CCMSLIB00017289916","spectrum_index":38274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 505.7226 Da; putative annotation: N/A; putative formula: C14H2OS10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":797.825,"smiles":null,"spectrum_id":"CCMSLIB00017289918","spectrum_index":38275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 126.0414 Da; putative annotation: N/A; putative formula: CH2N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.092,"smiles":null,"spectrum_id":"CCMSLIB00017289921","spectrum_index":38276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 66.0102 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.081,"smiles":null,"spectrum_id":"CCMSLIB00017289924","spectrum_index":38277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 495.1598 Da; putative annotation: N/A; putative formula: C33H17N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":720.272,"smiles":null,"spectrum_id":"CCMSLIB00017289926","spectrum_index":38278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 54.0107 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.061,"smiles":null,"spectrum_id":"CCMSLIB00017289928","spectrum_index":38279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 284.0992 Da; putative annotation: N/A; putative formula: C9H16N8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.17,"smiles":null,"spectrum_id":"CCMSLIB00017289931","spectrum_index":38280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 282.0529 Da; putative annotation: N/A; putative formula: C16H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.176,"smiles":null,"spectrum_id":"CCMSLIB00017289934","spectrum_index":38281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 138.0306 Da; putative annotation: N/A; putative formula: CH7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.111,"smiles":null,"spectrum_id":"CCMSLIB00017289937","spectrum_index":38282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 229.1162 Da; putative annotation: N/A; putative formula: C10H20N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.186,"smiles":null,"spectrum_id":"CCMSLIB00017289939","spectrum_index":38283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 100.0544 Da; putative annotation: N/A; putative formula: C4H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.158,"smiles":null,"spectrum_id":"CCMSLIB00017289941","spectrum_index":38284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 78.0761 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.21,"smiles":null,"spectrum_id":"CCMSLIB00017289944","spectrum_index":38285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 142.0445 Da; putative annotation: N/A; putative formula: C7H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.111,"smiles":null,"spectrum_id":"CCMSLIB00017289947","spectrum_index":38286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 109.0616 Da; putative annotation: N/A; putative formula: C5H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.201,"smiles":null,"spectrum_id":"CCMSLIB00017289948","spectrum_index":38287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1293.5999 Da; putative annotation: N/A; putative formula: C58H83N15O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1486.67,"smiles":null,"spectrum_id":"CCMSLIB00017289951","spectrum_index":38288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 145.9679 Da; putative annotation: N/A; putative formula: C5H6O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.028,"smiles":null,"spectrum_id":"CCMSLIB00017289954","spectrum_index":38289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 108.0215 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017289957","spectrum_index":38290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 104.0623 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017289960","spectrum_index":38291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 68.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.143,"smiles":null,"spectrum_id":"CCMSLIB00017289961","spectrum_index":38292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 293.1107 Da; putative annotation: N/A; putative formula: C11H19NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.176,"smiles":null,"spectrum_id":"CCMSLIB00017289964","spectrum_index":38293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C9:0 (delta mass: 154.1358 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.363,"smiles":null,"spectrum_id":"CCMSLIB00017289967","spectrum_index":38294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 97.0162 Da; putative annotation: N/A; putative formula: C4H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017289970","spectrum_index":38295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylnicotinic acid (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.065,"smiles":null,"spectrum_id":"CCMSLIB00017289973","spectrum_index":38296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 28.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017289975","spectrum_index":38297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 516.7166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.814,"smiles":null,"spectrum_id":"CCMSLIB00017289978","spectrum_index":38298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 19.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.102,"smiles":null,"spectrum_id":"CCMSLIB00017289981","spectrum_index":38299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 341.1954 Da; putative annotation: N/A; putative formula: C16H27N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.292,"smiles":null,"spectrum_id":"CCMSLIB00017289984","spectrum_index":38300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 83.0371 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017289987","spectrum_index":38301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxymorphinan (delta mass: 114.1048 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.29,"smiles":null,"spectrum_id":"CCMSLIB00017289989","spectrum_index":38302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 156.0839 Da; putative annotation: N/A; putative formula: C6H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.379,"smiles":null,"spectrum_id":"CCMSLIB00017289992","spectrum_index":38303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 406.2457 Da; putative annotation: N/A; putative formula: C19H26N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.341,"smiles":null,"spectrum_id":"CCMSLIB00017289995","spectrum_index":38304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 68.0628 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.165,"smiles":null,"spectrum_id":"CCMSLIB00017289998","spectrum_index":38305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 403.3288 Da; putative annotation: N/A; putative formula: C19H37N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.477,"smiles":null,"spectrum_id":"CCMSLIB00017290001","spectrum_index":38306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 195.0863 Da; putative annotation: N/A; putative formula: C6H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.167,"smiles":null,"spectrum_id":"CCMSLIB00017290002","spectrum_index":38307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(1H-Imidazol-4-yl)ethyl]-N'-(2-phenylethyl)thiourea (delta mass: 86.0295 Da; putative annotation: N/A; putative formula: C3H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.162,"smiles":null,"spectrum_id":"CCMSLIB00017290005","spectrum_index":38308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 12.0002 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.108,"smiles":null,"spectrum_id":"CCMSLIB00017290008","spectrum_index":38309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 146.0463 Da; putative annotation: N/A; putative formula: C2H7N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.133,"smiles":null,"spectrum_id":"CCMSLIB00017290011","spectrum_index":38310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00938 Curcumin (delta mass: 126.049 Da; putative annotation: N/A; putative formula: C7H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.182,"smiles":null,"spectrum_id":"CCMSLIB00017290013","spectrum_index":38311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 681.487 Da; putative annotation: N/A; putative formula: C44H63N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.582,"smiles":null,"spectrum_id":"CCMSLIB00017290015","spectrum_index":38312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 254.0713 Da; putative annotation: N/A; putative formula: C13H19O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.152,"smiles":null,"spectrum_id":"CCMSLIB00017290018","spectrum_index":38313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 291.1217 Da; putative annotation: N/A; putative formula: C14H17N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.208,"smiles":null,"spectrum_id":"CCMSLIB00017290021","spectrum_index":38314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 169.1355 Da; putative annotation: N/A; putative formula: C7H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.296,"smiles":null,"spectrum_id":"CCMSLIB00017290024","spectrum_index":38315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 194.0745 Da; putative annotation: N/A; putative formula: C7H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.203,"smiles":null,"spectrum_id":"CCMSLIB00017290026","spectrum_index":38316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 113.0476 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017290029","spectrum_index":38317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 46.043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.15,"smiles":null,"spectrum_id":"CCMSLIB00017290031","spectrum_index":38318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 267.144 Da; putative annotation: N/A; putative formula: C10H17N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.183,"smiles":null,"spectrum_id":"CCMSLIB00017290034","spectrum_index":38319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 121.1266 Da; putative annotation: N/A; putative formula: C9H15NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.317,"smiles":null,"spectrum_id":"CCMSLIB00017290036","spectrum_index":38320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Bromoquinolin-8-ol (delta mass: 42.0096 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.98,"smiles":null,"spectrum_id":"CCMSLIB00017290038","spectrum_index":38321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 386.1378 Da; putative annotation: N/A; putative formula: C22H18N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.302,"smiles":null,"spectrum_id":"CCMSLIB00017290041","spectrum_index":38322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 45.9995 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.155,"smiles":null,"spectrum_id":"CCMSLIB00017290043","spectrum_index":38323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 1.9649 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.061,"smiles":null,"spectrum_id":"CCMSLIB00017290046","spectrum_index":38324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 419.3608 Da; putative annotation: N/A; putative formula: C20H41N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.509,"smiles":null,"spectrum_id":"CCMSLIB00017290049","spectrum_index":38325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300487 Hordenine (delta mass: 177.1006 Da; putative annotation: N/A; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.223,"smiles":null,"spectrum_id":"CCMSLIB00017290051","spectrum_index":38326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 146.0632 Da; putative annotation: N/A; putative formula: C4H10N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.149,"smiles":null,"spectrum_id":"CCMSLIB00017290054","spectrum_index":38327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 441.1372 Da; putative annotation: N/A; putative formula: C23H19N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.291,"smiles":null,"spectrum_id":"CCMSLIB00017290057","spectrum_index":38328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 270.122 Da; putative annotation: N/A; putative formula: C14H25O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.219,"smiles":null,"spectrum_id":"CCMSLIB00017290060","spectrum_index":38329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 118.0782 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017290062","spectrum_index":38330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-yl)-N-(4-methoxyphenyl)acetamide (delta mass: 17.0297 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.158,"smiles":null,"spectrum_id":"CCMSLIB00017290065","spectrum_index":38331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 198.134 Da; putative annotation: N/A; putative formula: C6H14N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.247,"smiles":null,"spectrum_id":"CCMSLIB00017290068","spectrum_index":38332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one (delta mass: 115.0265 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.103,"smiles":null,"spectrum_id":"CCMSLIB00017290070","spectrum_index":38333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; AIF; CE10; MS2Dec (delta mass: 354.2051 Da; putative annotation: N/A; putative formula: C20H34OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.303,"smiles":null,"spectrum_id":"CCMSLIB00017290073","spectrum_index":38334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 358.1252 Da; putative annotation: N/A; putative formula: C16H22O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.206,"smiles":null,"spectrum_id":"CCMSLIB00017290076","spectrum_index":38335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 82.0268 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.124,"smiles":null,"spectrum_id":"CCMSLIB00017290079","spectrum_index":38336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 435.3689 Da; putative annotation: N/A; putative formula: C23H45N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.434,"smiles":null,"spectrum_id":"CCMSLIB00017290081","spectrum_index":38337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 299.1529 Da; putative annotation: N/A; putative formula: C18H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.234,"smiles":null,"spectrum_id":"CCMSLIB00017290084","spectrum_index":38338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 136.0887 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.169,"smiles":null,"spectrum_id":"CCMSLIB00017290087","spectrum_index":38339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 40.8916 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.979,"smiles":null,"spectrum_id":"CCMSLIB00017290088","spectrum_index":38340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 531.336 Da; putative annotation: N/A; putative formula: C35H41N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.49,"smiles":null,"spectrum_id":"CCMSLIB00017290091","spectrum_index":38341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 76.0678 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.149,"smiles":null,"spectrum_id":"CCMSLIB00017290092","spectrum_index":38342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 155.0734 Da; putative annotation: N/A; putative formula: C11H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.155,"smiles":null,"spectrum_id":"CCMSLIB00017290095","spectrum_index":38343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 199.1284 Da; putative annotation: N/A; putative formula: C8H17N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.169,"smiles":null,"spectrum_id":"CCMSLIB00017290098","spectrum_index":38344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 257.1504 Da; putative annotation: N/A; putative formula: C11H15N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.221,"smiles":null,"spectrum_id":"CCMSLIB00017290100","spectrum_index":38345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 124.024 Da; putative annotation: N/A; putative formula: CN8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.09,"smiles":null,"spectrum_id":"CCMSLIB00017290102","spectrum_index":38346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 162.0898 Da; putative annotation: N/A; putative formula: C7H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.244,"smiles":null,"spectrum_id":"CCMSLIB00017290105","spectrum_index":38347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 207.1991 Da; putative annotation: N/A; putative formula: C14H25N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.27,"smiles":null,"spectrum_id":"CCMSLIB00017290108","spectrum_index":38348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 54.0391 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.089,"smiles":null,"spectrum_id":"CCMSLIB00017290110","spectrum_index":38349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 261.102 Da; putative annotation: N/A; putative formula: C15H11N5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.189,"smiles":null,"spectrum_id":"CCMSLIB00017290113","spectrum_index":38350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltryptamine (delta mass: 70.077 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017290115","spectrum_index":38351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 54.7914 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.807,"smiles":null,"spectrum_id":"CCMSLIB00017290118","spectrum_index":38352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 192.2816 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.368,"smiles":null,"spectrum_id":"CCMSLIB00017290121","spectrum_index":38353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-(Difluoromethylthio)phenyl)-N-methylmethanamine (delta mass: 206.1159 Da; putative annotation: N/A; putative formula: C9H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.181,"smiles":null,"spectrum_id":"CCMSLIB00017290123","spectrum_index":38354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 101.0477 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.228,"smiles":null,"spectrum_id":"CCMSLIB00017290126","spectrum_index":38355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ301405 Cefalexin|7-[(2-amino-1-oxo-2-phenylethyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 283.0877 Da; putative annotation: N/A; putative formula: C13H17NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.189,"smiles":null,"spectrum_id":"CCMSLIB00017290129","spectrum_index":38356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 199.0899 Da; putative annotation: N/A; putative formula: C7H13N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.202,"smiles":null,"spectrum_id":"CCMSLIB00017290131","spectrum_index":38357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 146.0339 Da; putative annotation: Massbank:PR311088 Coumaric acid (isomer of 189, 194); putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.136,"smiles":null,"spectrum_id":"CCMSLIB00017290134","spectrum_index":38358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180712-02!(3R,5R)-1-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4,5-trihydroxycyclohexane-1-carboxylic acid (delta mass: 162.031 Da; putative annotation: Caffeic acid; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.133,"smiles":null,"spectrum_id":"CCMSLIB00017290137","spectrum_index":38359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 275.0999 Da; putative annotation: N-Acetylmuramic Acid; putative formula: C11H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.197,"smiles":null,"spectrum_id":"CCMSLIB00017290139","spectrum_index":38360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 111.0326 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.177,"smiles":null,"spectrum_id":"CCMSLIB00017290141","spectrum_index":38361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 97.0531 Da; putative annotation: Pyrrolidine-3-carboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.124,"smiles":null,"spectrum_id":"CCMSLIB00017290144","spectrum_index":38362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE (delta mass: 86.036 Da; putative annotation: Methyl 2-hydroxypropanoate; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.127,"smiles":null,"spectrum_id":"CCMSLIB00017290147","spectrum_index":38363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-QUINOLINECARBOXYLATE (delta mass: 143.0586 Da; putative annotation: Glutamic acid gamma methyl ester; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.114,"smiles":null,"spectrum_id":"CCMSLIB00017290150","spectrum_index":38364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 167.0581 Da; putative annotation: Eglumegad; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.235,"smiles":null,"spectrum_id":"CCMSLIB00017290151","spectrum_index":38365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 312.2086 Da; putative annotation: 11.beta.-Hydroxyprogesterone; putative formula: C21H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.279,"smiles":null,"spectrum_id":"CCMSLIB00017290154","spectrum_index":38366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 108.0212 Da; putative annotation: 1,3,5-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017290157","spectrum_index":38367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100279 D-Sorbitol|D-Sorbit|D-Glucitol|D-1,2,3,4,5,6-Hexanehexol|D-Sorbol|Cystosol|Glucarine|Diakarmon|Esasorb|Sorbol (delta mass: 164.1565 Da; putative annotation: trans-8, trans-10-Dodecadien-1-ol; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.243,"smiles":null,"spectrum_id":"CCMSLIB00017290160","spectrum_index":38368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 244.1102 Da; putative annotation: 1-Dehydroperuvinine; putative formula: C15H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017290161","spectrum_index":38369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 190.0989 Da; putative annotation: 2-(3,5-Dimethylphenoxy)butanoic acid; putative formula: C12H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.185,"smiles":null,"spectrum_id":"CCMSLIB00017290164","spectrum_index":38370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 134.0727 Da; putative annotation: 4-Hydroxynonenal alkyne; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017290167","spectrum_index":38371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 282.1973 Da; putative annotation: rac-all-trans-4-Hydroxyretinal; putative formula: C20H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.284,"smiles":null,"spectrum_id":"CCMSLIB00017290170","spectrum_index":38372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 132.0837 Da; putative annotation: N/A; putative formula: C4H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.232,"smiles":null,"spectrum_id":"CCMSLIB00017290171","spectrum_index":38373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Aminobutyl)hydroxylamine (delta mass: 344.162 Da; putative annotation: N/A; putative formula: C20H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.264,"smiles":null,"spectrum_id":"CCMSLIB00017290174","spectrum_index":38374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 484.2882 Da; putative annotation: N/A; putative formula: C22H44O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.437,"smiles":null,"spectrum_id":"CCMSLIB00017290177","spectrum_index":38375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-nitrobenzyl)ethanamine (delta mass: 170.0669 Da; putative annotation: N/A; putative formula: C3H6N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.186,"smiles":null,"spectrum_id":"CCMSLIB00017290180","spectrum_index":38376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridylamidoxime (delta mass: 22.008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.074,"smiles":null,"spectrum_id":"CCMSLIB00017290182","spectrum_index":38377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 138.0793 Da; putative annotation: N/A; putative formula: C7H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.15,"smiles":null,"spectrum_id":"CCMSLIB00017290185","spectrum_index":38378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1037.4169 Da; putative annotation: N/A; putative formula: C64H63NO10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1218.49,"smiles":null,"spectrum_id":"CCMSLIB00017290187","spectrum_index":38379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 655.3752 Da; putative annotation: N/A; putative formula: C36H54N3O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.43,"smiles":null,"spectrum_id":"CCMSLIB00017290190","spectrum_index":38380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 93.0216 Da; putative annotation: N/A; putative formula: C5H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.124,"smiles":null,"spectrum_id":"CCMSLIB00017290193","spectrum_index":38381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(6aR,9R,10aR)-9-(methylsulfanylmethyl)-7-propyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline\"\" (delta mass: 112.1174 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.306,"smiles":null,"spectrum_id":"CCMSLIB00017290194","spectrum_index":38382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2,5-Dihydroxyhexyl)oxolan-2-one (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.138,"smiles":null,"spectrum_id":"CCMSLIB00017290197","spectrum_index":38383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 136.0951 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.154,"smiles":null,"spectrum_id":"CCMSLIB00017290200","spectrum_index":38384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 800.4361 Da; putative annotation: N/A; putative formula: C45H60N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":981.507,"smiles":null,"spectrum_id":"CCMSLIB00017290201","spectrum_index":38385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 723.3834 Da; putative annotation: N/A; putative formula: C43H49N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.47,"smiles":null,"spectrum_id":"CCMSLIB00017290204","spectrum_index":38386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 130.0269 Da; putative annotation: N/A; putative formula: C5H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.066,"smiles":null,"spectrum_id":"CCMSLIB00017290207","spectrum_index":38387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 113.0848 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.124,"smiles":null,"spectrum_id":"CCMSLIB00017290208","spectrum_index":38388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 95.0369 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.16,"smiles":null,"spectrum_id":"CCMSLIB00017290211","spectrum_index":38389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 50.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.117,"smiles":null,"spectrum_id":"CCMSLIB00017290213","spectrum_index":38390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 129.0536 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.155,"smiles":null,"spectrum_id":"CCMSLIB00017290215","spectrum_index":38391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galantamine (delta mass: 73.0167 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.176,"smiles":null,"spectrum_id":"CCMSLIB00017290218","spectrum_index":38392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 7.9986 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.114,"smiles":null,"spectrum_id":"CCMSLIB00017290219","spectrum_index":38393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 49.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.29,"smiles":null,"spectrum_id":"CCMSLIB00017290222","spectrum_index":38394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 467.1639 Da; putative annotation: N/A; putative formula: C18H29NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.235,"smiles":null,"spectrum_id":"CCMSLIB00017290225","spectrum_index":38395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Cinchonidine - 30.0 eV (delta mass: 119.1034 Da; putative annotation: N/A; putative formula: H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.284,"smiles":null,"spectrum_id":"CCMSLIB00017290226","spectrum_index":38396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 180.0734 Da; putative annotation: N/A; putative formula: C2H4N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.16,"smiles":null,"spectrum_id":"CCMSLIB00017290229","spectrum_index":38397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 124.1254 Da; putative annotation: N/A; putative formula: C9H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.243,"smiles":null,"spectrum_id":"CCMSLIB00017290230","spectrum_index":38398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 54.0836 Da; putative annotation: N/A; putative formula: C5H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.123,"smiles":null,"spectrum_id":"CCMSLIB00017290233","spectrum_index":38399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 93.5662 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.652,"smiles":null,"spectrum_id":"CCMSLIB00017290236","spectrum_index":38400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 41.1643 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.199,"smiles":null,"spectrum_id":"CCMSLIB00017290237","spectrum_index":38401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 54.1086 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.189,"smiles":null,"spectrum_id":"CCMSLIB00017290240","spectrum_index":38402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 297.1846 Da; putative annotation: N/A; putative formula: C18H23N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.271,"smiles":null,"spectrum_id":"CCMSLIB00017290243","spectrum_index":38403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 228.6581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.736,"smiles":null,"spectrum_id":"CCMSLIB00017290244","spectrum_index":38404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 124.186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.221,"smiles":null,"spectrum_id":"CCMSLIB00017290247","spectrum_index":38405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-beta-D-galactosamine - 40.0 eV (delta mass: 483.9694 Da; putative annotation: N/A; putative formula: C10H11N6O11P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.067,"smiles":null,"spectrum_id":"CCMSLIB00017290249","spectrum_index":38406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 71.1375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.222,"smiles":null,"spectrum_id":"CCMSLIB00017290251","spectrum_index":38407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 135.0687 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.139,"smiles":null,"spectrum_id":"CCMSLIB00017290254","spectrum_index":38408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 211.1574 Da; putative annotation: N/A; putative formula: C12H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.238,"smiles":null,"spectrum_id":"CCMSLIB00017290255","spectrum_index":38409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 166.1595 Da; putative annotation: N/A; putative formula: C9H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.263,"smiles":null,"spectrum_id":"CCMSLIB00017290258","spectrum_index":38410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 18.104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017290260","spectrum_index":38411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347865-02!4-[7-acetyloxy-5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxoisoquinolin-2-yl]-5-amino-5-oxopentanoic acid (delta mass: 518.1805 Da; putative annotation: N/A; putative formula: C28H38OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1037.37,"smiles":null,"spectrum_id":"CCMSLIB00017290262","spectrum_index":38412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 6.4028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.5,"smiles":null,"spectrum_id":"CCMSLIB00017290265","spectrum_index":38413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 64.0675 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017290266","spectrum_index":38414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 157.1104 Da; putative annotation: N/A; putative formula: C8H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.208,"smiles":null,"spectrum_id":"CCMSLIB00017290269","spectrum_index":38415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 90.0563 Da; putative annotation: N/A; putative formula: C6H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.164,"smiles":null,"spectrum_id":"CCMSLIB00017290272","spectrum_index":38416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Ala (delta mass: 224.1154 Da; putative annotation: N/A; putative formula: C13H21O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.245,"smiles":null,"spectrum_id":"CCMSLIB00017290274","spectrum_index":38417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 96.0426 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.191,"smiles":null,"spectrum_id":"CCMSLIB00017290276","spectrum_index":38418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 104.0345 Da; putative annotation: N/A; putative formula: CH4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.075,"smiles":null,"spectrum_id":"CCMSLIB00017290279","spectrum_index":38419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 113.0284 Da; putative annotation: N/A; putative formula: C5H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.13,"smiles":null,"spectrum_id":"CCMSLIB00017290282","spectrum_index":38420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 25.0221 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.161,"smiles":null,"spectrum_id":"CCMSLIB00017290284","spectrum_index":38421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 82.0376 Da; putative annotation: N/A; putative formula: CH2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.14,"smiles":null,"spectrum_id":"CCMSLIB00017290286","spectrum_index":38422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 707.5535 Da; putative annotation: N/A; putative formula: C35H69N11O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.702,"smiles":null,"spectrum_id":"CCMSLIB00017290289","spectrum_index":38423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 328.1159 Da; putative annotation: N/A; putative formula: C15H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.239,"smiles":null,"spectrum_id":"CCMSLIB00017290291","spectrum_index":38424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-GLUCOSE 1-PHOSPHATE (delta mass: 101.0362 Da; putative annotation: N/A; putative formula: C6H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.073,"smiles":null,"spectrum_id":"CCMSLIB00017290293","spectrum_index":38425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 298.0918 Da; putative annotation: N/A; putative formula: C11H24O3P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.188,"smiles":null,"spectrum_id":"CCMSLIB00017290296","spectrum_index":38426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyltyramine (delta mass: 252.2457 Da; putative annotation: N/A; putative formula: C17H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.353,"smiles":null,"spectrum_id":"CCMSLIB00017290299","spectrum_index":38427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-2-amine, 4,5-dihydro-N-[4-[[4-(1-methylethoxy)phenyl]methyl]phenyl]- (delta mass: 17.9991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.19,"smiles":null,"spectrum_id":"CCMSLIB00017290301","spectrum_index":38428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 195.147 Da; putative annotation: N/A; putative formula: C9H17N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.212,"smiles":null,"spectrum_id":"CCMSLIB00017290303","spectrum_index":38429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nitro-2,4-quinolinediol (delta mass: 110.041 Da; putative annotation: N/A; putative formula: C5H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.081,"smiles":null,"spectrum_id":"CCMSLIB00017290306","spectrum_index":38430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 17.9607 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.042,"smiles":null,"spectrum_id":"CCMSLIB00017290309","spectrum_index":38431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 76.0157 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.082,"smiles":null,"spectrum_id":"CCMSLIB00017290310","spectrum_index":38432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 871.4973 Da; putative annotation: N/A; putative formula: C44H70N7O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1034.56,"smiles":null,"spectrum_id":"CCMSLIB00017290313","spectrum_index":38433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 127.0518 Da; putative annotation: N/A; putative formula: C8H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.132,"smiles":null,"spectrum_id":"CCMSLIB00017290316","spectrum_index":38434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 125.0831 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.18,"smiles":null,"spectrum_id":"CCMSLIB00017290317","spectrum_index":38435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 86.0678 Da; putative annotation: N/A; putative formula: CH6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.149,"smiles":null,"spectrum_id":"CCMSLIB00017290320","spectrum_index":38436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 239.1162 Da; putative annotation: N/A; putative formula: C13H21NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.187,"smiles":null,"spectrum_id":"CCMSLIB00017290323","spectrum_index":38437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of fMet CollisionEnergy:102040 (delta mass: 70.0782 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.131,"smiles":null,"spectrum_id":"CCMSLIB00017290326","spectrum_index":38438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(?)-ampicillin - 40.0 eV (delta mass: 279.1219 Da; putative annotation: N/A; putative formula: C13H17N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.239,"smiles":null,"spectrum_id":"CCMSLIB00017290327","spectrum_index":38439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 171.0537 Da; putative annotation: N/A; putative formula: C8H13NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.14,"smiles":null,"spectrum_id":"CCMSLIB00017290330","spectrum_index":38440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 267.0681 Da; putative annotation: N/A; putative formula: C19H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.217,"smiles":null,"spectrum_id":"CCMSLIB00017290333","spectrum_index":38441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 209.2449 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.306,"smiles":null,"spectrum_id":"CCMSLIB00017290335","spectrum_index":38442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 99.0673 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.185,"smiles":null,"spectrum_id":"CCMSLIB00017290337","spectrum_index":38443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-[3-(Benzyloxy)benzyl]-1H-tetrazole-1,5-diamine (delta mass: 56.0654 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.211,"smiles":null,"spectrum_id":"CCMSLIB00017290340","spectrum_index":38444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 388.1439 Da; putative annotation: N/A; putative formula: C21H25O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.223,"smiles":null,"spectrum_id":"CCMSLIB00017290343","spectrum_index":38445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 37.9461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.017,"smiles":null,"spectrum_id":"CCMSLIB00017290344","spectrum_index":38446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 617.5756 Da; putative annotation: N/A; putative formula: C41H71N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.672,"smiles":null,"spectrum_id":"CCMSLIB00017290347","spectrum_index":38447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 40.0309 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.065,"smiles":null,"spectrum_id":"CCMSLIB00017290350","spectrum_index":38448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 174.1754 Da; putative annotation: N/A; putative formula: C14H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.236,"smiles":null,"spectrum_id":"CCMSLIB00017290353","spectrum_index":38449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 114.0329 Da; putative annotation: N/A; putative formula: C6H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.154,"smiles":null,"spectrum_id":"CCMSLIB00017290354","spectrum_index":38450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 29.0372 Da; putative annotation: N/A; putative formula: H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.176,"smiles":null,"spectrum_id":"CCMSLIB00017290357","spectrum_index":38451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 50.0444 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.178,"smiles":null,"spectrum_id":"CCMSLIB00017290360","spectrum_index":38452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 78.0586 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.119,"smiles":null,"spectrum_id":"CCMSLIB00017290361","spectrum_index":38453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Desmethylquinidine (delta mass: 27.0569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.232,"smiles":null,"spectrum_id":"CCMSLIB00017290364","spectrum_index":38454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 95.1527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.233,"smiles":null,"spectrum_id":"CCMSLIB00017290367","spectrum_index":38455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 178.0658 Da; putative annotation: N/A; putative formula: C9H11N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.146,"smiles":null,"spectrum_id":"CCMSLIB00017290368","spectrum_index":38456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Murrayafoline A (delta mass: 2.0013 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.108,"smiles":null,"spectrum_id":"CCMSLIB00017290371","spectrum_index":38457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylic acid (delta mass: 111.0319 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.145,"smiles":null,"spectrum_id":"CCMSLIB00017290374","spectrum_index":38458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 63.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.113,"smiles":null,"spectrum_id":"CCMSLIB00017290377","spectrum_index":38459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Pro-Lys (delta mass: 99.0689 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.319,"smiles":null,"spectrum_id":"CCMSLIB00017290378","spectrum_index":38460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Allyl-5-isobutylimidazolidine-2,4-dione (delta mass: 25.9664 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.095,"smiles":null,"spectrum_id":"CCMSLIB00017290381","spectrum_index":38461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 304.1473 Da; putative annotation: N/A; putative formula: C14H20N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.271,"smiles":null,"spectrum_id":"CCMSLIB00017290384","spectrum_index":38462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 130.1721 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.232,"smiles":null,"spectrum_id":"CCMSLIB00017290386","spectrum_index":38463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 219.0774 Da; putative annotation: N/A; putative formula: C7H14N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.17,"smiles":null,"spectrum_id":"CCMSLIB00017290388","spectrum_index":38464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxymitragynine (delta mass: 17.0173 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.24,"smiles":null,"spectrum_id":"CCMSLIB00017290391","spectrum_index":38465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Aminoethyl)-1H-imidazol-2-amine (delta mass: 41.98 Da; putative annotation: N/A; putative formula: H-1N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.078,"smiles":null,"spectrum_id":"CCMSLIB00017290394","spectrum_index":38466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 15.0202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.122,"smiles":null,"spectrum_id":"CCMSLIB00017290395","spectrum_index":38467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 184.1213 Da; putative annotation: N/A; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.271,"smiles":null,"spectrum_id":"CCMSLIB00017290398","spectrum_index":38468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 328.0787 Da; putative annotation: N/A; putative formula: C19H12N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.118,"smiles":null,"spectrum_id":"CCMSLIB00017290401","spectrum_index":38469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 279.1088 Da; putative annotation: N/A; putative formula: C11H9N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.19,"smiles":null,"spectrum_id":"CCMSLIB00017290403","spectrum_index":38470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 145.0741 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.15,"smiles":null,"spectrum_id":"CCMSLIB00017290406","spectrum_index":38471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Val (delta mass: 44.0083 Da; putative annotation: N/A; putative formula: C2H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.137,"smiles":null,"spectrum_id":"CCMSLIB00017290408","spectrum_index":38472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000901 Harman|1-methyl-9H-pyrido[3,4-b]indole (delta mass: 57.0214 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.113,"smiles":null,"spectrum_id":"CCMSLIB00017290411","spectrum_index":38473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE10; MS2Dec (delta mass: 124.1101 Da; putative annotation: N/A; putative formula: C6H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.186,"smiles":null,"spectrum_id":"CCMSLIB00017290414","spectrum_index":38474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 589.3677 Da; putative annotation: N/A; putative formula: C24H43N15O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.516,"smiles":null,"spectrum_id":"CCMSLIB00017290416","spectrum_index":38475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 51.0453 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.126,"smiles":null,"spectrum_id":"CCMSLIB00017290418","spectrum_index":38476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 105.0391 Da; putative annotation: N/A; putative formula: C2H7N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.082,"smiles":null,"spectrum_id":"CCMSLIB00017290421","spectrum_index":38477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 209.0907 Da; putative annotation: N/A; putative formula: C8H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.229,"smiles":null,"spectrum_id":"CCMSLIB00017290423","spectrum_index":38478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 194.1098 Da; putative annotation: N/A; putative formula: C15H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.233,"smiles":null,"spectrum_id":"CCMSLIB00017290425","spectrum_index":38479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 168.057 Da; putative annotation: N/A; putative formula: C12H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.138,"smiles":null,"spectrum_id":"CCMSLIB00017290428","spectrum_index":38480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 54.9188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.099,"smiles":null,"spectrum_id":"CCMSLIB00017290431","spectrum_index":38481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 222.1982 Da; putative annotation: N/A; putative formula: C15H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.269,"smiles":null,"spectrum_id":"CCMSLIB00017290433","spectrum_index":38482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 14.0296 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.118,"smiles":null,"spectrum_id":"CCMSLIB00017290435","spectrum_index":38483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 19.0136 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.074,"smiles":null,"spectrum_id":"CCMSLIB00017290438","spectrum_index":38484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 133.879 Da; putative annotation: N/A; putative formula: C2H-2O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.939,"smiles":null,"spectrum_id":"CCMSLIB00017290441","spectrum_index":38485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 351.3059 Da; putative annotation: N/A; putative formula: C22H42NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.408,"smiles":null,"spectrum_id":"CCMSLIB00017290443","spectrum_index":38486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU277306 Creatinine|2-amino-3-methyl-4H-imidazol-5-one (delta mass: 37.0138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.08,"smiles":null,"spectrum_id":"CCMSLIB00017290445","spectrum_index":38487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 117.079 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.16,"smiles":null,"spectrum_id":"CCMSLIB00017290448","spectrum_index":38488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 87.0685 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.149,"smiles":null,"spectrum_id":"CCMSLIB00017290451","spectrum_index":38489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 165.0788 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.192,"smiles":null,"spectrum_id":"CCMSLIB00017290452","spectrum_index":38490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 651.3985 Da; putative annotation: N/A; putative formula: C40H55N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":858.485,"smiles":null,"spectrum_id":"CCMSLIB00017290455","spectrum_index":38491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 122.0365 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.123,"smiles":null,"spectrum_id":"CCMSLIB00017290458","spectrum_index":38492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 13.9133 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.952,"smiles":null,"spectrum_id":"CCMSLIB00017290459","spectrum_index":38493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 80.0325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.155,"smiles":null,"spectrum_id":"CCMSLIB00017290462","spectrum_index":38494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 138.1006 Da; putative annotation: N/A; putative formula: C5H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.181,"smiles":null,"spectrum_id":"CCMSLIB00017290465","spectrum_index":38495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 444.1846 Da; putative annotation: N/A; putative formula: C23H24N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.282,"smiles":null,"spectrum_id":"CCMSLIB00017290466","spectrum_index":38496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 647.2285 Da; putative annotation: N/A; putative formula: C25H37N5O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1152.4,"smiles":null,"spectrum_id":"CCMSLIB00017290469","spectrum_index":38497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 738.3542 Da; putative annotation: N/A; putative formula: C45H42N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1405.58,"smiles":null,"spectrum_id":"CCMSLIB00017290472","spectrum_index":38498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 1029.7514 Da; putative annotation: N/A; putative formula: C78H95NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1534.93,"smiles":null,"spectrum_id":"CCMSLIB00017290473","spectrum_index":38499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET020002 CLE_291.1026_12.2|Clensiopenterol|1-(4-amino-3,5-dichlorophenyl)-2-(3-methylbutylamino)ethanol (delta mass: 337.4996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.602,"smiles":null,"spectrum_id":"CCMSLIB00017290476","spectrum_index":38500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 423.837 Da; putative annotation: N/A; putative formula: C4H8O11S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.923,"smiles":null,"spectrum_id":"CCMSLIB00017290479","spectrum_index":38501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 46.0432 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.093,"smiles":null,"spectrum_id":"CCMSLIB00017290480","spectrum_index":38502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Bromo-3,4-dihydro-2(1H)-quinazolinone (delta mass: 63.1785 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017290483","spectrum_index":38503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 40.0 eV (delta mass: 143.9272 Da; putative annotation: N/A; putative formula: C3N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.014,"smiles":null,"spectrum_id":"CCMSLIB00017290486","spectrum_index":38504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 223.1055 Da; putative annotation: N/A; putative formula: C8H17NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.296,"smiles":null,"spectrum_id":"CCMSLIB00017290487","spectrum_index":38505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 102.0827 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017290490","spectrum_index":38506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 15.0187 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.12,"smiles":null,"spectrum_id":"CCMSLIB00017290493","spectrum_index":38507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 55.024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.147,"smiles":null,"spectrum_id":"CCMSLIB00017290494","spectrum_index":38508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 44.0414 Da; putative annotation: N/A; putative formula: CH4N2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.107,"smiles":null,"spectrum_id":"CCMSLIB00017290497","spectrum_index":38509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1276.6202 Da; putative annotation: N/A; putative formula: C58H84N16O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1469.69,"smiles":null,"spectrum_id":"CCMSLIB00017290499","spectrum_index":38510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 317.1491 Da; putative annotation: N/A; putative formula: C15H19N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.261,"smiles":null,"spectrum_id":"CCMSLIB00017290501","spectrum_index":38511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 90.068 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.155,"smiles":null,"spectrum_id":"CCMSLIB00017290504","spectrum_index":38512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 36.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.149,"smiles":null,"spectrum_id":"CCMSLIB00017290507","spectrum_index":38513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-CARBOXYLIC ACID (delta mass: 68.035 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.09,"smiles":null,"spectrum_id":"CCMSLIB00017290508","spectrum_index":38514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 194.0253 Da; putative annotation: N/A; putative formula: C6H10O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.106,"smiles":null,"spectrum_id":"CCMSLIB00017290511","spectrum_index":38515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 525.457 Da; putative annotation: N/A; putative formula: C32H63NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":856.611,"smiles":null,"spectrum_id":"CCMSLIB00017290514","spectrum_index":38516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one (delta mass: 146.0675 Da; putative annotation: N/A; putative formula: C7H15O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.149,"smiles":null,"spectrum_id":"CCMSLIB00017290515","spectrum_index":38517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 167.0774 Da; putative annotation: N/A; putative formula: C9H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.117,"smiles":null,"spectrum_id":"CCMSLIB00017290518","spectrum_index":38518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 307.1994 Da; putative annotation: N/A; putative formula: C14H29NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.348,"smiles":null,"spectrum_id":"CCMSLIB00017290521","spectrum_index":38519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Diamino-4-methylbenzoic acid (delta mass: 42.0206 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.102,"smiles":null,"spectrum_id":"CCMSLIB00017290522","spectrum_index":38520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 177.9399 Da; putative annotation: N/A; putative formula: C5H6O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.063,"smiles":null,"spectrum_id":"CCMSLIB00017290525","spectrum_index":38521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 115.0624 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.117,"smiles":null,"spectrum_id":"CCMSLIB00017290528","spectrum_index":38522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 13.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017290530","spectrum_index":38523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 926.3676 Da; putative annotation: N/A; putative formula: C52H66N2O3S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1080.45,"smiles":null,"spectrum_id":"CCMSLIB00017290533","spectrum_index":38524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 741.0922 Da; putative annotation: N/A; putative formula: C45H19N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":963.189,"smiles":null,"spectrum_id":"CCMSLIB00017290536","spectrum_index":38525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 30.9808 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.057,"smiles":null,"spectrum_id":"CCMSLIB00017290538","spectrum_index":38526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 392.2536 Da; putative annotation: N/A; putative formula: C19H32N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.34,"smiles":null,"spectrum_id":"CCMSLIB00017290541","spectrum_index":38527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 94.0788 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.15,"smiles":null,"spectrum_id":"CCMSLIB00017290544","spectrum_index":38528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 124.0852 Da; putative annotation: N/A; putative formula: C4H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.265,"smiles":null,"spectrum_id":"CCMSLIB00017290546","spectrum_index":38529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 309.1791 Da; putative annotation: N/A; putative formula: C13H27NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.234,"smiles":null,"spectrum_id":"CCMSLIB00017290548","spectrum_index":38530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 552.3361 Da; putative annotation: N/A; putative formula: C26H53N2O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.417,"smiles":null,"spectrum_id":"CCMSLIB00017290551","spectrum_index":38531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 336.2709 Da; putative annotation: N/A; putative formula: C19H36N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.346,"smiles":null,"spectrum_id":"CCMSLIB00017290554","spectrum_index":38532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-L-.gamma.-Glutamyl-L-leucine (delta mass: 242.1268 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.271,"smiles":null,"spectrum_id":"CCMSLIB00017290557","spectrum_index":38533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1,2,3,4-tetrahydroquinoline (delta mass: 358.0964 Da; putative annotation: N/A; putative formula: C11H23N2O7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.208,"smiles":null,"spectrum_id":"CCMSLIB00017290558","spectrum_index":38534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 195.0477 Da; putative annotation: N/A; putative formula: C8H11N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":862.277,"smiles":null,"spectrum_id":"CCMSLIB00017290561","spectrum_index":38535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 225.1016 Da; putative annotation: N/A; putative formula: C12H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.25,"smiles":null,"spectrum_id":"CCMSLIB00017290564","spectrum_index":38536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 561.2564 Da; putative annotation: N/A; putative formula: C23H40N5O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.343,"smiles":null,"spectrum_id":"CCMSLIB00017290566","spectrum_index":38537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 25.9461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.012,"smiles":null,"spectrum_id":"CCMSLIB00017290568","spectrum_index":38538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 104.0619 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.11,"smiles":null,"spectrum_id":"CCMSLIB00017290571","spectrum_index":38539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 477.4037 Da; putative annotation: N/A; putative formula: C27H51N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.552,"smiles":null,"spectrum_id":"CCMSLIB00017290574","spectrum_index":38540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 33.9915 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.093,"smiles":null,"spectrum_id":"CCMSLIB00017290575","spectrum_index":38541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.28,"smiles":null,"spectrum_id":"CCMSLIB00017290578","spectrum_index":38542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 130.1359 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.316,"smiles":null,"spectrum_id":"CCMSLIB00017290581","spectrum_index":38543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 581.2331 Da; putative annotation: N/A; putative formula: C35H36NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.304,"smiles":null,"spectrum_id":"CCMSLIB00017290582","spectrum_index":38544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 130.0753 Da; putative annotation: N/A; putative formula: C5H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.146,"smiles":null,"spectrum_id":"CCMSLIB00017290585","spectrum_index":38545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 282.2557 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.353,"smiles":null,"spectrum_id":"CCMSLIB00017290588","spectrum_index":38546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 134.073 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.185,"smiles":null,"spectrum_id":"CCMSLIB00017290591","spectrum_index":38547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl 2-(aminomethyl)phenylcarbamate (delta mass: 56.0664 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.211,"smiles":null,"spectrum_id":"CCMSLIB00017290593","spectrum_index":38548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 25.8721 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.969,"smiles":null,"spectrum_id":"CCMSLIB00017290596","spectrum_index":38549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017290599","spectrum_index":38550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS002154081-01!Pronethalol hydrochloride51-02-5 (delta mass: 71.0302 Da; putative annotation: N/A; putative formula: C3H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.161,"smiles":null,"spectrum_id":"CCMSLIB00017290601","spectrum_index":38551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 128.0113 Da; putative annotation: N/A; putative formula: C5H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.056,"smiles":null,"spectrum_id":"CCMSLIB00017290604","spectrum_index":38552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 71.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.133,"smiles":null,"spectrum_id":"CCMSLIB00017290607","spectrum_index":38553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:205060\"\" (delta mass: 72.0094 Da; putative annotation: N/A; putative formula: C5N2O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.101,"smiles":null,"spectrum_id":"CCMSLIB00017290609","spectrum_index":38554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 331.1435 Da; putative annotation: N/A; putative formula: C19H17N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.21,"smiles":null,"spectrum_id":"CCMSLIB00017290611","spectrum_index":38555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Oxo-1-pyrrolidinyl)acetic acid (delta mass: 88.0519 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.117,"smiles":null,"spectrum_id":"CCMSLIB00017290614","spectrum_index":38556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 136.0147 Da; putative annotation: N/A; putative formula: CH5N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.101,"smiles":null,"spectrum_id":"CCMSLIB00017290617","spectrum_index":38557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 146.0357 Da; putative annotation: p-coumaric acid CollisionEnergy:102040; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.116,"smiles":null,"spectrum_id":"CCMSLIB00017290618","spectrum_index":38558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 324.1056 Da; putative annotation: Maltose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.229,"smiles":null,"spectrum_id":"CCMSLIB00017290621","spectrum_index":38559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 128.0472 Da; putative annotation: Adipic acid; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.118,"smiles":null,"spectrum_id":"CCMSLIB00017290624","spectrum_index":38560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 280.2793 Da; putative annotation: Pristanic acid; putative formula: C19H36O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.368,"smiles":null,"spectrum_id":"CCMSLIB00017290626","spectrum_index":38561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006041 (+/-) Salsolinol|1-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 161.0837 Da; putative annotation: .beta.-Phenyl-.gamma.-aminobutyric acid; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.186,"smiles":null,"spectrum_id":"CCMSLIB00017290628","spectrum_index":38562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 141.0435 Da; putative annotation: (.alpha.S,1S,2R)-.alpha.-Amino-2-carboxycyclopropaneacetic acid; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017290631","spectrum_index":38563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 316.2413 Da; putative annotation: 3-Hexadec-15-en-7-ynyl-4-hydroxy-5-methyloxolan-2-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.365,"smiles":null,"spectrum_id":"CCMSLIB00017290634","spectrum_index":38564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of fMet CollisionEnergy:205060 (delta mass: 83.0374 Da; putative annotation: 1-AMINOCYCLOPROPANE-1-CARBOXYLIC ACID; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.091,"smiles":null,"spectrum_id":"CCMSLIB00017290636","spectrum_index":38565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 188.0815 Da; putative annotation: N/A; putative formula: C8H8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.251,"smiles":null,"spectrum_id":"CCMSLIB00017290638","spectrum_index":38566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 118.0265 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.086,"smiles":null,"spectrum_id":"CCMSLIB00017290641","spectrum_index":38567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 125.1676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.248,"smiles":null,"spectrum_id":"CCMSLIB00017290644","spectrum_index":38568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 174.0798 Da; putative annotation: N/A; putative formula: C10H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.151,"smiles":null,"spectrum_id":"CCMSLIB00017290646","spectrum_index":38569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 86.0516 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.175,"smiles":null,"spectrum_id":"CCMSLIB00017290649","spectrum_index":38570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 522.1822 Da; putative annotation: N/A; putative formula: C20H26N8O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.247,"smiles":null,"spectrum_id":"CCMSLIB00017290651","spectrum_index":38571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Glu (delta mass: 74.0011 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.13,"smiles":null,"spectrum_id":"CCMSLIB00017290654","spectrum_index":38572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 14.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.164,"smiles":null,"spectrum_id":"CCMSLIB00017290657","spectrum_index":38573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 44.0303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.081,"smiles":null,"spectrum_id":"CCMSLIB00017290660","spectrum_index":38574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 96.0916 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.178,"smiles":null,"spectrum_id":"CCMSLIB00017290661","spectrum_index":38575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 102.0135 Da; putative annotation: N/A; putative formula: C4H6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.109,"smiles":null,"spectrum_id":"CCMSLIB00017290664","spectrum_index":38576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 73.992 Da; putative annotation: N/A; putative formula: C2H3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.029,"smiles":null,"spectrum_id":"CCMSLIB00017290667","spectrum_index":38577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 130.1358 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.217,"smiles":null,"spectrum_id":"CCMSLIB00017290669","spectrum_index":38578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 76.0361 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.154,"smiles":null,"spectrum_id":"CCMSLIB00017290672","spectrum_index":38579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 598.175 Da; putative annotation: N/A; putative formula: C37H30N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.246,"smiles":null,"spectrum_id":"CCMSLIB00017290674","spectrum_index":38580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 15.0105 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.091,"smiles":null,"spectrum_id":"CCMSLIB00017290677","spectrum_index":38581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 125.0688 Da; putative annotation: N/A; putative formula: C4H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.124,"smiles":null,"spectrum_id":"CCMSLIB00017290680","spectrum_index":38582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 180.1513 Da; putative annotation: N/A; putative formula: C12H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.238,"smiles":null,"spectrum_id":"CCMSLIB00017290683","spectrum_index":38583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 218.1284 Da; putative annotation: N/A; putative formula: C10H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.272,"smiles":null,"spectrum_id":"CCMSLIB00017290686","spectrum_index":38584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 62.9949 Da; putative annotation: N/A; putative formula: HNO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.134,"smiles":null,"spectrum_id":"CCMSLIB00017290687","spectrum_index":38585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HarmalolHCl2H2O///harmalol///Harmalol CollisionEnergy:205060 (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017290690","spectrum_index":38586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 45.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.155,"smiles":null,"spectrum_id":"CCMSLIB00017290693","spectrum_index":38587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 216.0821 Da; putative annotation: N/A; putative formula: C10H16O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.232,"smiles":null,"spectrum_id":"CCMSLIB00017290694","spectrum_index":38588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 234.0526 Da; putative annotation: N/A; putative formula: C12H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.185,"smiles":null,"spectrum_id":"CCMSLIB00017290697","spectrum_index":38589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 255.627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.713,"smiles":null,"spectrum_id":"CCMSLIB00017290700","spectrum_index":38590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 314.6744 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.761,"smiles":null,"spectrum_id":"CCMSLIB00017290702","spectrum_index":38591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 272.6581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.744,"smiles":null,"spectrum_id":"CCMSLIB00017290705","spectrum_index":38592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 46.023 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.102,"smiles":null,"spectrum_id":"CCMSLIB00017290707","spectrum_index":38593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 11.0028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017290710","spectrum_index":38594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 311.2485 Da; putative annotation: N/A; putative formula: C17H34N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.346,"smiles":null,"spectrum_id":"CCMSLIB00017290713","spectrum_index":38595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 186.0675 Da; putative annotation: N/A; putative formula: C7H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.133,"smiles":null,"spectrum_id":"CCMSLIB00017290716","spectrum_index":38596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Difluoromethoxy)-1H-indole-2-carboxylic acid (delta mass: 7.9762 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.023,"smiles":null,"spectrum_id":"CCMSLIB00017290718","spectrum_index":38597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380791-01!methyl 3,7,8-trihydroxy-3-methyl-10-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylate (delta mass: 322.0637 Da; putative annotation: N/A; putative formula: C15H10N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.14,"smiles":null,"spectrum_id":"CCMSLIB00017290720","spectrum_index":38598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)(3-fluorophenyl)amine (delta mass: 18.0175 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.147,"smiles":null,"spectrum_id":"CCMSLIB00017290723","spectrum_index":38599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-(Difluoromethylthio)phenyl)-N-methylmethanamine (delta mass: 180.1005 Da; putative annotation: N/A; putative formula: C8H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.166,"smiles":null,"spectrum_id":"CCMSLIB00017290726","spectrum_index":38600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 63.0358 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.148,"smiles":null,"spectrum_id":"CCMSLIB00017290727","spectrum_index":38601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 50.0523 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017290731","spectrum_index":38602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 88.0571 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.195,"smiles":null,"spectrum_id":"CCMSLIB00017290733","spectrum_index":38603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 839.6314 Da; putative annotation: N/A; putative formula: C12H8O19S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1028.78,"smiles":null,"spectrum_id":"CCMSLIB00017290736","spectrum_index":38604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 751.5798 Da; putative annotation: N/A; putative formula: C45H77N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":940.728,"smiles":null,"spectrum_id":"CCMSLIB00017290739","spectrum_index":38605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 487.423 Da; putative annotation: N/A; putative formula: C25H49N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.571,"smiles":null,"spectrum_id":"CCMSLIB00017290740","spectrum_index":38606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3,4-Difluorophenyl)-6,7-dimethyl-3,4-dihydro-2(1H)-quinolinone (delta mass: 216.1488 Da; putative annotation: N/A; putative formula: C11H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.268,"smiles":null,"spectrum_id":"CCMSLIB00017290743","spectrum_index":38607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 732.3888 Da; putative annotation: N/A; putative formula: C37H60N6O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.449,"smiles":null,"spectrum_id":"CCMSLIB00017290746","spectrum_index":38608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381307-01!1-[2,4-dihydroxy-3-(2-hydroxyethyl)-6-methoxyphenyl]butan-1-one (delta mass: 170.0924 Da; putative annotation: N/A; putative formula: C5H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.215,"smiles":null,"spectrum_id":"CCMSLIB00017290749","spectrum_index":38609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 96.0422 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.102,"smiles":null,"spectrum_id":"CCMSLIB00017290752","spectrum_index":38610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 113.5532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.624,"smiles":null,"spectrum_id":"CCMSLIB00017290754","spectrum_index":38611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 589.5463 Da; putative annotation: N/A; putative formula: C39H67N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.625,"smiles":null,"spectrum_id":"CCMSLIB00017290756","spectrum_index":38612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinaldic acid (delta mass: 115.1028 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.158,"smiles":null,"spectrum_id":"CCMSLIB00017290759","spectrum_index":38613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 70.0182 Da; putative annotation: N/A; putative formula: C2H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.105,"smiles":null,"spectrum_id":"CCMSLIB00017290762","spectrum_index":38614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 93.0316 Da; putative annotation: N/A; putative formula: C4H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.087,"smiles":null,"spectrum_id":"CCMSLIB00017290765","spectrum_index":38615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Pyridinyl)ethanol (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.091,"smiles":null,"spectrum_id":"CCMSLIB00017290766","spectrum_index":38616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 73.0519 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.165,"smiles":null,"spectrum_id":"CCMSLIB00017290769","spectrum_index":38617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 118.9459 Da; putative annotation: N/A; putative formula: H-1N3OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.006,"smiles":null,"spectrum_id":"CCMSLIB00017290772","spectrum_index":38618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 299.1216 Da; putative annotation: N/A; putative formula: C10H21NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.192,"smiles":null,"spectrum_id":"CCMSLIB00017290775","spectrum_index":38619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(phenylmethoxy)-2H-3,4,5,6-tetrahydropyra n-3-yl]acetamide CollisionEnergy:102040\"\" (delta mass: 125.0394 Da; putative annotation: N/A; putative formula: C6H8NP)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.184,"smiles":null,"spectrum_id":"CCMSLIB00017290776","spectrum_index":38620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 72.9117 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.928,"smiles":null,"spectrum_id":"CCMSLIB00017290780","spectrum_index":38621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 204.0532 Da; putative annotation: N/A; putative formula: C10H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.129,"smiles":null,"spectrum_id":"CCMSLIB00017290782","spectrum_index":38622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 86.0845 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.181,"smiles":null,"spectrum_id":"CCMSLIB00017290785","spectrum_index":38623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 654.4619 Da; putative annotation: N/A; putative formula: C40H58N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.548,"smiles":null,"spectrum_id":"CCMSLIB00017290788","spectrum_index":38624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 59.915 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.97,"smiles":null,"spectrum_id":"CCMSLIB00017290790","spectrum_index":38625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 906.261 Da; putative annotation: N/A; putative formula: C47H38N8O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1033.3,"smiles":null,"spectrum_id":"CCMSLIB00017290792","spectrum_index":38626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lofemizole (delta mass: 215.1121 Da; putative annotation: N/A; putative formula: C6H13N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.165,"smiles":null,"spectrum_id":"CCMSLIB00017290795","spectrum_index":38627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ozagrel (delta mass: 122.0461 Da; putative annotation: N/A; putative formula: C2H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.143,"smiles":null,"spectrum_id":"CCMSLIB00017290798","spectrum_index":38628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 64.0159 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.097,"smiles":null,"spectrum_id":"CCMSLIB00017290799","spectrum_index":38629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Threonine (delta mass: 28.0101 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.076,"smiles":null,"spectrum_id":"CCMSLIB00017290802","spectrum_index":38630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 245.1756 Da; putative annotation: N/A; putative formula: C12H19N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.335,"smiles":null,"spectrum_id":"CCMSLIB00017290805","spectrum_index":38631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 185.1425 Da; putative annotation: N/A; putative formula: C10H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.448,"smiles":null,"spectrum_id":"CCMSLIB00017290806","spectrum_index":38632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoroindole-2-carboxylic acid (delta mass: 42.0168 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.062,"smiles":null,"spectrum_id":"CCMSLIB00017290809","spectrum_index":38633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 11.9992 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.075,"smiles":null,"spectrum_id":"CCMSLIB00017290812","spectrum_index":38634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 473.1729 Da; putative annotation: N/A; putative formula: C22H35NO4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.244,"smiles":null,"spectrum_id":"CCMSLIB00017290813","spectrum_index":38635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-methyl-2-aminoindane (delta mass: 12.0038 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.116,"smiles":null,"spectrum_id":"CCMSLIB00017290816","spectrum_index":38636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 245.1987 Da; putative annotation: N/A; putative formula: C13H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.279,"smiles":null,"spectrum_id":"CCMSLIB00017290818","spectrum_index":38637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 8.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.133,"smiles":null,"spectrum_id":"CCMSLIB00017290820","spectrum_index":38638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 117.9943 Da; putative annotation: N/A; putative formula: CH2N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.06,"smiles":null,"spectrum_id":"CCMSLIB00017290823","spectrum_index":38639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 30.0222 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.113,"smiles":null,"spectrum_id":"CCMSLIB00017290826","spectrum_index":38640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 124.0154 Da; putative annotation: N/A; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.069,"smiles":null,"spectrum_id":"CCMSLIB00017290827","spectrum_index":38641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 359.6718 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.758,"smiles":null,"spectrum_id":"CCMSLIB00017290830","spectrum_index":38642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 343.683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.769,"smiles":null,"spectrum_id":"CCMSLIB00017290833","spectrum_index":38643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 97.0639 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.218,"smiles":null,"spectrum_id":"CCMSLIB00017290835","spectrum_index":38644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 280.3537 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.412,"smiles":null,"spectrum_id":"CCMSLIB00017290838","spectrum_index":38645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 76.0316 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.149,"smiles":null,"spectrum_id":"CCMSLIB00017290840","spectrum_index":38646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 174.2029 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.262,"smiles":null,"spectrum_id":"CCMSLIB00017290843","spectrum_index":38647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 197.1069 Da; putative annotation: N/A; putative formula: C10H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.183,"smiles":null,"spectrum_id":"CCMSLIB00017290845","spectrum_index":38648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 73.0435 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.065,"smiles":null,"spectrum_id":"CCMSLIB00017290848","spectrum_index":38649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 55.9792 Da; putative annotation: N/A; putative formula: C2HP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.086,"smiles":null,"spectrum_id":"CCMSLIB00017290851","spectrum_index":38650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-VALINE - 40.0 eV (delta mass: 57.0211 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.107,"smiles":null,"spectrum_id":"CCMSLIB00017290853","spectrum_index":38651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005923 Tetrahydropapaveroline|1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 64.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.176,"smiles":null,"spectrum_id":"CCMSLIB00017290856","spectrum_index":38652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa (delta mass: 58.0422 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.118,"smiles":null,"spectrum_id":"CCMSLIB00017290859","spectrum_index":38653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 253.24 Da; putative annotation: N/A; putative formula: C16H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.326,"smiles":null,"spectrum_id":"CCMSLIB00017290862","spectrum_index":38654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 131.1131 Da; putative annotation: N/A; putative formula: C10H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.135,"smiles":null,"spectrum_id":"CCMSLIB00017290864","spectrum_index":38655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 104.0111 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.108,"smiles":null,"spectrum_id":"CCMSLIB00017290867","spectrum_index":38656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 2.9873 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.058,"smiles":null,"spectrum_id":"CCMSLIB00017290870","spectrum_index":38657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 295.2972 Da; putative annotation: N/A; putative formula: C18H37N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.436,"smiles":null,"spectrum_id":"CCMSLIB00017290871","spectrum_index":38658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 83.9847 Da; putative annotation: N/A; putative formula: C3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.044,"smiles":null,"spectrum_id":"CCMSLIB00017290874","spectrum_index":38659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 9.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017290877","spectrum_index":38660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 93.1735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.195,"smiles":null,"spectrum_id":"CCMSLIB00017290880","spectrum_index":38661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 242.0993 Da; putative annotation: N/A; putative formula: C13H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.17,"smiles":null,"spectrum_id":"CCMSLIB00017290882","spectrum_index":38662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 358.2357 Da; putative annotation: N/A; putative formula: C19H34O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.306,"smiles":null,"spectrum_id":"CCMSLIB00017290884","spectrum_index":38663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 94.078 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.253,"smiles":null,"spectrum_id":"CCMSLIB00017290887","spectrum_index":38664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[3-(Trifluoromethyl)phenyl]ethylamine (delta mass: 126.1027 Da; putative annotation: N/A; putative formula: C4H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.186,"smiles":null,"spectrum_id":"CCMSLIB00017290890","spectrum_index":38665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one (delta mass: 46.0062 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.088,"smiles":null,"spectrum_id":"CCMSLIB00017290892","spectrum_index":38666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 238.1574 Da; putative annotation: N/A; putative formula: C14H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.244,"smiles":null,"spectrum_id":"CCMSLIB00017290894","spectrum_index":38667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 59.0734 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.165,"smiles":null,"spectrum_id":"CCMSLIB00017290897","spectrum_index":38668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chymostatinol A (delta mass: 293.1626 Da; putative annotation: N/A; putative formula: C16H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":889.482,"smiles":null,"spectrum_id":"CCMSLIB00017290900","spectrum_index":38669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KF 77AG6 (delta mass: 756.2184 Da; putative annotation: N/A; putative formula: C27H40N4O21)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1122.4,"smiles":null,"spectrum_id":"CCMSLIB00017290902","spectrum_index":38670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:205060\"\" (delta mass: 221.127 Da; putative annotation: N/A; putative formula: C10H15N5O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.218,"smiles":null,"spectrum_id":"CCMSLIB00017290904","spectrum_index":38671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 90.0106 Da; putative annotation: N/A; putative formula: C6H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.15,"smiles":null,"spectrum_id":"CCMSLIB00017290907","spectrum_index":38672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347453-02!(E)-1,7-bis(4-hydroxyphenyl)hept-4-en-3-one (delta mass: 250.0795 Da; putative annotation: N/A; putative formula: C10H19O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.228,"smiles":null,"spectrum_id":"CCMSLIB00017290909","spectrum_index":38673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 415.2104 Da; putative annotation: N/A; putative formula: C22H29N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.312,"smiles":null,"spectrum_id":"CCMSLIB00017290912","spectrum_index":38674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 97.0916 Da; putative annotation: N/A; putative formula: C6H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.119,"smiles":null,"spectrum_id":"CCMSLIB00017290915","spectrum_index":38675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 32.0303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.118,"smiles":null,"spectrum_id":"CCMSLIB00017290918","spectrum_index":38676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 31.0071 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.067,"smiles":null,"spectrum_id":"CCMSLIB00017290919","spectrum_index":38677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 180.0684 Da; putative annotation: N/A; putative formula: C12H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.17,"smiles":null,"spectrum_id":"CCMSLIB00017290922","spectrum_index":38678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 64.0165 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.077,"smiles":null,"spectrum_id":"CCMSLIB00017290925","spectrum_index":38679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 56.9611 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.973,"smiles":null,"spectrum_id":"CCMSLIB00017290927","spectrum_index":38680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-His (delta mass: 97.0519 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.213,"smiles":null,"spectrum_id":"CCMSLIB00017290930","spectrum_index":38681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 323.1701 Da; putative annotation: N/A; putative formula: C13H29N3O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.241,"smiles":null,"spectrum_id":"CCMSLIB00017290932","spectrum_index":38682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C8:0 (delta mass: 72.0767 Da; putative annotation: N/A; putative formula: C2H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.289,"smiles":null,"spectrum_id":"CCMSLIB00017290935","spectrum_index":38683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-3-carbaldehyde (delta mass: 15.0309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.081,"smiles":null,"spectrum_id":"CCMSLIB00017290938","spectrum_index":38684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 111.032 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.166,"smiles":null,"spectrum_id":"CCMSLIB00017290939","spectrum_index":38685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 255.0651 Da; putative annotation: N/A; putative formula: C6H9N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.17,"smiles":null,"spectrum_id":"CCMSLIB00017290942","spectrum_index":38686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 49.0317 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017290945","spectrum_index":38687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 565.2002 Da; putative annotation: N/A; putative formula: C36H27N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.286,"smiles":null,"spectrum_id":"CCMSLIB00017290947","spectrum_index":38688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 36.0206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.139,"smiles":null,"spectrum_id":"CCMSLIB00017290949","spectrum_index":38689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 76.143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.17,"smiles":null,"spectrum_id":"CCMSLIB00017290952","spectrum_index":38690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 182.0314 Da; putative annotation: N/A; putative formula: C9H11PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.103,"smiles":null,"spectrum_id":"CCMSLIB00017290955","spectrum_index":38691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 190.4192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.5,"smiles":null,"spectrum_id":"CCMSLIB00017290956","spectrum_index":38692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1140.073 Da; putative annotation: N/A; putative formula: C60H52O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1321.14,"smiles":null,"spectrum_id":"CCMSLIB00017290959","spectrum_index":38693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 88.1066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017290961","spectrum_index":38694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 20.0 eV (delta mass: 633.0185 Da; putative annotation: N/A; putative formula: C17H7N13O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.132,"smiles":null,"spectrum_id":"CCMSLIB00017290963","spectrum_index":38695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 58.0209 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.207,"smiles":null,"spectrum_id":"CCMSLIB00017290966","spectrum_index":38696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-3-Benzazepine-7,8-diol, 6-chloro-2,3,4,5-tetrahydro-1-phenyl- (delta mass: 136.061 Da; putative annotation: N/A; putative formula: C3H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.155,"smiles":null,"spectrum_id":"CCMSLIB00017290967","spectrum_index":38697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 45.0222 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.161,"smiles":null,"spectrum_id":"CCMSLIB00017290970","spectrum_index":38698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 28.9919 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.099,"smiles":null,"spectrum_id":"CCMSLIB00017290973","spectrum_index":38699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-methoxybenzaldehyde (delta mass: 32.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.08,"smiles":null,"spectrum_id":"CCMSLIB00017290974","spectrum_index":38700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 814.4713 Da; putative annotation: N/A; putative formula: C40H58N14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":977.531,"smiles":null,"spectrum_id":"CCMSLIB00017290977","spectrum_index":38701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(2-methoxybenzyl)ethanamine (delta mass: 72.0397 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.184,"smiles":null,"spectrum_id":"CCMSLIB00017290979","spectrum_index":38702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ310302 Warfarin|2-hydroxy-3-(3-oxo-1-phenylbutyl)chromen-4-one|Coumafen (delta mass: 250.0637 Da; putative annotation: N/A; putative formula: C9H10N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.176,"smiles":null,"spectrum_id":"CCMSLIB00017290981","spectrum_index":38703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 54.0468 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.19,"smiles":null,"spectrum_id":"CCMSLIB00017290984","spectrum_index":38704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 186.1041 Da; putative annotation: N/A; putative formula: C13H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.175,"smiles":null,"spectrum_id":"CCMSLIB00017290986","spectrum_index":38705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 316.1057 Da; putative annotation: N/A; putative formula: C16H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.208,"smiles":null,"spectrum_id":"CCMSLIB00017290988","spectrum_index":38706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoroindoline (delta mass: 176.0358 Da; putative annotation: N/A; putative formula: C5H9N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.098,"smiles":null,"spectrum_id":"CCMSLIB00017290991","spectrum_index":38707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.134,"smiles":null,"spectrum_id":"CCMSLIB00017290993","spectrum_index":38708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.123,"smiles":null,"spectrum_id":"CCMSLIB00017290995","spectrum_index":38709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 202.0929 Da; putative annotation: N/A; putative formula: C12H14N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.134,"smiles":null,"spectrum_id":"CCMSLIB00017290998","spectrum_index":38710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-(2-fluorophenyl)-1H-pyrazole-4-carbonitrile (delta mass: 114.0505 Da; putative annotation: N/A; putative formula: C6H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.123,"smiles":null,"spectrum_id":"CCMSLIB00017291001","spectrum_index":38711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 606.3057 Da; putative annotation: N/A; putative formula: C34H54OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.397,"smiles":null,"spectrum_id":"CCMSLIB00017291003","spectrum_index":38712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 129.1477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.263,"smiles":null,"spectrum_id":"CCMSLIB00017291005","spectrum_index":38713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-hydroxy-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate (delta mass: 86.0261 Da; putative annotation: N/A; putative formula: C6H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.17,"smiles":null,"spectrum_id":"CCMSLIB00017291008","spectrum_index":38714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 47.0242 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.079,"smiles":null,"spectrum_id":"CCMSLIB00017291011","spectrum_index":38715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 280.051 Da; putative annotation: N/A; putative formula: C14H9N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.122,"smiles":null,"spectrum_id":"CCMSLIB00017291012","spectrum_index":38716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 98.0519 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.138,"smiles":null,"spectrum_id":"CCMSLIB00017291015","spectrum_index":38717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 68.0513 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.123,"smiles":null,"spectrum_id":"CCMSLIB00017291018","spectrum_index":38718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 185.0914 Da; putative annotation: N/A; putative formula: C6H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.188,"smiles":null,"spectrum_id":"CCMSLIB00017291020","spectrum_index":38719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Isoserine (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.061,"smiles":null,"spectrum_id":"CCMSLIB00017291022","spectrum_index":38720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 266.2967 Da; putative annotation: N/A; putative formula: C19H38)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.378,"smiles":null,"spectrum_id":"CCMSLIB00017291025","spectrum_index":38721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 155.0698 Da; putative annotation: N/A; putative formula: C6H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.315,"smiles":null,"spectrum_id":"CCMSLIB00017291028","spectrum_index":38722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 162.0534 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.14,"smiles":null,"spectrum_id":"CCMSLIB00017291029","spectrum_index":38723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 133.0419 Da; putative annotation: N/A; putative formula: C2H7N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.124,"smiles":null,"spectrum_id":"CCMSLIB00017291032","spectrum_index":38724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 93.079 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.17,"smiles":null,"spectrum_id":"CCMSLIB00017291035","spectrum_index":38725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 267.1651 Da; putative annotation: N/A; putative formula: C15H25NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.267,"smiles":null,"spectrum_id":"CCMSLIB00017291036","spectrum_index":38726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-(2-fluorophenyl)-1H-pyrazole-4-carbonitrile (delta mass: 64.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.11,"smiles":null,"spectrum_id":"CCMSLIB00017291039","spectrum_index":38727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 168.1304 Da; putative annotation: N/A; putative formula: C14H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.404,"smiles":null,"spectrum_id":"CCMSLIB00017291042","spectrum_index":38728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 132.0211 Da; putative annotation: N/A; putative formula: C8H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017291044","spectrum_index":38729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 166.052 Da; putative annotation: N/A; putative formula: C3H10N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.191,"smiles":null,"spectrum_id":"CCMSLIB00017291046","spectrum_index":38730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 113.084 Da; putative annotation: LEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.234,"smiles":null,"spectrum_id":"CCMSLIB00017291049","spectrum_index":38731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 113.0837 Da; putative annotation: 4-Amino-4-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.164,"smiles":null,"spectrum_id":"CCMSLIB00017291052","spectrum_index":38732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 164.0581 Da; putative annotation: 2-Hydroxyfluorene; putative formula: C13H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.123,"smiles":null,"spectrum_id":"CCMSLIB00017291053","spectrum_index":38733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 162.0532 Da; putative annotation: Spectral Match to D-(+)-Mannose from NIST14; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.124,"smiles":null,"spectrum_id":"CCMSLIB00017291056","spectrum_index":38734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Gln (delta mass: 129.0412 Da; putative annotation: O-Acetyl-L-serine; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.15,"smiles":null,"spectrum_id":"CCMSLIB00017291059","spectrum_index":38735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 201.1004 Da; putative annotation: D-PANTOTHENIC ACID - 30.0 eV; putative formula: C9H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.16,"smiles":null,"spectrum_id":"CCMSLIB00017291061","spectrum_index":38736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 131.0586 Da; putative annotation: N6-Methyladenine; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017291063","spectrum_index":38737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 324.1075 Da; putative annotation: .alpha.,.beta.-Trehalose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.284,"smiles":null,"spectrum_id":"CCMSLIB00017291066","spectrum_index":38738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 119.0733 Da; putative annotation: 2-Methyl-4-(methylamino)phenol; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.15,"smiles":null,"spectrum_id":"CCMSLIB00017291069","spectrum_index":38739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 97.0528 Da; putative annotation: 2-Amino-2-cyclopropylacetic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.155,"smiles":null,"spectrum_id":"CCMSLIB00017291072","spectrum_index":38740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 210.1252 Da; putative annotation: NCGC00180743-02!9-methoxycarbonyldec-9-enoic acid; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.201,"smiles":null,"spectrum_id":"CCMSLIB00017291074","spectrum_index":38741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 278.0585 Da; putative annotation: Aspulvinone E - Yellow pigment - Found in Aspergillus; putative formula: C17H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.119,"smiles":null,"spectrum_id":"CCMSLIB00017291077","spectrum_index":38742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 72.0364 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017291080","spectrum_index":38743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 98.0378 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.049,"smiles":null,"spectrum_id":"CCMSLIB00017291082","spectrum_index":38744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 184.123 Da; putative annotation: N/A; putative formula: C8H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.23,"smiles":null,"spectrum_id":"CCMSLIB00017291085","spectrum_index":38745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 11.9997 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.08,"smiles":null,"spectrum_id":"CCMSLIB00017291088","spectrum_index":38746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 77.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.227,"smiles":null,"spectrum_id":"CCMSLIB00017291090","spectrum_index":38747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(4-Methoxyphenyl)ethyl]-3-methyl-2-butenamide (delta mass: 78.0469 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.196,"smiles":null,"spectrum_id":"CCMSLIB00017291093","spectrum_index":38748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 4-nitro-1H-imidazole-5-carboxylate (delta mass: 142.1238 Da; putative annotation: N/A; putative formula: C6H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.175,"smiles":null,"spectrum_id":"CCMSLIB00017291096","spectrum_index":38749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 135.0687 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017291098","spectrum_index":38750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 289.1177 Da; putative annotation: N/A; putative formula: C13H15N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.215,"smiles":null,"spectrum_id":"CCMSLIB00017291101","spectrum_index":38751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 43.0315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.1,"smiles":null,"spectrum_id":"CCMSLIB00017291104","spectrum_index":38752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 67.0393 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.126,"smiles":null,"spectrum_id":"CCMSLIB00017291106","spectrum_index":38753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 1179.7649 Da; putative annotation: N/A; putative formula: C62H97N15O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1563.91,"smiles":null,"spectrum_id":"CCMSLIB00017291109","spectrum_index":38754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloropropyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 47.1429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.206,"smiles":null,"spectrum_id":"CCMSLIB00017291112","spectrum_index":38755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 175.0484 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.124,"smiles":null,"spectrum_id":"CCMSLIB00017291115","spectrum_index":38756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 11.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.139,"smiles":null,"spectrum_id":"CCMSLIB00017291116","spectrum_index":38757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 462.9727 Da; putative annotation: N/A; putative formula: C17H13N5OS5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.043,"smiles":null,"spectrum_id":"CCMSLIB00017291119","spectrum_index":38758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 117.0633 Da; putative annotation: N/A; putative formula: C2H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.097,"smiles":null,"spectrum_id":"CCMSLIB00017291122","spectrum_index":38759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 60.0765 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.199,"smiles":null,"spectrum_id":"CCMSLIB00017291125","spectrum_index":38760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 161.0691 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.124,"smiles":null,"spectrum_id":"CCMSLIB00017291126","spectrum_index":38761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 306.0704 Da; putative annotation: N/A; putative formula: C11H18N2O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.198,"smiles":null,"spectrum_id":"CCMSLIB00017291129","spectrum_index":38762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 62.016 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.06,"smiles":null,"spectrum_id":"CCMSLIB00017291132","spectrum_index":38763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01042 Hexahydrocurcumin (delta mass: 190.063 Da; putative annotation: N/A; putative formula: C11H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.243,"smiles":null,"spectrum_id":"CCMSLIB00017291135","spectrum_index":38764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 227.0788 Da; putative annotation: N/A; putative formula: C10H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.165,"smiles":null,"spectrum_id":"CCMSLIB00017291136","spectrum_index":38765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 248.1081 Da; putative annotation: N/A; putative formula: C11H20O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.185,"smiles":null,"spectrum_id":"CCMSLIB00017291139","spectrum_index":38766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmane (delta mass: 62.085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.177,"smiles":null,"spectrum_id":"CCMSLIB00017291142","spectrum_index":38767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 25.9017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017291144","spectrum_index":38768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 17.0318 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.175,"smiles":null,"spectrum_id":"CCMSLIB00017291146","spectrum_index":38769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Felbinac (delta mass: 47.9995 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.091,"smiles":null,"spectrum_id":"CCMSLIB00017291149","spectrum_index":38770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol - 30.0 eV (delta mass: 37.9251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.085,"smiles":null,"spectrum_id":"CCMSLIB00017291152","spectrum_index":38771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1H-1,2,4-triazole-3,5-diamine (delta mass: 46.0192 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.112,"smiles":null,"spectrum_id":"CCMSLIB00017291154","spectrum_index":38772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 240.0783 Da; putative annotation: N/A; putative formula: C10H12N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.207,"smiles":null,"spectrum_id":"CCMSLIB00017291157","spectrum_index":38773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 489.3144 Da; putative annotation: N/A; putative formula: C34H39N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.348,"smiles":null,"spectrum_id":"CCMSLIB00017291159","spectrum_index":38774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 44.0463 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.221,"smiles":null,"spectrum_id":"CCMSLIB00017291162","spectrum_index":38775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 166.0987 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.174,"smiles":null,"spectrum_id":"CCMSLIB00017291165","spectrum_index":38776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Quinolinediol (delta mass: 187.0682 Da; putative annotation: N/A; putative formula: C8H15NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.123,"smiles":null,"spectrum_id":"CCMSLIB00017291166","spectrum_index":38777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 403.2248 Da; putative annotation: N/A; putative formula: C17H33N5O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.336,"smiles":null,"spectrum_id":"CCMSLIB00017291169","spectrum_index":38778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylic acid (delta mass: 202.11 Da; putative annotation: N/A; putative formula: C6H15N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.223,"smiles":null,"spectrum_id":"CCMSLIB00017291172","spectrum_index":38779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 118.0266 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.113,"smiles":null,"spectrum_id":"CCMSLIB00017291174","spectrum_index":38780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-serine (delta mass: 28.9985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.064,"smiles":null,"spectrum_id":"CCMSLIB00017291176","spectrum_index":38781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 146.2032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.3,"smiles":null,"spectrum_id":"CCMSLIB00017291179","spectrum_index":38782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE0; MS2Dec (delta mass: 342.1162 Da; putative annotation: N/A; putative formula: C12H22O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.177,"smiles":null,"spectrum_id":"CCMSLIB00017291182","spectrum_index":38783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 213.3015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.471,"smiles":null,"spectrum_id":"CCMSLIB00017291185","spectrum_index":38784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 59.0385 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.099,"smiles":null,"spectrum_id":"CCMSLIB00017291186","spectrum_index":38785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 290.2661 Da; putative annotation: N/A; putative formula: C20H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.352,"smiles":null,"spectrum_id":"CCMSLIB00017291189","spectrum_index":38786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 1-methylbeta-carboline-3-carboxylate CollisionEnergy:205060 (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.108,"smiles":null,"spectrum_id":"CCMSLIB00017291192","spectrum_index":38787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl tyramine (delta mass: 47.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.139,"smiles":null,"spectrum_id":"CCMSLIB00017291195","spectrum_index":38788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 26.0154 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017291198","spectrum_index":38789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 733.5835 Da; putative annotation: N/A; putative formula: C48H79NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1117.73,"smiles":null,"spectrum_id":"CCMSLIB00017291199","spectrum_index":38790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1-octanamine (delta mass: 652.4023 Da; putative annotation: N/A; putative formula: C37H56N4O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.624,"smiles":null,"spectrum_id":"CCMSLIB00017291202","spectrum_index":38791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 125.0473 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.149,"smiles":null,"spectrum_id":"CCMSLIB00017291205","spectrum_index":38792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 194.1669 Da; putative annotation: N/A; putative formula: C13H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.248,"smiles":null,"spectrum_id":"CCMSLIB00017291207","spectrum_index":38793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 273.101 Da; putative annotation: N/A; putative formula: C16H19NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.172,"smiles":null,"spectrum_id":"CCMSLIB00017291209","spectrum_index":38794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 106.0416 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.086,"smiles":null,"spectrum_id":"CCMSLIB00017291212","spectrum_index":38795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mandelic acid (delta mass: 32.0084 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.063,"smiles":null,"spectrum_id":"CCMSLIB00017291215","spectrum_index":38796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 267.0326 Da; putative annotation: N/A; putative formula: C11H5N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.119,"smiles":null,"spectrum_id":"CCMSLIB00017291216","spectrum_index":38797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 158.1063 Da; putative annotation: N/A; putative formula: C7H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017291219","spectrum_index":38798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 247.1792 Da; putative annotation: N/A; putative formula: C13H21N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.27,"smiles":null,"spectrum_id":"CCMSLIB00017291222","spectrum_index":38799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 14.0186 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.107,"smiles":null,"spectrum_id":"CCMSLIB00017291224","spectrum_index":38800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP016603 Indolacetic acid|indole-3-acetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 32.9802 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.051,"smiles":null,"spectrum_id":"CCMSLIB00017291227","spectrum_index":38801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 79.0819 Da; putative annotation: N/A; putative formula: C6H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.142,"smiles":null,"spectrum_id":"CCMSLIB00017291230","spectrum_index":38802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 379.2185 Da; putative annotation: N/A; putative formula: C21H33NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.305,"smiles":null,"spectrum_id":"CCMSLIB00017291232","spectrum_index":38803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Fluorobenzyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 56.0672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.16,"smiles":null,"spectrum_id":"CCMSLIB00017291235","spectrum_index":38804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 909.5801 Da; putative annotation: N/A; putative formula: C54H79N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1090.65,"smiles":null,"spectrum_id":"CCMSLIB00017291238","spectrum_index":38805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.097,"smiles":null,"spectrum_id":"CCMSLIB00017291240","spectrum_index":38806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 398.2712 Da; putative annotation: N/A; putative formula: C22H35N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.41,"smiles":null,"spectrum_id":"CCMSLIB00017291242","spectrum_index":38807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 36.0112 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.092,"smiles":null,"spectrum_id":"CCMSLIB00017291245","spectrum_index":38808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Colchicine (delta mass: 17.0845 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.26,"smiles":null,"spectrum_id":"CCMSLIB00017291248","spectrum_index":38809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Fluorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine (delta mass: 18.0196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.128,"smiles":null,"spectrum_id":"CCMSLIB00017291250","spectrum_index":38810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 166.0784 Da; putative annotation: N/A; putative formula: C13H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.165,"smiles":null,"spectrum_id":"CCMSLIB00017291253","spectrum_index":38811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 90.0796 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.202,"smiles":null,"spectrum_id":"CCMSLIB00017291255","spectrum_index":38812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 409.1591 Da; putative annotation: N/A; putative formula: C19H28N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.24,"smiles":null,"spectrum_id":"CCMSLIB00017291258","spectrum_index":38813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 89.1041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.202,"smiles":null,"spectrum_id":"CCMSLIB00017291261","spectrum_index":38814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 388.1447 Da; putative annotation: N/A; putative formula: C22H29PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.184,"smiles":null,"spectrum_id":"CCMSLIB00017291263","spectrum_index":38815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galanthamine (delta mass: 84.0694 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.229,"smiles":null,"spectrum_id":"CCMSLIB00017291266","spectrum_index":38816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-propanoic acid (delta mass: 288.1717 Da; putative annotation: N/A; putative formula: C12H25N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.258,"smiles":null,"spectrum_id":"CCMSLIB00017291268","spectrum_index":38817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 70.0535 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.14,"smiles":null,"spectrum_id":"CCMSLIB00017291271","spectrum_index":38818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 129.0579 Da; putative annotation: N/A; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017291274","spectrum_index":38819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 465.2416 Da; putative annotation: N/A; putative formula: C30H31N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.312,"smiles":null,"spectrum_id":"CCMSLIB00017291277","spectrum_index":38820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 55.9898 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.055,"smiles":null,"spectrum_id":"CCMSLIB00017291278","spectrum_index":38821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 394.2881 Da; putative annotation: N/A; putative formula: C20H38N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.364,"smiles":null,"spectrum_id":"CCMSLIB00017291281","spectrum_index":38822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01040 Hexahydrocurcumin (delta mass: 179.08 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.26,"smiles":null,"spectrum_id":"CCMSLIB00017291284","spectrum_index":38823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 184.1213 Da; putative annotation: N/A; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.276,"smiles":null,"spectrum_id":"CCMSLIB00017291285","spectrum_index":38824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 449.1237 Da; putative annotation: N/A; putative formula: C24H15N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.198,"smiles":null,"spectrum_id":"CCMSLIB00017291288","spectrum_index":38825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 410.2626 Da; putative annotation: N/A; putative formula: C18H38N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.36,"smiles":null,"spectrum_id":"CCMSLIB00017291291","spectrum_index":38826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 251.0683 Da; putative annotation: N/A; putative formula: C8H18N3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.18,"smiles":null,"spectrum_id":"CCMSLIB00017291294","spectrum_index":38827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 182.1674 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.221,"smiles":null,"spectrum_id":"CCMSLIB00017291297","spectrum_index":38828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 407.1793 Da; putative annotation: N/A; putative formula: C22H27N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.25,"smiles":null,"spectrum_id":"CCMSLIB00017291299","spectrum_index":38829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 290.0905 Da; putative annotation: N/A; putative formula: C16H21O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.177,"smiles":null,"spectrum_id":"CCMSLIB00017291302","spectrum_index":38830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 486.152 Da; putative annotation: N/A; putative formula: C18H30O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.249,"smiles":null,"spectrum_id":"CCMSLIB00017291305","spectrum_index":38831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1097.3651 Da; putative annotation: N/A; putative formula: C79H48N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1260.43,"smiles":null,"spectrum_id":"CCMSLIB00017291307","spectrum_index":38832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 534.3635 Da; putative annotation: N/A; putative formula: C26H54N4O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":789.476,"smiles":null,"spectrum_id":"CCMSLIB00017291310","spectrum_index":38833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-1-yl)propanamide (delta mass: 63.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.144,"smiles":null,"spectrum_id":"CCMSLIB00017291313","spectrum_index":38834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 130.1147 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.357,"smiles":null,"spectrum_id":"CCMSLIB00017291316","spectrum_index":38835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 36.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.101,"smiles":null,"spectrum_id":"CCMSLIB00017291317","spectrum_index":38836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 96.0936 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.331,"smiles":null,"spectrum_id":"CCMSLIB00017291320","spectrum_index":38837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 46.0132 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.126,"smiles":null,"spectrum_id":"CCMSLIB00017291323","spectrum_index":38838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 212.1417 Da; putative annotation: N/A; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.27,"smiles":null,"spectrum_id":"CCMSLIB00017291325","spectrum_index":38839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 164.0462 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.127,"smiles":null,"spectrum_id":"CCMSLIB00017291327","spectrum_index":38840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000498 3-Acetylindole|1-(1H-indol-3-yl)ethanone (delta mass: 117.0791 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017291330","spectrum_index":38841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 396.1259 Da; putative annotation: N/A; putative formula: C4H22N12O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.223,"smiles":null,"spectrum_id":"CCMSLIB00017291333","spectrum_index":38842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine; LC-tDDA; CE10 (delta mass: 334.7628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.86,"smiles":null,"spectrum_id":"CCMSLIB00017291336","spectrum_index":38843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 221.0947 Da; putative annotation: N/A; putative formula: C6H15N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.177,"smiles":null,"spectrum_id":"CCMSLIB00017291337","spectrum_index":38844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 86.0758 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.18,"smiles":null,"spectrum_id":"CCMSLIB00017291340","spectrum_index":38845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 68.2404 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.394,"smiles":null,"spectrum_id":"CCMSLIB00017291342","spectrum_index":38846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 188.0314 Da; putative annotation: N/A; putative formula: C11H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.123,"smiles":null,"spectrum_id":"CCMSLIB00017291344","spectrum_index":38847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 209.0325 Da; putative annotation: N/A; putative formula: C9H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.092,"smiles":null,"spectrum_id":"CCMSLIB00017291347","spectrum_index":38848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 7.0309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.135,"smiles":null,"spectrum_id":"CCMSLIB00017291349","spectrum_index":38849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250806 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 57.44 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017291351","spectrum_index":38850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ACETALDEHYDE (delta mass: 15.9949 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.071,"smiles":null,"spectrum_id":"CCMSLIB00017291354","spectrum_index":38851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 23.8961 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.956,"smiles":null,"spectrum_id":"CCMSLIB00017291356","spectrum_index":38852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 200.1772 Da; putative annotation: N/A; putative formula: C12H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.237,"smiles":null,"spectrum_id":"CCMSLIB00017291358","spectrum_index":38853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 102.0284 Da; putative annotation: N/A; putative formula: H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.13,"smiles":null,"spectrum_id":"CCMSLIB00017291361","spectrum_index":38854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 46.0051 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.107,"smiles":null,"spectrum_id":"CCMSLIB00017291363","spectrum_index":38855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1020.3792 Da; putative annotation: N/A; putative formula: C57H56N4O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1242.48,"smiles":null,"spectrum_id":"CCMSLIB00017291365","spectrum_index":38856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 442.0941 Da; putative annotation: N/A; putative formula: C20H26O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.191,"smiles":null,"spectrum_id":"CCMSLIB00017291368","spectrum_index":38857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gln-Lys (delta mass: 128.0955 Da; putative annotation: N/A; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.31,"smiles":null,"spectrum_id":"CCMSLIB00017291371","spectrum_index":38858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 144.0574 Da; putative annotation: N/A; putative formula: C10H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017291373","spectrum_index":38859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 65.0309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.112,"smiles":null,"spectrum_id":"CCMSLIB00017291376","spectrum_index":38860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 31.9978 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.105,"smiles":null,"spectrum_id":"CCMSLIB00017291378","spectrum_index":38861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 14.0251 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.133,"smiles":null,"spectrum_id":"CCMSLIB00017291381","spectrum_index":38862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 43.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.155,"smiles":null,"spectrum_id":"CCMSLIB00017291384","spectrum_index":38863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 179.0799 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.122,"smiles":null,"spectrum_id":"CCMSLIB00017291386","spectrum_index":38864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNT (delta mass: 186.0529 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.309,"smiles":null,"spectrum_id":"CCMSLIB00017291389","spectrum_index":38865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 481.2358 Da; putative annotation: N/A; putative formula: C21H41NO7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.306,"smiles":null,"spectrum_id":"CCMSLIB00017291391","spectrum_index":38866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 479.2784 Da; putative annotation: N/A; putative formula: C28H37N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.374,"smiles":null,"spectrum_id":"CCMSLIB00017291394","spectrum_index":38867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 38.049 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.177,"smiles":null,"spectrum_id":"CCMSLIB00017291397","spectrum_index":38868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 156.0505 Da; putative annotation: N/A; putative formula: C2H4N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.204,"smiles":null,"spectrum_id":"CCMSLIB00017291398","spectrum_index":38869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C10:0 (delta mass: 104.0625 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.306,"smiles":null,"spectrum_id":"CCMSLIB00017291401","spectrum_index":38870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 74.0269 Da; putative annotation: N/A; putative formula: C5H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.043,"smiles":null,"spectrum_id":"CCMSLIB00017291404","spectrum_index":38871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 845.005 Da; putative annotation: N/A; putative formula: C29H27N5O15S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1229.16,"smiles":null,"spectrum_id":"CCMSLIB00017291405","spectrum_index":38872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 74.0229 Da; putative annotation: N/A; putative formula: H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.134,"smiles":null,"spectrum_id":"CCMSLIB00017291408","spectrum_index":38873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 127.0665 Da; putative annotation: N/A; putative formula: C5H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.153,"smiles":null,"spectrum_id":"CCMSLIB00017291411","spectrum_index":38874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 194.0429 Da; putative annotation: N/A; putative formula: C6H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.123,"smiles":null,"spectrum_id":"CCMSLIB00017291412","spectrum_index":38875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 857.6425 Da; putative annotation: N/A; putative formula: C57H83N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.79,"smiles":null,"spectrum_id":"CCMSLIB00017291415","spectrum_index":38876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 769.5942 Da; putative annotation: N/A; putative formula: C42H75N9O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":958.743,"smiles":null,"spectrum_id":"CCMSLIB00017291418","spectrum_index":38877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 190.1246 Da; putative annotation: N/A; putative formula: C7H18N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.264,"smiles":null,"spectrum_id":"CCMSLIB00017291421","spectrum_index":38878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 116.0999 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.342,"smiles":null,"spectrum_id":"CCMSLIB00017291423","spectrum_index":38879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 106.0782 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.128,"smiles":null,"spectrum_id":"CCMSLIB00017291425","spectrum_index":38880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-MANNOSAMINE (delta mass: 258.224 Da; putative annotation: N/A; putative formula: C13H30N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.311,"smiles":null,"spectrum_id":"CCMSLIB00017291428","spectrum_index":38881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000512 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 227.08 Da; putative annotation: N/A; putative formula: C11H17NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.151,"smiles":null,"spectrum_id":"CCMSLIB00017291431","spectrum_index":38882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 93.0347 Da; putative annotation: N/A; putative formula: C4H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.1,"smiles":null,"spectrum_id":"CCMSLIB00017291432","spectrum_index":38883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 27.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.117,"smiles":null,"spectrum_id":"CCMSLIB00017291435","spectrum_index":38884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-(4-Chlorophenyl)ethyl](methyl)amine (delta mass: 54.0548 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017291438","spectrum_index":38885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 105.0679 Da; putative annotation: N/A; putative formula: C6H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017291440","spectrum_index":38886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 287.1004 Da; putative annotation: N/A; putative formula: C12H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.213,"smiles":null,"spectrum_id":"CCMSLIB00017291442","spectrum_index":38887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 27.0158 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.076,"smiles":null,"spectrum_id":"CCMSLIB00017291445","spectrum_index":38888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 241.24 Da; putative annotation: N/A; putative formula: C15H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.353,"smiles":null,"spectrum_id":"CCMSLIB00017291448","spectrum_index":38889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 13.9341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.956,"smiles":null,"spectrum_id":"CCMSLIB00017291450","spectrum_index":38890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 176.1032 Da; putative annotation: Tetraethylene glycol; putative formula: C8H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.2,"smiles":null,"spectrum_id":"CCMSLIB00017291453","spectrum_index":38891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine CollisionEnergy:102040 (delta mass: 141.0792 Da; putative annotation: N-Acetyl-DL-valine; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.176,"smiles":null,"spectrum_id":"CCMSLIB00017291455","spectrum_index":38892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 146.0363 Da; putative annotation: trans-3-Coumaric acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.117,"smiles":null,"spectrum_id":"CCMSLIB00017291458","spectrum_index":38893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 258.1009 Da; putative annotation: Spectral Match to PyroGlu-Phe from NIST14; putative formula: C14H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.198,"smiles":null,"spectrum_id":"CCMSLIB00017291460","spectrum_index":38894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 206.0722 Da; putative annotation: 4'-Hydroxychalcone CollisionEnergy:205060; putative formula: C15H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.148,"smiles":null,"spectrum_id":"CCMSLIB00017291462","spectrum_index":38895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-fluoro-1H-indazole-3-carboxylate (delta mass: 176.0399 Da; putative annotation: Methyl 6-fluoro-1H-indazole-3-carboxylate; putative formula: C9H5FN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.096,"smiles":null,"spectrum_id":"CCMSLIB00017291465","spectrum_index":38896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381117-01!2-amino-4-hydroxy-5-[[1-(4-methoxy-6-oxopyran-2-yl)-3-methylbutyl]amino]-5-oxopentanoic acid (delta mass: 356.1635 Da; putative annotation: 16.alpha.,17,21-Trihydroxypregna-1,4-diene-3,11,20-trione; putative formula: C21H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.329,"smiles":null,"spectrum_id":"CCMSLIB00017291467","spectrum_index":38897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 122.0371 Da; putative annotation: Ethyl maltol - 40.0 eV; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.108,"smiles":null,"spectrum_id":"CCMSLIB00017291469","spectrum_index":38898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380167-01!3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015] (delta mass: 162.0678 Da; putative annotation: 4-Hydroxy-3-methoxyphenylacetone; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.222,"smiles":null,"spectrum_id":"CCMSLIB00017291472","spectrum_index":38899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 162.0679 Da; putative annotation: 4-Hydroxy-3-(2-hydroxyethyl)acetophenone; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.123,"smiles":null,"spectrum_id":"CCMSLIB00017291474","spectrum_index":38900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 122.0368 Da; putative annotation: 3,5-Dihydroxybenzenemethanol; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017291476","spectrum_index":38901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 60.0362 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.149,"smiles":null,"spectrum_id":"CCMSLIB00017291479","spectrum_index":38902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 113.0955 Da; putative annotation: N/A; putative formula: C5H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.266,"smiles":null,"spectrum_id":"CCMSLIB00017291481","spectrum_index":38903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 126.0467 Da; putative annotation: N/A; putative formula: C10H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.17,"smiles":null,"spectrum_id":"CCMSLIB00017291483","spectrum_index":38904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 35.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.212,"smiles":null,"spectrum_id":"CCMSLIB00017291486","spectrum_index":38905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 97.0411 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017291489","spectrum_index":38906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-C4:0 (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017291492","spectrum_index":38907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Desthiobiotin (delta mass: 118.0305 Da; putative annotation: N/A; putative formula: C2H6N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.169,"smiles":null,"spectrum_id":"CCMSLIB00017291493","spectrum_index":38908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 29.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.118,"smiles":null,"spectrum_id":"CCMSLIB00017291496","spectrum_index":38909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 528.3139 Da; putative annotation: N/A; putative formula: C37H40N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.462,"smiles":null,"spectrum_id":"CCMSLIB00017291497","spectrum_index":38910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 83.0364 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.117,"smiles":null,"spectrum_id":"CCMSLIB00017291500","spectrum_index":38911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 346.3247 Da; putative annotation: N/A; putative formula: C24H42O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.458,"smiles":null,"spectrum_id":"CCMSLIB00017291503","spectrum_index":38912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 149.1054 Da; putative annotation: N/A; putative formula: C7H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.171,"smiles":null,"spectrum_id":"CCMSLIB00017291504","spectrum_index":38913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNITOL - 20.0 eV (delta mass: 40.9021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.988,"smiles":null,"spectrum_id":"CCMSLIB00017291507","spectrum_index":38914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match] (delta mass: 123.0077 Da; putative annotation: N/A; putative formula: C4HN3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.276,"smiles":null,"spectrum_id":"CCMSLIB00017291510","spectrum_index":38915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 176.0414 Da; putative annotation: N/A; putative formula: C2N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.165,"smiles":null,"spectrum_id":"CCMSLIB00017291511","spectrum_index":38916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 18.0586 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.124,"smiles":null,"spectrum_id":"CCMSLIB00017291514","spectrum_index":38917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-serine (delta mass: 97.0155 Da; putative annotation: N/A; putative formula: C4H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.081,"smiles":null,"spectrum_id":"CCMSLIB00017291517","spectrum_index":38918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 283.3066 Da; putative annotation: N/A; putative formula: C16H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.352,"smiles":null,"spectrum_id":"CCMSLIB00017291519","spectrum_index":38919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084606 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 86.0577 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.112,"smiles":null,"spectrum_id":"CCMSLIB00017291522","spectrum_index":38920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroquinidine (delta mass: 237.1523 Da; putative annotation: N/A; putative formula: C17H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.359,"smiles":null,"spectrum_id":"CCMSLIB00017291524","spectrum_index":38921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 59.0484 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.182,"smiles":null,"spectrum_id":"CCMSLIB00017291527","spectrum_index":38922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 102.0251 Da; putative annotation: N/A; putative formula: C3H6N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.164,"smiles":null,"spectrum_id":"CCMSLIB00017291530","spectrum_index":38923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 135.0858 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.239,"smiles":null,"spectrum_id":"CCMSLIB00017291532","spectrum_index":38924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 72.9967 Da; putative annotation: N/A; putative formula: C5H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.088,"smiles":null,"spectrum_id":"CCMSLIB00017291535","spectrum_index":38925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 208.2187 Da; putative annotation: N/A; putative formula: C15H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.31,"smiles":null,"spectrum_id":"CCMSLIB00017291538","spectrum_index":38926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 16.1884 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.311,"smiles":null,"spectrum_id":"CCMSLIB00017291539","spectrum_index":38927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 293.1468 Da; putative annotation: N/A; putative formula: C16H25NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.323,"smiles":null,"spectrum_id":"CCMSLIB00017291542","spectrum_index":38928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 166.1016 Da; putative annotation: N/A; putative formula: C9H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.207,"smiles":null,"spectrum_id":"CCMSLIB00017291545","spectrum_index":38929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 158.0213 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.108,"smiles":null,"spectrum_id":"CCMSLIB00017291547","spectrum_index":38930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 184.0684 Da; putative annotation: N/A; putative formula: C8H14N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.17,"smiles":null,"spectrum_id":"CCMSLIB00017291549","spectrum_index":38931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 425.4803 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.561,"smiles":null,"spectrum_id":"CCMSLIB00017291552","spectrum_index":38932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 74.0732 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.133,"smiles":null,"spectrum_id":"CCMSLIB00017291555","spectrum_index":38933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 315.2781 Da; putative annotation: N/A; putative formula: C19H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.343,"smiles":null,"spectrum_id":"CCMSLIB00017291558","spectrum_index":38934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 336.153 Da; putative annotation: N/A; putative formula: C13H24N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.213,"smiles":null,"spectrum_id":"CCMSLIB00017291561","spectrum_index":38935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 314.8279 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.914,"smiles":null,"spectrum_id":"CCMSLIB00017291563","spectrum_index":38936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 667.2475 Da; putative annotation: N/A; putative formula: C31H41NO15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.334,"smiles":null,"spectrum_id":"CCMSLIB00017291565","spectrum_index":38937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haloperidol (delta mass: 17.0126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.16,"smiles":null,"spectrum_id":"CCMSLIB00017291568","spectrum_index":38938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 237.9881 Da; putative annotation: N/A; putative formula: C6H7O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.137,"smiles":null,"spectrum_id":"CCMSLIB00017291571","spectrum_index":38939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of FENOLDOPAM MESYLATE (delta mass: 67.9984 Da; putative annotation: N/A; putative formula: C2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.087,"smiles":null,"spectrum_id":"CCMSLIB00017291574","spectrum_index":38940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Thienyl)-1H-imidazole (delta mass: 46.0852 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.118,"smiles":null,"spectrum_id":"CCMSLIB00017291577","spectrum_index":38941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 90.1673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.244,"smiles":null,"spectrum_id":"CCMSLIB00017291578","spectrum_index":38942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-oxido-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl)methyl 2,3-dihydroxy-3-methylpentanoate (delta mass: 18.0097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.19,"smiles":null,"spectrum_id":"CCMSLIB00017291581","spectrum_index":38943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 135.0813 Da; putative annotation: N/A; putative formula: C7H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.168,"smiles":null,"spectrum_id":"CCMSLIB00017291584","spectrum_index":38944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one (delta mass: 103.0241 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.106,"smiles":null,"spectrum_id":"CCMSLIB00017291587","spectrum_index":38945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N.alpha.-Acetyl-L-lysine (delta mass: 180.1151 Da; putative annotation: N/A; putative formula: C11H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.238,"smiles":null,"spectrum_id":"CCMSLIB00017291590","spectrum_index":38946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 32.0271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.124,"smiles":null,"spectrum_id":"CCMSLIB00017291593","spectrum_index":38947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 146.0567 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.205,"smiles":null,"spectrum_id":"CCMSLIB00017291595","spectrum_index":38948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltryptamine (delta mass: 15.0008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.124,"smiles":null,"spectrum_id":"CCMSLIB00017291598","spectrum_index":38949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 98.1094 Da; putative annotation: N/A; putative formula: C7H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.169,"smiles":null,"spectrum_id":"CCMSLIB00017291600","spectrum_index":38950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 927.684 Da; putative annotation: N/A; putative formula: C52H97NO10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1116.83,"smiles":null,"spectrum_id":"CCMSLIB00017291603","spectrum_index":38951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 883.6575 Da; putative annotation: N/A; putative formula: C51H97NO4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1072.81,"smiles":null,"spectrum_id":"CCMSLIB00017291606","spectrum_index":38952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 44.026 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.102,"smiles":null,"spectrum_id":"CCMSLIB00017291609","spectrum_index":38953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 180.0462 Da; putative annotation: N/A; putative formula: C6H12O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.18,"smiles":null,"spectrum_id":"CCMSLIB00017291612","spectrum_index":38954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 42.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.16,"smiles":null,"spectrum_id":"CCMSLIB00017291614","spectrum_index":38955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 214.128 Da; putative annotation: N/A; putative formula: C15H19O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.329,"smiles":null,"spectrum_id":"CCMSLIB00017291617","spectrum_index":38956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.15,"smiles":null,"spectrum_id":"CCMSLIB00017291620","spectrum_index":38957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 88.0158 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.144,"smiles":null,"spectrum_id":"CCMSLIB00017291623","spectrum_index":38958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 6.0444 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.087,"smiles":null,"spectrum_id":"CCMSLIB00017291626","spectrum_index":38959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 67.019 Da; putative annotation: N/A; putative formula: C2HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.131,"smiles":null,"spectrum_id":"CCMSLIB00017291629","spectrum_index":38960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 79.9573 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.028,"smiles":null,"spectrum_id":"CCMSLIB00017291631","spectrum_index":38961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 665.2373 Da; putative annotation: N/A; putative formula: C35H23N17O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1008.36,"smiles":null,"spectrum_id":"CCMSLIB00017291634","spectrum_index":38962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 799.3293 Da; putative annotation: N/A; putative formula: C47H49N3O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":962.389,"smiles":null,"spectrum_id":"CCMSLIB00017291637","spectrum_index":38963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 291.0968 Da; putative annotation: N/A; putative formula: C11H17NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.22,"smiles":null,"spectrum_id":"CCMSLIB00017291640","spectrum_index":38964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 146.0361 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.101,"smiles":null,"spectrum_id":"CCMSLIB00017291643","spectrum_index":38965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(benzimidazol-2-ylthiomethyl)-4-methoxybenzaldehyde CollisionEnergy:102040 (delta mass: 18.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.101,"smiles":null,"spectrum_id":"CCMSLIB00017291645","spectrum_index":38966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C5:0 (delta mass: 114.068 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.212,"smiles":null,"spectrum_id":"CCMSLIB00017291648","spectrum_index":38967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000216 Roquefortine C|Roquefortine|2H-Pyrazino(1',2':1,5)pyrrolo(2,3-b)indole-1,4(3H,5aH)-dione, 10b-(1,1-dimethyl-2-propenyl)-6,10b,11,11a-tetrahydro-3-(1H-imidazol-4-ylmethylene)- (delta mass: 290.1142 Da; putative annotation: N/A; putative formula: C10H19N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.307,"smiles":null,"spectrum_id":"CCMSLIB00017291651","spectrum_index":38968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 17.0603 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.197,"smiles":null,"spectrum_id":"CCMSLIB00017291654","spectrum_index":38969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087703 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 64.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017291656","spectrum_index":38970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.16,"smiles":null,"spectrum_id":"CCMSLIB00017291659","spectrum_index":38971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 647.6302 Da; putative annotation: N/A; putative formula: C37H77N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.702,"smiles":null,"spectrum_id":"CCMSLIB00017291662","spectrum_index":38972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 86.1526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.248,"smiles":null,"spectrum_id":"CCMSLIB00017291665","spectrum_index":38973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 256.1356 Da; putative annotation: N/A; putative formula: C11H20N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.295,"smiles":null,"spectrum_id":"CCMSLIB00017291667","spectrum_index":38974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline (delta mass: 121.0836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.144,"smiles":null,"spectrum_id":"CCMSLIB00017291670","spectrum_index":38975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 116.0984 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.325,"smiles":null,"spectrum_id":"CCMSLIB00017291673","spectrum_index":38976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 159.085 Da; putative annotation: N/A; putative formula: C3H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.165,"smiles":null,"spectrum_id":"CCMSLIB00017291676","spectrum_index":38977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 150.0778 Da; putative annotation: N/A; putative formula: C4H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.128,"smiles":null,"spectrum_id":"CCMSLIB00017291679","spectrum_index":38978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 32.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.098,"smiles":null,"spectrum_id":"CCMSLIB00017291681","spectrum_index":38979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 106.0531 Da; putative annotation: N/A; putative formula: C6H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.124,"smiles":null,"spectrum_id":"CCMSLIB00017291684","spectrum_index":38980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 61.0081 Da; putative annotation: N/A; putative formula: CH4NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.089,"smiles":null,"spectrum_id":"CCMSLIB00017291687","spectrum_index":38981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 24.9957 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.056,"smiles":null,"spectrum_id":"CCMSLIB00017291689","spectrum_index":38982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 68.0274 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.094,"smiles":null,"spectrum_id":"CCMSLIB00017291692","spectrum_index":38983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 18.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.085,"smiles":null,"spectrum_id":"CCMSLIB00017291695","spectrum_index":38984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 112.0634 Da; putative annotation: N/A; putative formula: C5H8N2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017291698","spectrum_index":38985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 116.0814 Da; putative annotation: N/A; putative formula: C2H8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.23,"smiles":null,"spectrum_id":"CCMSLIB00017291701","spectrum_index":38986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 193.5754 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.698,"smiles":null,"spectrum_id":"CCMSLIB00017291704","spectrum_index":38987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 62.0523 Da; putative annotation: N/A; putative formula: C6H6O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.107,"smiles":null,"spectrum_id":"CCMSLIB00017291706","spectrum_index":38988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 45.023 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.083,"smiles":null,"spectrum_id":"CCMSLIB00017291708","spectrum_index":38989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.16,"smiles":null,"spectrum_id":"CCMSLIB00017291711","spectrum_index":38990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 50.0145 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.116,"smiles":null,"spectrum_id":"CCMSLIB00017291714","spectrum_index":38991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 137.1564 Da; putative annotation: N/A; putative formula: C10H19NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.279,"smiles":null,"spectrum_id":"CCMSLIB00017291717","spectrum_index":38992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.133,"smiles":null,"spectrum_id":"CCMSLIB00017291720","spectrum_index":38993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 152.0952 Da; putative annotation: N/A; putative formula: C8H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.171,"smiles":null,"spectrum_id":"CCMSLIB00017291722","spectrum_index":38994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-5-fluoropentanoic acid (delta mass: 39.0099 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.087,"smiles":null,"spectrum_id":"CCMSLIB00017291725","spectrum_index":38995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-nitro-1H-indole-2-carboxylate (delta mass: 96.9867 Da; putative annotation: N/A; putative formula: CH-1N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.042,"smiles":null,"spectrum_id":"CCMSLIB00017291728","spectrum_index":38996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 485.6672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.791,"smiles":null,"spectrum_id":"CCMSLIB00017291731","spectrum_index":38997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 367.2171 Da; putative annotation: N/A; putative formula: C16H31N7O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.341,"smiles":null,"spectrum_id":"CCMSLIB00017291733","spectrum_index":38998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE - 70.0 eV (delta mass: 85.9987 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.101,"smiles":null,"spectrum_id":"CCMSLIB00017291736","spectrum_index":38999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 260.2171 Da; putative annotation: N/A; putative formula: C11H28N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.366,"smiles":null,"spectrum_id":"CCMSLIB00017291738","spectrum_index":39000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 198.161 Da; putative annotation: N/A; putative formula: C12H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.263,"smiles":null,"spectrum_id":"CCMSLIB00017291741","spectrum_index":39001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 36.0215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.317,"smiles":null,"spectrum_id":"CCMSLIB00017291744","spectrum_index":39002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 73.0378 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.133,"smiles":null,"spectrum_id":"CCMSLIB00017291747","spectrum_index":39003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 151.0688 Da; putative annotation: N/A; putative formula: C2H9N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.207,"smiles":null,"spectrum_id":"CCMSLIB00017291748","spectrum_index":39004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 569.3055 Da; putative annotation: N/A; putative formula: C26H43N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.376,"smiles":null,"spectrum_id":"CCMSLIB00017291751","spectrum_index":39005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 98.0125 Da; putative annotation: N/A; putative formula: C3H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.125,"smiles":null,"spectrum_id":"CCMSLIB00017291754","spectrum_index":39006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one [IIN-based: Match] (delta mass: 162.0499 Da; putative annotation: N/A; putative formula: C2H6N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.152,"smiles":null,"spectrum_id":"CCMSLIB00017291757","spectrum_index":39007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 114.0436 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.198,"smiles":null,"spectrum_id":"CCMSLIB00017291759","spectrum_index":39008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 200.1356 Da; putative annotation: N/A; putative formula: C10H20N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.211,"smiles":null,"spectrum_id":"CCMSLIB00017291762","spectrum_index":39009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 100.0636 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.144,"smiles":null,"spectrum_id":"CCMSLIB00017291765","spectrum_index":39010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 224.0153 Da; putative annotation: N/A; putative formula: C11H12O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.052,"smiles":null,"spectrum_id":"CCMSLIB00017291767","spectrum_index":39011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 411.1374 Da; putative annotation: N/A; putative formula: C28H17N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.198,"smiles":null,"spectrum_id":"CCMSLIB00017291769","spectrum_index":39012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydro-6-hydroxy-.alpha.,2,5,7,8-pentamethyl-2H-1-benzopyran-2-pentanoic acid (delta mass: 358.1774 Da; putative annotation: N/A; putative formula: C15H27N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.383,"smiles":null,"spectrum_id":"CCMSLIB00017291772","spectrum_index":39013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-1H-indole-2-carboxamide (delta mass: 113.0927 Da; putative annotation: N/A; putative formula: C5H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.211,"smiles":null,"spectrum_id":"CCMSLIB00017291775","spectrum_index":39014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 388.1559 Da; putative annotation: N/A; putative formula: C18H28O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.247,"smiles":null,"spectrum_id":"CCMSLIB00017291777","spectrum_index":39015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 2.9944 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.967,"smiles":null,"spectrum_id":"CCMSLIB00017291780","spectrum_index":39016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 2.0358 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.131,"smiles":null,"spectrum_id":"CCMSLIB00017291782","spectrum_index":39017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 129.0543 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.141,"smiles":null,"spectrum_id":"CCMSLIB00017291785","spectrum_index":39018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 182.1435 Da; putative annotation: N/A; putative formula: C10H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.323,"smiles":null,"spectrum_id":"CCMSLIB00017291788","spectrum_index":39019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 572.3357 Da; putative annotation: N/A; putative formula: C26H48N6O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.417,"smiles":null,"spectrum_id":"CCMSLIB00017291789","spectrum_index":39020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 22.9731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.107,"smiles":null,"spectrum_id":"CCMSLIB00017291792","spectrum_index":39021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 40.0 eV (delta mass: 72.0212 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.097,"smiles":null,"spectrum_id":"CCMSLIB00017291795","spectrum_index":39022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 53.0641 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.135,"smiles":null,"spectrum_id":"CCMSLIB00017291798","spectrum_index":39023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 284.0318 Da; putative annotation: N/A; putative formula: C15H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.16,"smiles":null,"spectrum_id":"CCMSLIB00017291801","spectrum_index":39024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 112.0306 Da; putative annotation: N/A; putative formula: C3H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.159,"smiles":null,"spectrum_id":"CCMSLIB00017291802","spectrum_index":39025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoferulic acid CollisionEnergy:102040 (delta mass: 144.1268 Da; putative annotation: N/A; putative formula: C7H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.192,"smiles":null,"spectrum_id":"CCMSLIB00017291805","spectrum_index":39026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 91.0422 Da; putative annotation: N/A; putative formula: C6H5N)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017291808","spectrum_index":39027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdesmethoxycurcumin (delta mass: 56.0797 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.192,"smiles":null,"spectrum_id":"CCMSLIB00017291811","spectrum_index":39028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 50.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017291812","spectrum_index":39029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 217.1132 Da; putative annotation: N/A; putative formula: C12H16N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.231,"smiles":null,"spectrum_id":"CCMSLIB00017291815","spectrum_index":39030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 596.2558 Da; putative annotation: N/A; putative formula: C32H40N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":751.326,"smiles":null,"spectrum_id":"CCMSLIB00017291818","spectrum_index":39031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 81.0101 Da; putative annotation: N/A; putative formula: CH-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017291821","spectrum_index":39032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 301.2787 Da; putative annotation: N/A; putative formula: C21H35N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.344,"smiles":null,"spectrum_id":"CCMSLIB00017291822","spectrum_index":39033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethyl L-glutamate (delta mass: 436.3246 Da; putative annotation: N/A; putative formula: C24H46N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.448,"smiles":null,"spectrum_id":"CCMSLIB00017291825","spectrum_index":39034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 27.9777 Da; putative annotation: N/A; putative formula: CO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.048,"smiles":null,"spectrum_id":"CCMSLIB00017291828","spectrum_index":39035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 74.0913 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.17,"smiles":null,"spectrum_id":"CCMSLIB00017291831","spectrum_index":39036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 318.2715 Da; putative annotation: N/A; putative formula: C25H34O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.441,"smiles":null,"spectrum_id":"CCMSLIB00017291833","spectrum_index":39037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 292.2395 Da; putative annotation: N/A; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.363,"smiles":null,"spectrum_id":"CCMSLIB00017291836","spectrum_index":39038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 250.2297 Da; putative annotation: N/A; putative formula: C17H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.3,"smiles":null,"spectrum_id":"CCMSLIB00017291839","spectrum_index":39039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 186.216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.311,"smiles":null,"spectrum_id":"CCMSLIB00017291842","spectrum_index":39040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 685.4262 Da; putative annotation: N/A; putative formula: C33H59N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.497,"smiles":null,"spectrum_id":"CCMSLIB00017291844","spectrum_index":39041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 270.1739 Da; putative annotation: N/A; putative formula: C17H22N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.324,"smiles":null,"spectrum_id":"CCMSLIB00017291847","spectrum_index":39042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-O-.beta.-Galactopyranosyl-D-mannopyranose from NIST14 (delta mass: 312.2675 Da; putative annotation: N/A; putative formula: C19H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.391,"smiles":null,"spectrum_id":"CCMSLIB00017291850","spectrum_index":39043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 196.1476 Da; putative annotation: N/A; putative formula: C12H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.234,"smiles":null,"spectrum_id":"CCMSLIB00017291852","spectrum_index":39044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ365701 Cimaterol|2-amino-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile (delta mass: 142.1248 Da; putative annotation: N/A; putative formula: C9H19O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.269,"smiles":null,"spectrum_id":"CCMSLIB00017291855","spectrum_index":39045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.144,"smiles":null,"spectrum_id":"CCMSLIB00017291858","spectrum_index":39046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 384.1268 Da; putative annotation: N/A; putative formula: C14H24O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.208,"smiles":null,"spectrum_id":"CCMSLIB00017291861","spectrum_index":39047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 406.1467 Da; putative annotation: N/A; putative formula: C30H18N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.228,"smiles":null,"spectrum_id":"CCMSLIB00017291864","spectrum_index":39048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 28.0788 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.144,"smiles":null,"spectrum_id":"CCMSLIB00017291865","spectrum_index":39049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 216.1154 Da; putative annotation: N/A; putative formula: C14H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017291868","spectrum_index":39050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Thr (delta mass: 576.1758 Da; putative annotation: N/A; putative formula: C39H28O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":811.268,"smiles":null,"spectrum_id":"CCMSLIB00017291871","spectrum_index":39051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 128.0493 Da; putative annotation: N/A; putative formula: C7H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.17,"smiles":null,"spectrum_id":"CCMSLIB00017291874","spectrum_index":39052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,2R)-2-(Aminocarbonyl)cyclohexanecarboxylic acid (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.113,"smiles":null,"spectrum_id":"CCMSLIB00017291876","spectrum_index":39053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 402.0802 Da; putative annotation: N/A; putative formula: C19H19N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.214,"smiles":null,"spectrum_id":"CCMSLIB00017291878","spectrum_index":39054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 179.8875 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.958,"smiles":null,"spectrum_id":"CCMSLIB00017291881","spectrum_index":39055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 19.0287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.1,"smiles":null,"spectrum_id":"CCMSLIB00017291884","spectrum_index":39056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 184.0483 Da; putative annotation: N/A; putative formula: C7H8N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.129,"smiles":null,"spectrum_id":"CCMSLIB00017291887","spectrum_index":39057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 433.3774 Da; putative annotation: N/A; putative formula: C25H47N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.526,"smiles":null,"spectrum_id":"CCMSLIB00017291890","spectrum_index":39058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 46.0093 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.061,"smiles":null,"spectrum_id":"CCMSLIB00017291893","spectrum_index":39059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017291894","spectrum_index":39060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 314.1141 Da; putative annotation: N/A; putative formula: C15H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.279,"smiles":null,"spectrum_id":"CCMSLIB00017291898","spectrum_index":39061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 8.9881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.121,"smiles":null,"spectrum_id":"CCMSLIB00017291900","spectrum_index":39062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 144.0432 Da; putative annotation: N/A; putative formula: C7H12O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.197,"smiles":null,"spectrum_id":"CCMSLIB00017291903","spectrum_index":39063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CREATININE (delta mass: 85.9225 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.989,"smiles":null,"spectrum_id":"CCMSLIB00017291906","spectrum_index":39064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 18.0168 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.065,"smiles":null,"spectrum_id":"CCMSLIB00017291909","spectrum_index":39065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-(3,4-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 89.0152 Da; putative annotation: N/A; putative formula: CH4N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.138,"smiles":null,"spectrum_id":"CCMSLIB00017291910","spectrum_index":39066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 40.0 eV (delta mass: 90.0833 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017291914","spectrum_index":39067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 108.0943 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.17,"smiles":null,"spectrum_id":"CCMSLIB00017291916","spectrum_index":39068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 17.9081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.062,"smiles":null,"spectrum_id":"CCMSLIB00017291919","spectrum_index":39069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-(4-Chlorophenyl)ethyl](methyl)amine (delta mass: 72.0303 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.103,"smiles":null,"spectrum_id":"CCMSLIB00017291922","spectrum_index":39070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 46.0296 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.132,"smiles":null,"spectrum_id":"CCMSLIB00017291925","spectrum_index":39071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 240.0632 Da; putative annotation: N/A; putative formula: C11H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.123,"smiles":null,"spectrum_id":"CCMSLIB00017291926","spectrum_index":39072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 19.9245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.005,"smiles":null,"spectrum_id":"CCMSLIB00017291929","spectrum_index":39073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 129.0903 Da; putative annotation: N/A; putative formula: C5H11N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.161,"smiles":null,"spectrum_id":"CCMSLIB00017291932","spectrum_index":39074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 240.4403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.5,"smiles":null,"spectrum_id":"CCMSLIB00017291935","spectrum_index":39075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 198.3063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.387,"smiles":null,"spectrum_id":"CCMSLIB00017291938","spectrum_index":39076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; CorrDec (delta mass: 26.9998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":113.06,"smiles":null,"spectrum_id":"CCMSLIB00017291941","spectrum_index":39077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 389.1364 Da; putative annotation: N/A; putative formula: C24H24NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.198,"smiles":null,"spectrum_id":"CCMSLIB00017291943","spectrum_index":39078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 565.2336 Da; putative annotation: N/A; putative formula: C22H40N5O8PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.305,"smiles":null,"spectrum_id":"CCMSLIB00017291947","spectrum_index":39079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 298.1211 Da; putative annotation: N/A; putative formula: C10H24N2O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.181,"smiles":null,"spectrum_id":"CCMSLIB00017291948","spectrum_index":39080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 234.1472 Da; putative annotation: N/A; putative formula: C11H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.228,"smiles":null,"spectrum_id":"CCMSLIB00017291951","spectrum_index":39081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 313.1887 Da; putative annotation: N/A; putative formula: C16H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.249,"smiles":null,"spectrum_id":"CCMSLIB00017291954","spectrum_index":39082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 269.0405 Da; putative annotation: Mordant orange 1; putative formula: C13H7N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.111,"smiles":null,"spectrum_id":"CCMSLIB00017291957","spectrum_index":39083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 226.1607 Da; putative annotation: 1,11-Undecanedicarboxylic acid; putative formula: C13H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017291958","spectrum_index":39084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Pro (delta mass: 99.0689 Da; putative annotation: N-Methyl-.alpha.-aminoisobutyric acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.208,"smiles":null,"spectrum_id":"CCMSLIB00017291961","spectrum_index":39085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 190.0173 Da; putative annotation: [5-(2-Chlorophenyl)-2-furyl]methanol; putative formula: C11H7ClO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.056,"smiles":null,"spectrum_id":"CCMSLIB00017291964","spectrum_index":39086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of phenylethanolamine - 40.0 eV (delta mass: 176.0472 Da; putative annotation: 2,5-Dihydroxycinnamic acid methyl ester; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.138,"smiles":null,"spectrum_id":"CCMSLIB00017291967","spectrum_index":39087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 306.219 Da; putative annotation: allo-Protolichesterinic acid; putative formula: C19H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.279,"smiles":null,"spectrum_id":"CCMSLIB00017291968","spectrum_index":39088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 233.0888 Da; putative annotation: Muramic acid; putative formula: C9H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.149,"smiles":null,"spectrum_id":"CCMSLIB00017291971","spectrum_index":39089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 63.0559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.127,"smiles":null,"spectrum_id":"CCMSLIB00017291974","spectrum_index":39090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 618.3029 Da; putative annotation: N/A; putative formula: C38H42N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.395,"smiles":null,"spectrum_id":"CCMSLIB00017291977","spectrum_index":39091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 584.1897 Da; putative annotation: N/A; putative formula: C25H29N8O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":867.359,"smiles":null,"spectrum_id":"CCMSLIB00017291980","spectrum_index":39092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 620.295 Da; putative annotation: N/A; putative formula: C24H44N8O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.375,"smiles":null,"spectrum_id":"CCMSLIB00017291982","spectrum_index":39093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 68.0374 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.14,"smiles":null,"spectrum_id":"CCMSLIB00017291985","spectrum_index":39094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethanone, 1-[1-(4-hydroxypentyl)-1H-indol-3-yl]-2-(2-methoxyphenyl)- (delta mass: 14.0218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.212,"smiles":null,"spectrum_id":"CCMSLIB00017291988","spectrum_index":39095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 127.062 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.206,"smiles":null,"spectrum_id":"CCMSLIB00017291991","spectrum_index":39096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 41.0279 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.141,"smiles":null,"spectrum_id":"CCMSLIB00017291993","spectrum_index":39097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 320.1991 Da; putative annotation: N/A; putative formula: C19H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.27,"smiles":null,"spectrum_id":"CCMSLIB00017291996","spectrum_index":39098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 706.3565 Da; putative annotation: N/A; putative formula: C37H54O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.443,"smiles":null,"spectrum_id":"CCMSLIB00017291999","spectrum_index":39099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 126.0504 Da; putative annotation: N/A; putative formula: C7H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.137,"smiles":null,"spectrum_id":"CCMSLIB00017292002","spectrum_index":39100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2,2,6,6-tetramethyl-4-[3-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]butyl]cyclohex-4-ene-1,3-dione (delta mass: 232.1496 Da; putative annotation: N/A; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.387,"smiles":null,"spectrum_id":"CCMSLIB00017292004","spectrum_index":39101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 318.1642 Da; putative annotation: N/A; putative formula: C8H14N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.224,"smiles":null,"spectrum_id":"CCMSLIB00017292007","spectrum_index":39102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 239.1996 Da; putative annotation: N/A; putative formula: C13H25N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.281,"smiles":null,"spectrum_id":"CCMSLIB00017292010","spectrum_index":39103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diaveridine (delta mass: 168.0158 Da; putative annotation: N/A; putative formula: C8H9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.15,"smiles":null,"spectrum_id":"CCMSLIB00017292012","spectrum_index":39104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 128.0627 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.185,"smiles":null,"spectrum_id":"CCMSLIB00017292015","spectrum_index":39105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 56.0303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017292018","spectrum_index":39106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 202.0238 Da; putative annotation: N/A; putative formula: C7H2N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.095,"smiles":null,"spectrum_id":"CCMSLIB00017292021","spectrum_index":39107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 46.0202 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.132,"smiles":null,"spectrum_id":"CCMSLIB00017292024","spectrum_index":39108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 128.0684 Da; putative annotation: N/A; putative formula: H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.212,"smiles":null,"spectrum_id":"CCMSLIB00017292027","spectrum_index":39109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-O-Methylvisamminol (delta mass: 180.0634 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.186,"smiles":null,"spectrum_id":"CCMSLIB00017292029","spectrum_index":39110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 96.1735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.211,"smiles":null,"spectrum_id":"CCMSLIB00017292031","spectrum_index":39111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 155.0648 Da; putative annotation: N/A; putative formula: C5H9N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.081,"smiles":null,"spectrum_id":"CCMSLIB00017292034","spectrum_index":39112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 114.1045 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.186,"smiles":null,"spectrum_id":"CCMSLIB00017292037","spectrum_index":39113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 87.0313 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.144,"smiles":null,"spectrum_id":"CCMSLIB00017292040","spectrum_index":39114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 27.0448 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.157,"smiles":null,"spectrum_id":"CCMSLIB00017292041","spectrum_index":39115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 197.0994 Da; putative annotation: N/A; putative formula: C9H15N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.181,"smiles":null,"spectrum_id":"CCMSLIB00017292044","spectrum_index":39116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 15.1311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.207,"smiles":null,"spectrum_id":"CCMSLIB00017292047","spectrum_index":39117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 69.0333 Da; putative annotation: N/A; putative formula: C2H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.12,"smiles":null,"spectrum_id":"CCMSLIB00017292048","spectrum_index":39118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mahanimbine (delta mass: 408.278 Da; putative annotation: N/A; putative formula: C26H36N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.479,"smiles":null,"spectrum_id":"CCMSLIB00017292051","spectrum_index":39119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol (delta mass: 323.1368 Da; putative annotation: N/A; putative formula: C16H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.27,"smiles":null,"spectrum_id":"CCMSLIB00017292054","spectrum_index":39120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 127.0989 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.159,"smiles":null,"spectrum_id":"CCMSLIB00017292057","spectrum_index":39121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 122.036 Da; putative annotation: N/A; putative formula: CH7N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.133,"smiles":null,"spectrum_id":"CCMSLIB00017292060","spectrum_index":39122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine; LC-tDDA; CE10 (delta mass: 227.1516 Da; putative annotation: N/A; putative formula: C12H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.249,"smiles":null,"spectrum_id":"CCMSLIB00017292061","spectrum_index":39123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 73.0526 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.123,"smiles":null,"spectrum_id":"CCMSLIB00017292064","spectrum_index":39124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 252.0416 Da; putative annotation: N/A; putative formula: C7H12N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.17,"smiles":null,"spectrum_id":"CCMSLIB00017292067","spectrum_index":39125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 143.0571 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.185,"smiles":null,"spectrum_id":"CCMSLIB00017292070","spectrum_index":39126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYLTRYPTAMINE - 20.0 eV (delta mass: 143.0906 Da; putative annotation: N/A; putative formula: C3H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.214,"smiles":null,"spectrum_id":"CCMSLIB00017292071","spectrum_index":39127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 145.0464 Da; putative annotation: N/A; putative formula: H3N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.174,"smiles":null,"spectrum_id":"CCMSLIB00017292074","spectrum_index":39128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 45.0246 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.113,"smiles":null,"spectrum_id":"CCMSLIB00017292077","spectrum_index":39129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00160238-01!RIBALININE (delta mass: 84.0581 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.186,"smiles":null,"spectrum_id":"CCMSLIB00017292080","spectrum_index":39130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 46.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.176,"smiles":null,"spectrum_id":"CCMSLIB00017292081","spectrum_index":39131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazole (delta mass: 44.0254 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":113.07,"smiles":null,"spectrum_id":"CCMSLIB00017292084","spectrum_index":39132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((Dimethylamino)methyl)phenol (delta mass: 25.0027 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.11,"smiles":null,"spectrum_id":"CCMSLIB00017292087","spectrum_index":39133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 130.0782 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017292089","spectrum_index":39134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 677.5054 Da; putative annotation: N/A; putative formula: C40H71NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":858.576,"smiles":null,"spectrum_id":"CCMSLIB00017292091","spectrum_index":39135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 570.1372 Da; putative annotation: N/A; putative formula: C23H31N4O7PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.176,"smiles":null,"spectrum_id":"CCMSLIB00017292094","spectrum_index":39136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 537.3391 Da; putative annotation: N/A; putative formula: C32H47N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.409,"smiles":null,"spectrum_id":"CCMSLIB00017292097","spectrum_index":39137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine HCl (delta mass: 111.0199 Da; putative annotation: N/A; putative formula: C2HN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.106,"smiles":null,"spectrum_id":"CCMSLIB00017292100","spectrum_index":39138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 111.0181 Da; putative annotation: N/A; putative formula: C2HN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.11,"smiles":null,"spectrum_id":"CCMSLIB00017292103","spectrum_index":39139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 29.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017292106","spectrum_index":39140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-6-ol, 1-(4-methoxyphenyl)-2-methyl-3-nitro- (delta mass: 260.1326 Da; putative annotation: N/A; putative formula: C16H21OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.235,"smiles":null,"spectrum_id":"CCMSLIB00017292108","spectrum_index":39141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 56.1296 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.211,"smiles":null,"spectrum_id":"CCMSLIB00017292110","spectrum_index":39142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 563.9205 Da; putative annotation: N/A; putative formula: C3H9N4O27P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.991,"smiles":null,"spectrum_id":"CCMSLIB00017292113","spectrum_index":39143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 321.1203 Da; putative annotation: N/A; putative formula: C10H20N5O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.228,"smiles":null,"spectrum_id":"CCMSLIB00017292116","spectrum_index":39144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ITOPRIDE HCl (delta mass: 112.1335 Da; putative annotation: N/A; putative formula: C7H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.33,"smiles":null,"spectrum_id":"CCMSLIB00017292119","spectrum_index":39145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 347.9668 Da; putative annotation: N/A; putative formula: C10H4N8OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.048,"smiles":null,"spectrum_id":"CCMSLIB00017292120","spectrum_index":39146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 13.9499 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.991,"smiles":null,"spectrum_id":"CCMSLIB00017292123","spectrum_index":39147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 45.0134 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.11,"smiles":null,"spectrum_id":"CCMSLIB00017292127","spectrum_index":39148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 152.0924 Da; putative annotation: N/A; putative formula: C4H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.17,"smiles":null,"spectrum_id":"CCMSLIB00017292129","spectrum_index":39149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 10.9892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.07,"smiles":null,"spectrum_id":"CCMSLIB00017292132","spectrum_index":39150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methanesulfonamide, N-[3-(9H-carbazol-9-yl)-2-hydroxypropyl]-N-(2-furanylmethyl)- (delta mass: 43.9964 Da; putative annotation: N/A; putative formula: HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.134,"smiles":null,"spectrum_id":"CCMSLIB00017292135","spectrum_index":39151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 163.0975 Da; putative annotation: N/A; putative formula: C6H9N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.147,"smiles":null,"spectrum_id":"CCMSLIB00017292138","spectrum_index":39152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of curcumin CollisionEnergy:102040 (delta mass: 202.1728 Da; putative annotation: N/A; putative formula: C15H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.306,"smiles":null,"spectrum_id":"CCMSLIB00017292140","spectrum_index":39153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 46.0005 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.196,"smiles":null,"spectrum_id":"CCMSLIB00017292143","spectrum_index":39154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 483.9402 Da; putative annotation: N/A; putative formula: C3H8N12O9S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.099,"smiles":null,"spectrum_id":"CCMSLIB00017292146","spectrum_index":39155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 68.0214 Da; putative annotation: N/A; putative formula: N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.061,"smiles":null,"spectrum_id":"CCMSLIB00017292149","spectrum_index":39156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 273.0999 Da; putative annotation: N/A; putative formula: C15H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.223,"smiles":null,"spectrum_id":"CCMSLIB00017292152","spectrum_index":39157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindoleacetic acid; AIF; CE10; MS2Dec (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.076,"smiles":null,"spectrum_id":"CCMSLIB00017292155","spectrum_index":39158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 58.0365 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.16,"smiles":null,"spectrum_id":"CCMSLIB00017292158","spectrum_index":39159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 178.0992 Da; putative annotation: N/A; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.163,"smiles":null,"spectrum_id":"CCMSLIB00017292160","spectrum_index":39160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 130.0998 Da; putative annotation: N/A; putative formula: C7H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.243,"smiles":null,"spectrum_id":"CCMSLIB00017292163","spectrum_index":39161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-2-Dodecen-1-ol (delta mass: 41.0267 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.217,"smiles":null,"spectrum_id":"CCMSLIB00017292166","spectrum_index":39162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanylleucine (delta mass: 71.0375 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.177,"smiles":null,"spectrum_id":"CCMSLIB00017292169","spectrum_index":39163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 199.9612 Da; putative annotation: N/A; putative formula: C7H6OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.138,"smiles":null,"spectrum_id":"CCMSLIB00017292172","spectrum_index":39164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 366.0205 Da; putative annotation: N/A; putative formula: C11H16N2O6P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.16,"smiles":null,"spectrum_id":"CCMSLIB00017292174","spectrum_index":39165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Valine, N-[[1-(5-fluoropentyl)-1H-indazol-3-yl]carbonyl]-, methyl ester (delta mass: 120.0362 Da; putative annotation: N/A; putative formula: C11H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.239,"smiles":null,"spectrum_id":"CCMSLIB00017292177","spectrum_index":39166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Lys (delta mass: 44.0249 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.212,"smiles":null,"spectrum_id":"CCMSLIB00017292180","spectrum_index":39167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 372.2036 Da; putative annotation: N/A; putative formula: C25H28N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.274,"smiles":null,"spectrum_id":"CCMSLIB00017292182","spectrum_index":39168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 162.1096 Da; putative annotation: N/A; putative formula: CH10N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.263,"smiles":null,"spectrum_id":"CCMSLIB00017292185","spectrum_index":39169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 106.0311 Da; putative annotation: N/A; putative formula: CH6N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.081,"smiles":null,"spectrum_id":"CCMSLIB00017292188","spectrum_index":39170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 34.0197 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.111,"smiles":null,"spectrum_id":"CCMSLIB00017292191","spectrum_index":39171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 114.0283 Da; putative annotation: N/A; putative formula: CH2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.109,"smiles":null,"spectrum_id":"CCMSLIB00017292193","spectrum_index":39172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 14.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017292196","spectrum_index":39173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Bis(3-hydroxyphenyl)pteridine-2,4-diamine (delta mass: 35.0242 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.149,"smiles":null,"spectrum_id":"CCMSLIB00017292199","spectrum_index":39174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017292202","spectrum_index":39175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 75.9683 Da; putative annotation: N/A; putative formula: CHO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.107,"smiles":null,"spectrum_id":"CCMSLIB00017292204","spectrum_index":39176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 68.1829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.155,"smiles":null,"spectrum_id":"CCMSLIB00017292207","spectrum_index":39177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 300.217 Da; putative annotation: N/A; putative formula: C15H24N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.314,"smiles":null,"spectrum_id":"CCMSLIB00017292210","spectrum_index":39178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 154.0613 Da; putative annotation: N/A; putative formula: C4H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.121,"smiles":null,"spectrum_id":"CCMSLIB00017292212","spectrum_index":39179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 140.058 Da; putative annotation: N/A; putative formula: C6H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.155,"smiles":null,"spectrum_id":"CCMSLIB00017292215","spectrum_index":39180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 42.0288 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.23,"smiles":null,"spectrum_id":"CCMSLIB00017292218","spectrum_index":39181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 134.0376 Da; putative annotation: N/A; putative formula: C8H6O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.129,"smiles":null,"spectrum_id":"CCMSLIB00017292221","spectrum_index":39182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 47.0138 Da; putative annotation: N/A; putative formula: C4HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.085,"smiles":null,"spectrum_id":"CCMSLIB00017292223","spectrum_index":39183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 236.1384 Da; putative annotation: N/A; putative formula: C10H16N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.287,"smiles":null,"spectrum_id":"CCMSLIB00017292225","spectrum_index":39184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSAMINE (delta mass: 54.0106 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.097,"smiles":null,"spectrum_id":"CCMSLIB00017292228","spectrum_index":39185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.113,"smiles":null,"spectrum_id":"CCMSLIB00017292231","spectrum_index":39186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 222.1261 Da; putative annotation: N/A; putative formula: C13H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.207,"smiles":null,"spectrum_id":"CCMSLIB00017292234","spectrum_index":39187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of levodopa CollisionEnergy:102040 (delta mass: 83.0372 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.113,"smiles":null,"spectrum_id":"CCMSLIB00017292235","spectrum_index":39188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 138.0321 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.165,"smiles":null,"spectrum_id":"CCMSLIB00017292238","spectrum_index":39189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 283.0935 Da; putative annotation: N/A; putative formula: C8H18N3O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.232,"smiles":null,"spectrum_id":"CCMSLIB00017292243","spectrum_index":39190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 153.0462 Da; putative annotation: N/A; putative formula: C6H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.08,"smiles":null,"spectrum_id":"CCMSLIB00017292244","spectrum_index":39191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 160.0522 Da; putative annotation: N/A; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.149,"smiles":null,"spectrum_id":"CCMSLIB00017292247","spectrum_index":39192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.097,"smiles":null,"spectrum_id":"CCMSLIB00017292250","spectrum_index":39193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:102040 (delta mass: 129.1044 Da; putative annotation: N/A; putative formula: C7H16NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017292253","spectrum_index":39194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 326.0434 Da; putative annotation: N/A; putative formula: C10H10N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.167,"smiles":null,"spectrum_id":"CCMSLIB00017292255","spectrum_index":39195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (1-hydroxycyclohexyl)acetate (delta mass: 62.0471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.18,"smiles":null,"spectrum_id":"CCMSLIB00017292258","spectrum_index":39196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 327.1181 Da; putative annotation: N/A; putative formula: C12H17N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.197,"smiles":null,"spectrum_id":"CCMSLIB00017292260","spectrum_index":39197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 166.9963 Da; putative annotation: N/A; putative formula: C7H6NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.265,"smiles":null,"spectrum_id":"CCMSLIB00017292263","spectrum_index":39198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 194.9932 Da; putative annotation: N/A; putative formula: C4H6NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.058,"smiles":null,"spectrum_id":"CCMSLIB00017292266","spectrum_index":39199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 237.1721 Da; putative annotation: N/A; putative formula: C14H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.259,"smiles":null,"spectrum_id":"CCMSLIB00017292269","spectrum_index":39200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 247.0843 Da; putative annotation: N/A; putative formula: C13H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.171,"smiles":null,"spectrum_id":"CCMSLIB00017292271","spectrum_index":39201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 450.2094 Da; putative annotation: N/A; putative formula: C33H26N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.311,"smiles":null,"spectrum_id":"CCMSLIB00017292273","spectrum_index":39202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 208.1095 Da; putative annotation: N/A; putative formula: C12H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.201,"smiles":null,"spectrum_id":"CCMSLIB00017292276","spectrum_index":39203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 108.0419 Da; putative annotation: N/A; putative formula: C4H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017292279","spectrum_index":39204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 22.0055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017292282","spectrum_index":39205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 237.1581 Da; putative annotation: N/A; putative formula: C11H19N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.27,"smiles":null,"spectrum_id":"CCMSLIB00017292285","spectrum_index":39206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 320.2818 Da; putative annotation: N/A; putative formula: C20H36N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.347,"smiles":null,"spectrum_id":"CCMSLIB00017292288","spectrum_index":39207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 152.1928 Da; putative annotation: N/A; putative formula: C12H24O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.284,"smiles":null,"spectrum_id":"CCMSLIB00017292290","spectrum_index":39208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 92.0387 Da; putative annotation: N/A; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.114,"smiles":null,"spectrum_id":"CCMSLIB00017292293","spectrum_index":39209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 106.03 Da; putative annotation: N/A; putative formula: C2H7N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.09,"smiles":null,"spectrum_id":"CCMSLIB00017292295","spectrum_index":39210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 307.1203 Da; putative annotation: N/A; putative formula: C11H21N3O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.207,"smiles":null,"spectrum_id":"CCMSLIB00017292298","spectrum_index":39211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 899.3074 Da; putative annotation: N/A; putative formula: C63H49NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1566.54,"smiles":null,"spectrum_id":"CCMSLIB00017292301","spectrum_index":39212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 543.2165 Da; putative annotation: N/A; putative formula: C26H35N5O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.339,"smiles":null,"spectrum_id":"CCMSLIB00017292304","spectrum_index":39213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 409.3651 Da; putative annotation: N/A; putative formula: C20H43N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.457,"smiles":null,"spectrum_id":"CCMSLIB00017292305","spectrum_index":39214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 64.0165 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.202,"smiles":null,"spectrum_id":"CCMSLIB00017292308","spectrum_index":39215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 142.0981 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.221,"smiles":null,"spectrum_id":"CCMSLIB00017292311","spectrum_index":39216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 145.0821 Da; putative annotation: N/A; putative formula: C5H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.18,"smiles":null,"spectrum_id":"CCMSLIB00017292314","spectrum_index":39217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 933.676 Da; putative annotation: N/A; putative formula: C51H91N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1317.83,"smiles":null,"spectrum_id":"CCMSLIB00017292315","spectrum_index":39218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 102.1044 Da; putative annotation: N/A; putative formula: C2H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.191,"smiles":null,"spectrum_id":"CCMSLIB00017292320","spectrum_index":39219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 32.0222 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.134,"smiles":null,"spectrum_id":"CCMSLIB00017292321","spectrum_index":39220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 290.1579 Da; putative annotation: N/A; putative formula: C13H27N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.197,"smiles":null,"spectrum_id":"CCMSLIB00017292324","spectrum_index":39221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1260.6156 Da; putative annotation: N/A; putative formula: C62H92N4O23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1453.69,"smiles":null,"spectrum_id":"CCMSLIB00017292327","spectrum_index":39222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 91.9994 Da; putative annotation: N/A; putative formula: C4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.138,"smiles":null,"spectrum_id":"CCMSLIB00017292330","spectrum_index":39223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 81.0305 Da; putative annotation: N/A; putative formula: C3H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.127,"smiles":null,"spectrum_id":"CCMSLIB00017292332","spectrum_index":39224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 15.0142 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.09,"smiles":null,"spectrum_id":"CCMSLIB00017292334","spectrum_index":39225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 535.8246 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.911,"smiles":null,"spectrum_id":"CCMSLIB00017292337","spectrum_index":39226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 247.1218 Da; putative annotation: N/A; putative formula: C15H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.203,"smiles":null,"spectrum_id":"CCMSLIB00017292340","spectrum_index":39227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 661.4869 Da; putative annotation: N/A; putative formula: C39H63N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.521,"smiles":null,"spectrum_id":"CCMSLIB00017292343","spectrum_index":39228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Venalstonine (delta mass: 31.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.222,"smiles":null,"spectrum_id":"CCMSLIB00017292346","spectrum_index":39229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 326.1029 Da; putative annotation: N/A; putative formula: C17H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.251,"smiles":null,"spectrum_id":"CCMSLIB00017292348","spectrum_index":39230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 130.2173 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.298,"smiles":null,"spectrum_id":"CCMSLIB00017292350","spectrum_index":39231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 155.8602 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.936,"smiles":null,"spectrum_id":"CCMSLIB00017292353","spectrum_index":39232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT211470 D-Glucuronic acid|Glucuronate|Glucosiduronic Acid|D-Glucopyranuronic acid|(2S,3S,4S,5R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid (delta mass: 118.0801 Da; putative annotation: N/A; putative formula: C9H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.13,"smiles":null,"spectrum_id":"CCMSLIB00017292357","spectrum_index":39233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine (delta mass: 60.0588 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.147,"smiles":null,"spectrum_id":"CCMSLIB00017292359","spectrum_index":39234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 223.1327 Da; putative annotation: N/A; putative formula: C11H17N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.22,"smiles":null,"spectrum_id":"CCMSLIB00017292362","spectrum_index":39235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 379.1586 Da; putative annotation: N/A; putative formula: C16H30NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.271,"smiles":null,"spectrum_id":"CCMSLIB00017292365","spectrum_index":39236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 230.0429 Da; putative annotation: N/A; putative formula: C12H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.114,"smiles":null,"spectrum_id":"CCMSLIB00017292368","spectrum_index":39237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 240.0666 Da; putative annotation: N/A; putative formula: C8H16O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.106,"smiles":null,"spectrum_id":"CCMSLIB00017292371","spectrum_index":39238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1,N1-dimethyl-N2-phenyl-1,2-ethanediamine (delta mass: 333.2055 Da; putative annotation: N/A; putative formula: C18H27N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.344,"smiles":null,"spectrum_id":"CCMSLIB00017292373","spectrum_index":39239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 73.0163 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.103,"smiles":null,"spectrum_id":"CCMSLIB00017292375","spectrum_index":39240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 193.085 Da; putative annotation: N/A; putative formula: C9H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.151,"smiles":null,"spectrum_id":"CCMSLIB00017292378","spectrum_index":39241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP022901 D-Sorbitol|Sorbo|(3S,4S,5R)-hexane-1,2,3,4,5,6-hexol (delta mass: 149.0096 Da; putative annotation: N/A; putative formula: CH4N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.096,"smiles":null,"spectrum_id":"CCMSLIB00017292381","spectrum_index":39242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 140.0988 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017292384","spectrum_index":39243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 88.0157 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.128,"smiles":null,"spectrum_id":"CCMSLIB00017292386","spectrum_index":39244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 90.0828 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.127,"smiles":null,"spectrum_id":"CCMSLIB00017292388","spectrum_index":39245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 154.0614 Da; putative annotation: N/A; putative formula: C4H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.137,"smiles":null,"spectrum_id":"CCMSLIB00017292391","spectrum_index":39246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Difluoromethoxy)-1H-indole-2-carboxylic acid (delta mass: 84.0661 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.113,"smiles":null,"spectrum_id":"CCMSLIB00017292394","spectrum_index":39247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 175.1213 Da; putative annotation: N/A; putative formula: C8H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.17,"smiles":null,"spectrum_id":"CCMSLIB00017292397","spectrum_index":39248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 165.0785 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.175,"smiles":null,"spectrum_id":"CCMSLIB00017292400","spectrum_index":39249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 162.0571 Da; putative annotation: N/A; putative formula: C4H10N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.096,"smiles":null,"spectrum_id":"CCMSLIB00017292401","spectrum_index":39250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroergotamine (delta mass: 18.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.307,"smiles":null,"spectrum_id":"CCMSLIB00017292404","spectrum_index":39251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.07,"smiles":null,"spectrum_id":"CCMSLIB00017292407","spectrum_index":39252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 8.0001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.035,"smiles":null,"spectrum_id":"CCMSLIB00017292410","spectrum_index":39253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 40.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.117,"smiles":null,"spectrum_id":"CCMSLIB00017292411","spectrum_index":39254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 85.0887 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.185,"smiles":null,"spectrum_id":"CCMSLIB00017292414","spectrum_index":39255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 150.2137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.3,"smiles":null,"spectrum_id":"CCMSLIB00017292417","spectrum_index":39256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 40.0296 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.152,"smiles":null,"spectrum_id":"CCMSLIB00017292419","spectrum_index":39257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 22.9795 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.118,"smiles":null,"spectrum_id":"CCMSLIB00017292422","spectrum_index":39258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 190.0119 Da; putative annotation: N/A; putative formula: C9H7N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.08,"smiles":null,"spectrum_id":"CCMSLIB00017292424","spectrum_index":39259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 10.0209 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.207,"smiles":null,"spectrum_id":"CCMSLIB00017292427","spectrum_index":39260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.139,"smiles":null,"spectrum_id":"CCMSLIB00017292430","spectrum_index":39261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 375.1866 Da; putative annotation: N/A; putative formula: C23H26N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.267,"smiles":null,"spectrum_id":"CCMSLIB00017292433","spectrum_index":39262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 113.059 Da; putative annotation: N/A; putative formula: C4H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.192,"smiles":null,"spectrum_id":"CCMSLIB00017292436","spectrum_index":39263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 375.2626 Da; putative annotation: N/A; putative formula: C20H41NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.323,"smiles":null,"spectrum_id":"CCMSLIB00017292439","spectrum_index":39264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 329.1475 Da; putative annotation: N/A; putative formula: C15H23NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.228,"smiles":null,"spectrum_id":"CCMSLIB00017292441","spectrum_index":39265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 64.0472 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017292444","spectrum_index":39266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 70.0 eV (delta mass: 44.0651 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.156,"smiles":null,"spectrum_id":"CCMSLIB00017292447","spectrum_index":39267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 166.2219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.319,"smiles":null,"spectrum_id":"CCMSLIB00017292450","spectrum_index":39268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 178.1755 Da; putative annotation: N/A; putative formula: C13H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.262,"smiles":null,"spectrum_id":"CCMSLIB00017292452","spectrum_index":39269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isochromophilone IV (delta mass: 17.0328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.195,"smiles":null,"spectrum_id":"CCMSLIB00017292455","spectrum_index":39270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Leu from NIST14 (delta mass: 113.0847 Da; putative annotation: LEUCINE - 70.00 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.234,"smiles":null,"spectrum_id":"CCMSLIB00017292458","spectrum_index":39271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 205.0958 Da; putative annotation: N-Acetyl-D-galactosaminitol; putative formula: C8H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.219,"smiles":null,"spectrum_id":"CCMSLIB00017292460","spectrum_index":39272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 216.1154 Da; putative annotation: Massbank:NA001152 Pterosin G|(S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-1H-inden-1-one|(2S)-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-2,3-dihydroinden-1-one; putative formula: C14H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017292463","spectrum_index":39273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 316.2403 Da; putative annotation: 3-Hexadec-15-en-7-ynyl-4-hydroxy-5-methyloxolan-2-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.311,"smiles":null,"spectrum_id":"CCMSLIB00017292466","spectrum_index":39274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxy-3-[(9-methyl-6-oxohydropurin-8-ylthio)methyl]benzaldehyde CollisionEnergy:102040 (delta mass: 208.0697 Da; putative annotation: Genipin; putative formula: C11H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.156,"smiles":null,"spectrum_id":"CCMSLIB00017292468","spectrum_index":39275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 174.0528 Da; putative annotation: Quinic Acid; putative formula: C7H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.119,"smiles":null,"spectrum_id":"CCMSLIB00017292471","spectrum_index":39276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 244.1093 Da; putative annotation: 1-Dehydroperuvinine; putative formula: C15H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.18,"smiles":null,"spectrum_id":"CCMSLIB00017292473","spectrum_index":39277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 195.046 Da; putative annotation: N-(2,4-Difluorophenyl)-3-oxobutanamide; putative formula: C10H7F2NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.117,"smiles":null,"spectrum_id":"CCMSLIB00017292476","spectrum_index":39278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 368.3423 Da; putative annotation: Spectral Match to Cholesterol from NIST14; putative formula: C27H44)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.44,"smiles":null,"spectrum_id":"CCMSLIB00017292479","spectrum_index":39279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 250.2302 Da; putative annotation: cis-9,10-methylene-hexadecanoic acid; putative formula: C17H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.301,"smiles":null,"spectrum_id":"CCMSLIB00017292482","spectrum_index":39280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 145.0749 Da; putative annotation: 1-Deoxynojirimycin; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.213,"smiles":null,"spectrum_id":"CCMSLIB00017292485","spectrum_index":39281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 328.1059 Da; putative annotation: N/A; putative formula: C17H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.182,"smiles":null,"spectrum_id":"CCMSLIB00017292486","spectrum_index":39282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 16.0743 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.155,"smiles":null,"spectrum_id":"CCMSLIB00017292489","spectrum_index":39283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 22.0437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.197,"smiles":null,"spectrum_id":"CCMSLIB00017292492","spectrum_index":39284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 250.0956 Da; putative annotation: N/A; putative formula: C12H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.203,"smiles":null,"spectrum_id":"CCMSLIB00017292494","spectrum_index":39285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 192.141 Da; putative annotation: N/A; putative formula: C13H21O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.28,"smiles":null,"spectrum_id":"CCMSLIB00017292497","spectrum_index":39286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 36.0559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.121,"smiles":null,"spectrum_id":"CCMSLIB00017292499","spectrum_index":39287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 92.0621 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.133,"smiles":null,"spectrum_id":"CCMSLIB00017292502","spectrum_index":39288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 323.0888 Da; putative annotation: N/A; putative formula: C12H25NOP4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.175,"smiles":null,"spectrum_id":"CCMSLIB00017292505","spectrum_index":39289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 156.1496 Da; putative annotation: N/A; putative formula: C6H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.209,"smiles":null,"spectrum_id":"CCMSLIB00017292508","spectrum_index":39290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 117.0426 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.17,"smiles":null,"spectrum_id":"CCMSLIB00017292511","spectrum_index":39291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 259.1784 Da; putative annotation: N/A; putative formula: C13H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.249,"smiles":null,"spectrum_id":"CCMSLIB00017292512","spectrum_index":39292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-isoleucine (delta mass: 111.0323 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.129,"smiles":null,"spectrum_id":"CCMSLIB00017292515","spectrum_index":39293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380682-01_C13H18O8_ (delta mass: 50.0156 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.123,"smiles":null,"spectrum_id":"CCMSLIB00017292518","spectrum_index":39294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 469.1358 Da; putative annotation: N/A; putative formula: C21H15N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.206,"smiles":null,"spectrum_id":"CCMSLIB00017292520","spectrum_index":39295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 109.1771 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.31,"smiles":null,"spectrum_id":"CCMSLIB00017292522","spectrum_index":39296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 250.1193 Da; putative annotation: N/A; putative formula: C14H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.19,"smiles":null,"spectrum_id":"CCMSLIB00017292525","spectrum_index":39297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 391.3278 Da; putative annotation: N/A; putative formula: C25H45NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.398,"smiles":null,"spectrum_id":"CCMSLIB00017292528","spectrum_index":39298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 143.0986 Da; putative annotation: N/A; putative formula: C6H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.179,"smiles":null,"spectrum_id":"CCMSLIB00017292530","spectrum_index":39299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Arabinose (delta mass: 20.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.096,"smiles":null,"spectrum_id":"CCMSLIB00017292532","spectrum_index":39300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 28.9901 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.071,"smiles":null,"spectrum_id":"CCMSLIB00017292535","spectrum_index":39301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 793.2095 Da; putative annotation: N/A; putative formula: C30H39N11O9S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":956.27,"smiles":null,"spectrum_id":"CCMSLIB00017292538","spectrum_index":39302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 71.0001 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.103,"smiles":null,"spectrum_id":"CCMSLIB00017292541","spectrum_index":39303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 298.6716 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.758,"smiles":null,"spectrum_id":"CCMSLIB00017292542","spectrum_index":39304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 212.1088 Da; putative annotation: N/A; putative formula: C12H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.19,"smiles":null,"spectrum_id":"CCMSLIB00017292546","spectrum_index":39305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01040 Hexahydrocurcumin (delta mass: 46.1157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.296,"smiles":null,"spectrum_id":"CCMSLIB00017292548","spectrum_index":39306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 27.0474 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.113,"smiles":null,"spectrum_id":"CCMSLIB00017292551","spectrum_index":39307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 85.042 Da; putative annotation: N/A; putative formula: C4H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.118,"smiles":null,"spectrum_id":"CCMSLIB00017292554","spectrum_index":39308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 750.296 Da; putative annotation: N/A; putative formula: C34H46N4O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":995.391,"smiles":null,"spectrum_id":"CCMSLIB00017292555","spectrum_index":39309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 147.0326 Da; putative annotation: N/A; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.114,"smiles":null,"spectrum_id":"CCMSLIB00017292558","spectrum_index":39310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 705.5377 Da; putative annotation: N/A; putative formula: C35H67N11O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.686,"smiles":null,"spectrum_id":"CCMSLIB00017292561","spectrum_index":39311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 1015.7365 Da; putative annotation: N/A; putative formula: C49H97N11O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1204.89,"smiles":null,"spectrum_id":"CCMSLIB00017292564","spectrum_index":39312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 169.0737 Da; putative annotation: N/A; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.129,"smiles":null,"spectrum_id":"CCMSLIB00017292565","spectrum_index":39313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetanilide (delta mass: 48.0049 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.081,"smiles":null,"spectrum_id":"CCMSLIB00017292568","spectrum_index":39314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 16.0385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.172,"smiles":null,"spectrum_id":"CCMSLIB00017292571","spectrum_index":39315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 25.082 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.168,"smiles":null,"spectrum_id":"CCMSLIB00017292574","spectrum_index":39316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 38.0789 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.218,"smiles":null,"spectrum_id":"CCMSLIB00017292577","spectrum_index":39317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 87.0504 Da; putative annotation: N/A; putative formula: C4H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.148,"smiles":null,"spectrum_id":"CCMSLIB00017292579","spectrum_index":39318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510508 Tyramine|4-(2-aminoethyl)phenol (delta mass: 127.0209 Da; putative annotation: N/A; putative formula: C4H5N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.112,"smiles":null,"spectrum_id":"CCMSLIB00017292581","spectrum_index":39319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 50.0523 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.123,"smiles":null,"spectrum_id":"CCMSLIB00017292584","spectrum_index":39320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 156.0561 Da; putative annotation: N/A; putative formula: C5H9N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.137,"smiles":null,"spectrum_id":"CCMSLIB00017292587","spectrum_index":39321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (1S,15S,17S)-17-[(1S)-1-hydroxyethyl]-3,13-diazapentacyclo[13.3.1.0,?.0?,?.0,?]nonadeca-2(10),4,6,8-tetraene-1-carboxylate (delta mass: 30.0105 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.212,"smiles":null,"spectrum_id":"CCMSLIB00017292590","spectrum_index":39322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 323.2285 Da; putative annotation: N/A; putative formula: C19H33NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.377,"smiles":null,"spectrum_id":"CCMSLIB00017292592","spectrum_index":39323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 17.0655 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.23,"smiles":null,"spectrum_id":"CCMSLIB00017292594","spectrum_index":39324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN - 30.0 eV (delta mass: 47.0054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.101,"smiles":null,"spectrum_id":"CCMSLIB00017292597","spectrum_index":39325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE10; MS2Dec (delta mass: 241.0588 Da; putative annotation: N/A; putative formula: C10H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.14,"smiles":null,"spectrum_id":"CCMSLIB00017292600","spectrum_index":39326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(2-methylindol-3-yl)ethyl](4-methylphenyl)carboxamide CollisionEnergy:102040 (delta mass: 117.0731 Da; putative annotation: N/A; putative formula: C4H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.238,"smiles":null,"spectrum_id":"CCMSLIB00017292603","spectrum_index":39327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 120.0784 Da; putative annotation: N/A; putative formula: C6H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017292606","spectrum_index":39328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 276.1719 Da; putative annotation: N/A; putative formula: C11H25N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.253,"smiles":null,"spectrum_id":"CCMSLIB00017292608","spectrum_index":39329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 136.0617 Da; putative annotation: N/A; putative formula: C3H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.122,"smiles":null,"spectrum_id":"CCMSLIB00017292610","spectrum_index":39330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyltyramine (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.128,"smiles":null,"spectrum_id":"CCMSLIB00017292613","spectrum_index":39331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 309.3015 Da; putative annotation: N/A; putative formula: C16H35N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.414,"smiles":null,"spectrum_id":"CCMSLIB00017292616","spectrum_index":39332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.185,"smiles":null,"spectrum_id":"CCMSLIB00017292619","spectrum_index":39333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 56.0588 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.155,"smiles":null,"spectrum_id":"CCMSLIB00017292621","spectrum_index":39334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT106523 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole|2-(4-methyl-1,3-thiazol-5-yl)ethanol (delta mass: 29.0743 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.122,"smiles":null,"spectrum_id":"CCMSLIB00017292623","spectrum_index":39335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 76.0242 Da; putative annotation: N/A; putative formula: CH4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.075,"smiles":null,"spectrum_id":"CCMSLIB00017292626","spectrum_index":39336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 102.0313 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017292628","spectrum_index":39337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 719.4608 Da; putative annotation: N/A; putative formula: C40H65NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.531,"smiles":null,"spectrum_id":"CCMSLIB00017292631","spectrum_index":39338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 202.095 Da; putative annotation: N/A; putative formula: C8H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.15,"smiles":null,"spectrum_id":"CCMSLIB00017292634","spectrum_index":39339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-BUTYRIC ACID (delta mass: 104.0837 Da; putative annotation: N/A; putative formula: CH8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.186,"smiles":null,"spectrum_id":"CCMSLIB00017292636","spectrum_index":39340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385769-01!4-[3,5-dihydroxy-7-(4-hydroxyphenyl)heptyl]benzene-1,2-diol (delta mass: 226.113 Da; putative annotation: N/A; putative formula: C12H19O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.283,"smiles":null,"spectrum_id":"CCMSLIB00017292639","spectrum_index":39341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 57.0213 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.092,"smiles":null,"spectrum_id":"CCMSLIB00017292642","spectrum_index":39342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 32.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.138,"smiles":null,"spectrum_id":"CCMSLIB00017292644","spectrum_index":39343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CHEMBL358188 CollisionEnergy:102040 (delta mass: 64.0169 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.156,"smiles":null,"spectrum_id":"CCMSLIB00017292647","spectrum_index":39344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 92.0481 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.207,"smiles":null,"spectrum_id":"CCMSLIB00017292649","spectrum_index":39345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 72.0361 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.122,"smiles":null,"spectrum_id":"CCMSLIB00017292652","spectrum_index":39346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 41.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.07,"smiles":null,"spectrum_id":"CCMSLIB00017292655","spectrum_index":39347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 211.0702 Da; putative annotation: N/A; putative formula: C7H9N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.224,"smiles":null,"spectrum_id":"CCMSLIB00017292657","spectrum_index":39348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 50.0487 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.323,"smiles":null,"spectrum_id":"CCMSLIB00017292660","spectrum_index":39349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311011 Feruloyl allylamine (delta mass: 193.0738 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.186,"smiles":null,"spectrum_id":"CCMSLIB00017292662","spectrum_index":39350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Pyrimidinecarboxylic acid (delta mass: 2.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.05,"smiles":null,"spectrum_id":"CCMSLIB00017292665","spectrum_index":39351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(benzimidazol-2-ylthiomethyl)-4-methoxybenzaldehyde CollisionEnergy:102040 (delta mass: 533.1562 Da; putative annotation: N/A; putative formula: C35H23N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.241,"smiles":null,"spectrum_id":"CCMSLIB00017292667","spectrum_index":39352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 46.057 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.148,"smiles":null,"spectrum_id":"CCMSLIB00017292670","spectrum_index":39353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 392.1118 Da; putative annotation: N/A; putative formula: C30H17O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.198,"smiles":null,"spectrum_id":"CCMSLIB00017292673","spectrum_index":39354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 14.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017292675","spectrum_index":39355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 194.0947 Da; putative annotation: N/A; putative formula: C11H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.238,"smiles":null,"spectrum_id":"CCMSLIB00017292677","spectrum_index":39356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 369.2668 Da; putative annotation: N/A; putative formula: C24H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.364,"smiles":null,"spectrum_id":"CCMSLIB00017292680","spectrum_index":39357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 142.0745 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.145,"smiles":null,"spectrum_id":"CCMSLIB00017292683","spectrum_index":39358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 645.2505 Da; putative annotation: N/A; putative formula: C37H36N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.321,"smiles":null,"spectrum_id":"CCMSLIB00017292684","spectrum_index":39359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 36.0215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.191,"smiles":null,"spectrum_id":"CCMSLIB00017292689","spectrum_index":39360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 54.0475 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.338,"smiles":null,"spectrum_id":"CCMSLIB00017292690","spectrum_index":39361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 391.2186 Da; putative annotation: N/A; putative formula: C15H33N7OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.289,"smiles":null,"spectrum_id":"CCMSLIB00017292693","spectrum_index":39362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 168.1522 Da; putative annotation: N/A; putative formula: C11H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.26,"smiles":null,"spectrum_id":"CCMSLIB00017292694","spectrum_index":39363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 326.217 Da; putative annotation: N/A; putative formula: C22H31P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.345,"smiles":null,"spectrum_id":"CCMSLIB00017292697","spectrum_index":39364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 299.1571 Da; putative annotation: N/A; putative formula: C16H21N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.253,"smiles":null,"spectrum_id":"CCMSLIB00017292700","spectrum_index":39365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 198.1951 Da; putative annotation: N/A; putative formula: C9H22N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.375,"smiles":null,"spectrum_id":"CCMSLIB00017292703","spectrum_index":39366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 97.0887 Da; putative annotation: N/A; putative formula: C6H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.17,"smiles":null,"spectrum_id":"CCMSLIB00017292704","spectrum_index":39367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 176.1141 Da; putative annotation: N/A; putative formula: C7H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.211,"smiles":null,"spectrum_id":"CCMSLIB00017292707","spectrum_index":39368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norhydrocodone (delta mass: 62.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.202,"smiles":null,"spectrum_id":"CCMSLIB00017292710","spectrum_index":39369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 1072.5504 Da; putative annotation: N/A; putative formula: C45H87N8O15P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1253.62,"smiles":null,"spectrum_id":"CCMSLIB00017292712","spectrum_index":39370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Met-C5:0 (delta mass: 90.0234 Da; putative annotation: N/A; putative formula: C3H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.139,"smiles":null,"spectrum_id":"CCMSLIB00017292714","spectrum_index":39371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 79.9525 Da; putative annotation: N/A; putative formula: H3O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.028,"smiles":null,"spectrum_id":"CCMSLIB00017292717","spectrum_index":39372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 177.1 Da; putative annotation: N/A; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.249,"smiles":null,"spectrum_id":"CCMSLIB00017292719","spectrum_index":39373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 158.1307 Da; putative annotation: N/A; putative formula: C9H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.228,"smiles":null,"spectrum_id":"CCMSLIB00017292721","spectrum_index":39374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 113.0848 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.155,"smiles":null,"spectrum_id":"CCMSLIB00017292724","spectrum_index":39375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 354.2773 Da; putative annotation: N/A; putative formula: C21H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.328,"smiles":null,"spectrum_id":"CCMSLIB00017292727","spectrum_index":39376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Aminovaleric acid betaine (delta mass: 290.1992 Da; putative annotation: N/A; putative formula: C17H26N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.332,"smiles":null,"spectrum_id":"CCMSLIB00017292728","spectrum_index":39377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 17.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017292733","spectrum_index":39378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 60.0191 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.194,"smiles":null,"spectrum_id":"CCMSLIB00017292734","spectrum_index":39379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 59.0357 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.2,"smiles":null,"spectrum_id":"CCMSLIB00017292737","spectrum_index":39380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 77.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.14,"smiles":null,"spectrum_id":"CCMSLIB00017292740","spectrum_index":39381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 114.0677 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.123,"smiles":null,"spectrum_id":"CCMSLIB00017292743","spectrum_index":39382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 818.2958 Da; putative annotation: N/A; putative formula: C41H42N10O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1647.58,"smiles":null,"spectrum_id":"CCMSLIB00017292744","spectrum_index":39383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 747.3174 Da; putative annotation: N/A; putative formula: C31H49N5O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.393,"smiles":null,"spectrum_id":"CCMSLIB00017292747","spectrum_index":39384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paxilline (delta mass: 360.2534 Da; putative annotation: N/A; putative formula: C18H37N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.502,"smiles":null,"spectrum_id":"CCMSLIB00017292748","spectrum_index":39385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 162.0532 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.15,"smiles":null,"spectrum_id":"CCMSLIB00017292751","spectrum_index":39386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine methyl ester (delta mass: 43.006 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.082,"smiles":null,"spectrum_id":"CCMSLIB00017292754","spectrum_index":39387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 477.2423 Da; putative annotation: N/A; putative formula: C24H31N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.313,"smiles":null,"spectrum_id":"CCMSLIB00017292755","spectrum_index":39388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 355.1628 Da; putative annotation: N/A; putative formula: C17H25NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.317,"smiles":null,"spectrum_id":"CCMSLIB00017292758","spectrum_index":39389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 508.2518 Da; putative annotation: N/A; putative formula: C23H40O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.375,"smiles":null,"spectrum_id":"CCMSLIB00017292759","spectrum_index":39390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.138,"smiles":null,"spectrum_id":"CCMSLIB00017292762","spectrum_index":39391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 57.0193 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.174,"smiles":null,"spectrum_id":"CCMSLIB00017292765","spectrum_index":39392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methylquinolin-2(1H)-one (delta mass: 99.0752 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.151,"smiles":null,"spectrum_id":"CCMSLIB00017292766","spectrum_index":39393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 355.2282 Da; putative annotation: N/A; putative formula: C19H34NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.299,"smiles":null,"spectrum_id":"CCMSLIB00017292769","spectrum_index":39394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 131.0392 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.163,"smiles":null,"spectrum_id":"CCMSLIB00017292770","spectrum_index":39395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 518.1771 Da; putative annotation: N/A; putative formula: C31H34OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.237,"smiles":null,"spectrum_id":"CCMSLIB00017292773","spectrum_index":39396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 177.0711 Da; putative annotation: N/A; putative formula: C10H12NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.158,"smiles":null,"spectrum_id":"CCMSLIB00017292776","spectrum_index":39397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 71.0372 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017292779","spectrum_index":39398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 469.3954 Da; putative annotation: N/A; putative formula: C28H55NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.549,"smiles":null,"spectrum_id":"CCMSLIB00017292781","spectrum_index":39399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 61.0163 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.108,"smiles":null,"spectrum_id":"CCMSLIB00017292783","spectrum_index":39400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 97.0537 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.093,"smiles":null,"spectrum_id":"CCMSLIB00017292786","spectrum_index":39401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 1054.9576 Da; putative annotation: N/A; putative formula: C62H126N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1349.08,"smiles":null,"spectrum_id":"CCMSLIB00017292789","spectrum_index":39402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-5-Phenylpent-2-enoic acid (delta mass: 9.9845 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.076,"smiles":null,"spectrum_id":"CCMSLIB00017292790","spectrum_index":39403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 89.0528 Da; putative annotation: N/A; putative formula: C2H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.186,"smiles":null,"spectrum_id":"CCMSLIB00017292793","spectrum_index":39404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 87.0212 Da; putative annotation: N/A; putative formula: C5HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.113,"smiles":null,"spectrum_id":"CCMSLIB00017292796","spectrum_index":39405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 300.1883 Da; putative annotation: N/A; putative formula: C15H30N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.275,"smiles":null,"spectrum_id":"CCMSLIB00017292798","spectrum_index":39406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 391.2209 Da; putative annotation: N/A; putative formula: C18H33NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.276,"smiles":null,"spectrum_id":"CCMSLIB00017292800","spectrum_index":39407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 96.0934 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.346,"smiles":null,"spectrum_id":"CCMSLIB00017292803","spectrum_index":39408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 206.2045 Da; putative annotation: N/A; putative formula: C15H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.28,"smiles":null,"spectrum_id":"CCMSLIB00017292806","spectrum_index":39409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sarcosine ethyl ester (delta mass: 56.0028 Da; putative annotation: N/A; putative formula: CN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.089,"smiles":null,"spectrum_id":"CCMSLIB00017292809","spectrum_index":39410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 124.9299 Da; putative annotation: N/A; putative formula: H3NO-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.125,"smiles":null,"spectrum_id":"CCMSLIB00017292810","spectrum_index":39411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 171.0895 Da; putative annotation: N/A; putative formula: C8H13NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.15,"smiles":null,"spectrum_id":"CCMSLIB00017292813","spectrum_index":39412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 274.2301 Da; putative annotation: N/A; putative formula: C19H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.322,"smiles":null,"spectrum_id":"CCMSLIB00017292816","spectrum_index":39413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 19.0666 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.153,"smiles":null,"spectrum_id":"CCMSLIB00017292819","spectrum_index":39414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084606 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 114.0404 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.095,"smiles":null,"spectrum_id":"CCMSLIB00017292820","spectrum_index":39415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 218.0634 Da; putative annotation: N/A; putative formula: C10H10N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.13,"smiles":null,"spectrum_id":"CCMSLIB00017292823","spectrum_index":39416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 105.0793 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.233,"smiles":null,"spectrum_id":"CCMSLIB00017292826","spectrum_index":39417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-N-(2-pyridinylmethyl)-1H-indole-3-carboxamide (delta mass: 99.0785 Da; putative annotation: N/A; putative formula: C4H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.207,"smiles":null,"spectrum_id":"CCMSLIB00017292829","spectrum_index":39418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Paxitriol (delta mass: 97.9739 Da; putative annotation: N/A; putative formula: C4H3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.238,"smiles":null,"spectrum_id":"CCMSLIB00017292830","spectrum_index":39419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 77.0295 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.078,"smiles":null,"spectrum_id":"CCMSLIB00017292833","spectrum_index":39420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 172.1429 Da; putative annotation: N/A; putative formula: C6H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.223,"smiles":null,"spectrum_id":"CCMSLIB00017292836","spectrum_index":39421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 234.96 Da; putative annotation: N/A; putative formula: C6H5NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.041,"smiles":null,"spectrum_id":"CCMSLIB00017292839","spectrum_index":39422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 204.1343 Da; putative annotation: N/A; putative formula: C14H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.199,"smiles":null,"spectrum_id":"CCMSLIB00017292840","spectrum_index":39423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal (delta mass: 88.0505 Da; putative annotation: N/A; putative formula: H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017292843","spectrum_index":39424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 62.0015 Da; putative annotation: N/A; putative formula: C2H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.082,"smiles":null,"spectrum_id":"CCMSLIB00017292846","spectrum_index":39425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 1.9651 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.013,"smiles":null,"spectrum_id":"CCMSLIB00017292847","spectrum_index":39426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl indole-4-carboxylate (delta mass: 175.0781 Da; putative annotation: N/A; putative formula: C6H13N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.149,"smiles":null,"spectrum_id":"CCMSLIB00017292850","spectrum_index":39427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 478.0225 Da; putative annotation: N/A; putative formula: C13H16N6O8P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.151,"smiles":null,"spectrum_id":"CCMSLIB00017292851","spectrum_index":39428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Val (delta mass: 99.032 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.145,"smiles":null,"spectrum_id":"CCMSLIB00017292854","spectrum_index":39429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 504.3457 Da; putative annotation: N/A; putative formula: C31H52OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.406,"smiles":null,"spectrum_id":"CCMSLIB00017292857","spectrum_index":39430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 49.0277 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.114,"smiles":null,"spectrum_id":"CCMSLIB00017292858","spectrum_index":39431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 138.0836 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017292861","spectrum_index":39432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 355.1433 Da; putative annotation: N/A; putative formula: C21H17N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.203,"smiles":null,"spectrum_id":"CCMSLIB00017292864","spectrum_index":39433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Methyltryptamine (delta mass: 39.0413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.164,"smiles":null,"spectrum_id":"CCMSLIB00017292865","spectrum_index":39434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine (delta mass: 53.018 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.105,"smiles":null,"spectrum_id":"CCMSLIB00017292868","spectrum_index":39435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 130.042 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.108,"smiles":null,"spectrum_id":"CCMSLIB00017292869","spectrum_index":39436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 113.1266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.218,"smiles":null,"spectrum_id":"CCMSLIB00017292872","spectrum_index":39437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 218.0583 Da; putative annotation: N/A; putative formula: C5H10N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.118,"smiles":null,"spectrum_id":"CCMSLIB00017292875","spectrum_index":39438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 174.0312 Da; putative annotation: 7,8-Dihydroxy-4-methylcoumarin; putative formula: C10H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.091,"smiles":null,"spectrum_id":"CCMSLIB00017292878","spectrum_index":39439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 275.137 Da; putative annotation: 3-[(4-Fluoroanilino)carbonyl]-1,2,2-trimethylcyclopentanecarboxylic acid; putative formula: C16H18FNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.26,"smiles":null,"spectrum_id":"CCMSLIB00017292881","spectrum_index":39440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 321.9831 Da; putative annotation: D-myo-Inositol-1,5-diphosphate; putative formula: C6H12O11P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.08,"smiles":null,"spectrum_id":"CCMSLIB00017292882","spectrum_index":39441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-Binaphthyl-8,8'-dicarboxylic acid (delta mass: 135.2913 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.388,"smiles":null,"spectrum_id":"CCMSLIB00017292885","spectrum_index":39442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 90.0315 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017292888","spectrum_index":39443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.086,"smiles":null,"spectrum_id":"CCMSLIB00017292891","spectrum_index":39444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU022001 Labetalol|2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide (delta mass: 493.3667 Da; putative annotation: N/A; putative formula: C31H47N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.553,"smiles":null,"spectrum_id":"CCMSLIB00017292894","spectrum_index":39445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 40.9977 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.152,"smiles":null,"spectrum_id":"CCMSLIB00017292895","spectrum_index":39446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 116.1198 Da; putative annotation: N/A; putative formula: C3H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.206,"smiles":null,"spectrum_id":"CCMSLIB00017292898","spectrum_index":39447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 572.3406 Da; putative annotation: N/A; putative formula: C26H52O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.489,"smiles":null,"spectrum_id":"CCMSLIB00017292901","spectrum_index":39448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 67.0563 Da; putative annotation: N/A; putative formula: C3H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.143,"smiles":null,"spectrum_id":"CCMSLIB00017292903","spectrum_index":39449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 130.0783 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017292906","spectrum_index":39450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ364507 Diaveridine|5-[(3,4-dimethoxyphenyl)methyl]pyrimidine-2,4-diamine (delta mass: 68.051 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017292908","spectrum_index":39451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 14.0094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017292911","spectrum_index":39452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 342.278 Da; putative annotation: N/A; putative formula: C21H42O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.358,"smiles":null,"spectrum_id":"CCMSLIB00017292914","spectrum_index":39453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 550.2609 Da; putative annotation: N/A; putative formula: C30H46O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.328,"smiles":null,"spectrum_id":"CCMSLIB00017292917","spectrum_index":39454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 269.2678 Da; putative annotation: N/A; putative formula: C13H31N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.359,"smiles":null,"spectrum_id":"CCMSLIB00017292918","spectrum_index":39455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 239.1332 Da; putative annotation: N/A; putative formula: C13H21NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.22,"smiles":null,"spectrum_id":"CCMSLIB00017292921","spectrum_index":39456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 80.0624 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017292924","spectrum_index":39457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 7-fluoro-3-methyl-1H-indole-2-carboxylate (delta mass: 197.1543 Da; putative annotation: N/A; putative formula: C10H19N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.231,"smiles":null,"spectrum_id":"CCMSLIB00017292927","spectrum_index":39458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 187.0845 Da; putative annotation: N/A; putative formula: C8H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.145,"smiles":null,"spectrum_id":"CCMSLIB00017292928","spectrum_index":39459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Ethoxy-2-(ethylthio)-1H-benzimidazole (delta mass: 216.0743 Da; putative annotation: N/A; putative formula: C8H12N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.164,"smiles":null,"spectrum_id":"CCMSLIB00017292931","spectrum_index":39460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,6-Trihydroxy-5-[1-(4-hydroxy-1,1,4,7-tetramethyl-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-yl)-3-methylbutyl]benzene-1,3-dicarbaldehyde (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.301,"smiles":null,"spectrum_id":"CCMSLIB00017292934","spectrum_index":39461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phthalyl-L-tryptophan (delta mass: 27.0002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.103,"smiles":null,"spectrum_id":"CCMSLIB00017292935","spectrum_index":39462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 465.1638 Da; putative annotation: N/A; putative formula: C25H28N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.224,"smiles":null,"spectrum_id":"CCMSLIB00017292938","spectrum_index":39463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 180.1519 Da; putative annotation: N/A; putative formula: C12H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.275,"smiles":null,"spectrum_id":"CCMSLIB00017292939","spectrum_index":39464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (Vitamin B7) (delta mass: 37.956 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.051,"smiles":null,"spectrum_id":"CCMSLIB00017292942","spectrum_index":39465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 94.0418 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.107,"smiles":null,"spectrum_id":"CCMSLIB00017292945","spectrum_index":39466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 1.9729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.09,"smiles":null,"spectrum_id":"CCMSLIB00017292946","spectrum_index":39467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Methyl-1-piperazinyl)butanoic acid (delta mass: 7.994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.138,"smiles":null,"spectrum_id":"CCMSLIB00017292949","spectrum_index":39468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 83.0736 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.227,"smiles":null,"spectrum_id":"CCMSLIB00017292952","spectrum_index":39469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 204.0955 Da; putative annotation: N/A; putative formula: C7H17N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.145,"smiles":null,"spectrum_id":"CCMSLIB00017292954","spectrum_index":39470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 267.6198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.706,"smiles":null,"spectrum_id":"CCMSLIB00017292956","spectrum_index":39471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 166.1108 Da; putative annotation: N/A; putative formula: C9H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.15,"smiles":null,"spectrum_id":"CCMSLIB00017292959","spectrum_index":39472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 56.1088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.211,"smiles":null,"spectrum_id":"CCMSLIB00017292962","spectrum_index":39473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 143.073 Da; putative annotation: N/A; putative formula: C4H10N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.17,"smiles":null,"spectrum_id":"CCMSLIB00017292965","spectrum_index":39474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 76.0679 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.342,"smiles":null,"spectrum_id":"CCMSLIB00017292967","spectrum_index":39475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 157.021 Da; putative annotation: N/A; putative formula: C6H9NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.159,"smiles":null,"spectrum_id":"CCMSLIB00017292970","spectrum_index":39476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 130.1067 Da; putative annotation: N/A; putative formula: C2H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.208,"smiles":null,"spectrum_id":"CCMSLIB00017292972","spectrum_index":39477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 260.0978 Da; putative annotation: N/A; putative formula: C6H12N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.231,"smiles":null,"spectrum_id":"CCMSLIB00017292975","spectrum_index":39478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4,6-difluoro-1H-indole-2-carboxylate (delta mass: 23.9952 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.047,"smiles":null,"spectrum_id":"CCMSLIB00017292978","spectrum_index":39479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 115.0628 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.186,"smiles":null,"spectrum_id":"CCMSLIB00017292980","spectrum_index":39480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-methylpropan-1-ol (delta mass: 24.9943 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":115.086,"smiles":null,"spectrum_id":"CCMSLIB00017292982","spectrum_index":39481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine - 40.0 eV (delta mass: 10.9692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.071,"smiles":null,"spectrum_id":"CCMSLIB00017292985","spectrum_index":39482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Arabinose (delta mass: 76.0313 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017292988","spectrum_index":39483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 156.1304 Da; putative annotation: N/A; putative formula: C13H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.201,"smiles":null,"spectrum_id":"CCMSLIB00017292989","spectrum_index":39484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 256.0836 Da; putative annotation: N/A; putative formula: C8H13N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.126,"smiles":null,"spectrum_id":"CCMSLIB00017292992","spectrum_index":39485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 102.0246 Da; putative annotation: N/A; putative formula: C3H6N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.184,"smiles":null,"spectrum_id":"CCMSLIB00017292995","spectrum_index":39486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 59.0365 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.144,"smiles":null,"spectrum_id":"CCMSLIB00017292998","spectrum_index":39487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 396.3601 Da; putative annotation: N/A; putative formula: C25H48O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.42,"smiles":null,"spectrum_id":"CCMSLIB00017292999","spectrum_index":39488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 83.9906 Da; putative annotation: N/A; putative formula: CN4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.05,"smiles":null,"spectrum_id":"CCMSLIB00017293002","spectrum_index":39489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 8.0511 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.132,"smiles":null,"spectrum_id":"CCMSLIB00017293005","spectrum_index":39490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 550.2976 Da; putative annotation: N/A; putative formula: C23H38N10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.421,"smiles":null,"spectrum_id":"CCMSLIB00017293008","spectrum_index":39491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 160.2562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.327,"smiles":null,"spectrum_id":"CCMSLIB00017293009","spectrum_index":39492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 79.0097 Da; putative annotation: N/A; putative formula: C4HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.211,"smiles":null,"spectrum_id":"CCMSLIB00017293012","spectrum_index":39493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004401 1-hydroxypyrene|pyren-1-ol (delta mass: 29.0089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.089,"smiles":null,"spectrum_id":"CCMSLIB00017293015","spectrum_index":39494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 27.0116 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.087,"smiles":null,"spectrum_id":"CCMSLIB00017293018","spectrum_index":39495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 48.0114 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.092,"smiles":null,"spectrum_id":"CCMSLIB00017293019","spectrum_index":39496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 94.0166 Da; putative annotation: N/A; putative formula: C4H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017293022","spectrum_index":39497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 249.1213 Da; putative annotation: N/A; putative formula: C10H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.224,"smiles":null,"spectrum_id":"CCMSLIB00017293025","spectrum_index":39498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 172.143 Da; putative annotation: N/A; putative formula: C6H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.246,"smiles":null,"spectrum_id":"CCMSLIB00017293027","spectrum_index":39499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 130.0418 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017293029","spectrum_index":39500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 34.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.009,"smiles":null,"spectrum_id":"CCMSLIB00017293032","spectrum_index":39501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 173.1054 Da; putative annotation: N/A; putative formula: C8H15NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.192,"smiles":null,"spectrum_id":"CCMSLIB00017293035","spectrum_index":39502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 194.1587 Da; putative annotation: N/A; putative formula: C13H23O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.266,"smiles":null,"spectrum_id":"CCMSLIB00017293038","spectrum_index":39503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 45.0319 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.134,"smiles":null,"spectrum_id":"CCMSLIB00017293039","spectrum_index":39504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 536.2825 Da; putative annotation: N/A; putative formula: C38H36N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.406,"smiles":null,"spectrum_id":"CCMSLIB00017293042","spectrum_index":39505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 307.127 Da; putative annotation: N/A; putative formula: C15H22N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.166,"smiles":null,"spectrum_id":"CCMSLIB00017293045","spectrum_index":39506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 268.0371 Da; putative annotation: N/A; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.097,"smiles":null,"spectrum_id":"CCMSLIB00017293046","spectrum_index":39507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 33.97 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.009,"smiles":null,"spectrum_id":"CCMSLIB00017293049","spectrum_index":39508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 58.0422 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.165,"smiles":null,"spectrum_id":"CCMSLIB00017293052","spectrum_index":39509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101906 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 48.04 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.126,"smiles":null,"spectrum_id":"CCMSLIB00017293053","spectrum_index":39510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 11.9404 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.048,"smiles":null,"spectrum_id":"CCMSLIB00017293056","spectrum_index":39511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 95.0543 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.119,"smiles":null,"spectrum_id":"CCMSLIB00017293059","spectrum_index":39512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 148.0638 Da; putative annotation: N/A; putative formula: C8H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.165,"smiles":null,"spectrum_id":"CCMSLIB00017293060","spectrum_index":39513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385848-01_C19H24N2O_(3alpha,14alpha,16alpha)-14,15-Dihydroeburnamenin-14-ol (delta mass: 18.0129 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.209,"smiles":null,"spectrum_id":"CCMSLIB00017293063","spectrum_index":39514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 145.1079 Da; putative annotation: N/A; putative formula: C3H11N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.147,"smiles":null,"spectrum_id":"CCMSLIB00017293066","spectrum_index":39515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethoxy-2(1H)-quinolinone (delta mass: 43.0207 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.102,"smiles":null,"spectrum_id":"CCMSLIB00017293067","spectrum_index":39516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 212.1408 Da; putative annotation: N/A; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.274,"smiles":null,"spectrum_id":"CCMSLIB00017293070","spectrum_index":39517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 213.2094 Da; putative annotation: N/A; putative formula: C13H27NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.337,"smiles":null,"spectrum_id":"CCMSLIB00017293072","spectrum_index":39518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 74.0733 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017293074","spectrum_index":39519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 53.1719 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.237,"smiles":null,"spectrum_id":"CCMSLIB00017293077","spectrum_index":39520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017293079","spectrum_index":39521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 96.0562 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.121,"smiles":null,"spectrum_id":"CCMSLIB00017293081","spectrum_index":39522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-1H-indole-3-carbaldehyde (delta mass: 89.1179 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.139,"smiles":null,"spectrum_id":"CCMSLIB00017293084","spectrum_index":39523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 500.1715 Da; putative annotation: N/A; putative formula: C23H32O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.295,"smiles":null,"spectrum_id":"CCMSLIB00017293087","spectrum_index":39524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 443.3311 Da; putative annotation: N/A; putative formula: C28H46NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.427,"smiles":null,"spectrum_id":"CCMSLIB00017293089","spectrum_index":39525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 207.0909 Da; putative annotation: N/A; putative formula: C12H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.246,"smiles":null,"spectrum_id":"CCMSLIB00017293091","spectrum_index":39526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 304.169 Da; putative annotation: N/A; putative formula: C19H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.271,"smiles":null,"spectrum_id":"CCMSLIB00017293094","spectrum_index":39527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-histamine; LC-tDDA; CE10 (delta mass: 130.1064 Da; putative annotation: N/A; putative formula: C2H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.204,"smiles":null,"spectrum_id":"CCMSLIB00017293096","spectrum_index":39528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 136.0276 Da; putative annotation: N/A; putative formula: C6H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.156,"smiles":null,"spectrum_id":"CCMSLIB00017293098","spectrum_index":39529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 115.0695 Da; putative annotation: N/A; putative formula: H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.244,"smiles":null,"spectrum_id":"CCMSLIB00017293101","spectrum_index":39530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 65.0417 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.128,"smiles":null,"spectrum_id":"CCMSLIB00017293103","spectrum_index":39531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 23.0186 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.157,"smiles":null,"spectrum_id":"CCMSLIB00017293105","spectrum_index":39532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 116.1042 Da; putative annotation: N/A; putative formula: C4H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.206,"smiles":null,"spectrum_id":"CCMSLIB00017293108","spectrum_index":39533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(1H-Indol-3-yl)ethyl]propanamide (delta mass: 55.0423 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.176,"smiles":null,"spectrum_id":"CCMSLIB00017293111","spectrum_index":39534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 200.0889 Da; putative annotation: N/A; putative formula: C10H18P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.169,"smiles":null,"spectrum_id":"CCMSLIB00017293113","spectrum_index":39535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 279.1547 Da; putative annotation: N/A; putative formula: C19H22NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.262,"smiles":null,"spectrum_id":"CCMSLIB00017293115","spectrum_index":39536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380224-01!1,7-bis(3,4-dihydroxyphenyl)-6-methoxyheptan-3-one (delta mass: 276.0776 Da; putative annotation: N/A; putative formula: C12H13N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.242,"smiles":null,"spectrum_id":"CCMSLIB00017293118","spectrum_index":39537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 236.1524 Da; putative annotation: N/A; putative formula: C13H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.239,"smiles":null,"spectrum_id":"CCMSLIB00017293121","spectrum_index":39538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 230.135 Da; putative annotation: N/A; putative formula: C15H18O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.19,"smiles":null,"spectrum_id":"CCMSLIB00017293122","spectrum_index":39539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 258.6239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.71,"smiles":null,"spectrum_id":"CCMSLIB00017293125","spectrum_index":39540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-yl)ethanamine (delta mass: 30.0442 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.147,"smiles":null,"spectrum_id":"CCMSLIB00017293128","spectrum_index":39541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN - 30.0 eV (delta mass: 28.9955 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.091,"smiles":null,"spectrum_id":"CCMSLIB00017293130","spectrum_index":39542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 54.0224 Da; putative annotation: N/A; putative formula: C2H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.114,"smiles":null,"spectrum_id":"CCMSLIB00017293133","spectrum_index":39543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 796.4239 Da; putative annotation: N/A; putative formula: C54H56N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1003.51,"smiles":null,"spectrum_id":"CCMSLIB00017293135","spectrum_index":39544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 164.0305 Da; putative annotation: N/A; putative formula: C2N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.154,"smiles":null,"spectrum_id":"CCMSLIB00017293138","spectrum_index":39545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 155.0748 Da; putative annotation: N/A; putative formula: C11H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.172,"smiles":null,"spectrum_id":"CCMSLIB00017293140","spectrum_index":39546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 150.0752 Da; putative annotation: N/A; putative formula: C8H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.171,"smiles":null,"spectrum_id":"CCMSLIB00017293143","spectrum_index":39547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 164.0475 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.134,"smiles":null,"spectrum_id":"CCMSLIB00017293146","spectrum_index":39548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 116.0983 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.341,"smiles":null,"spectrum_id":"CCMSLIB00017293149","spectrum_index":39549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 659.3518 Da; putative annotation: N/A; putative formula: C32H53NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.412,"smiles":null,"spectrum_id":"CCMSLIB00017293150","spectrum_index":39550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 42.1202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.217,"smiles":null,"spectrum_id":"CCMSLIB00017293153","spectrum_index":39551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 159.1248 Da; putative annotation: N/A; putative formula: C8H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.221,"smiles":null,"spectrum_id":"CCMSLIB00017293156","spectrum_index":39552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 231.0743 Da; putative annotation: N/A; putative formula: C9H13NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.171,"smiles":null,"spectrum_id":"CCMSLIB00017293157","spectrum_index":39553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 92.0982 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.185,"smiles":null,"spectrum_id":"CCMSLIB00017293160","spectrum_index":39554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 35.0305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.165,"smiles":null,"spectrum_id":"CCMSLIB00017293163","spectrum_index":39555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 88.041 Da; putative annotation: N/A; putative formula: C6H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017293166","spectrum_index":39556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 893.374 Da; putative annotation: N/A; putative formula: C36H63NO24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1058.45,"smiles":null,"spectrum_id":"CCMSLIB00017293167","spectrum_index":39557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 729.6111 Da; putative annotation: N/A; putative formula: C42H83NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":892.671,"smiles":null,"spectrum_id":"CCMSLIB00017293170","spectrum_index":39558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 116.0856 Da; putative annotation: N/A; putative formula: C5H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.086,"smiles":null,"spectrum_id":"CCMSLIB00017293173","spectrum_index":39559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 66.9692 Da; putative annotation: N/A; putative formula: CH-2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.128,"smiles":null,"spectrum_id":"CCMSLIB00017293176","spectrum_index":39560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 157.0991 Da; putative annotation: N/A; putative formula: C10H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017293177","spectrum_index":39561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine (delta mass: 36.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.17,"smiles":null,"spectrum_id":"CCMSLIB00017293180","spectrum_index":39562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 247.2185 Da; putative annotation: N/A; putative formula: C14H25N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.31,"smiles":null,"spectrum_id":"CCMSLIB00017293183","spectrum_index":39563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 305.0406 Da; putative annotation: N/A; putative formula: C12H11N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.08,"smiles":null,"spectrum_id":"CCMSLIB00017293184","spectrum_index":39564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 66.0834 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.211,"smiles":null,"spectrum_id":"CCMSLIB00017293187","spectrum_index":39565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 267.2601 Da; putative annotation: N/A; putative formula: C17H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.347,"smiles":null,"spectrum_id":"CCMSLIB00017293190","spectrum_index":39566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 143.1236 Da; putative annotation: N/A; putative formula: C8H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.219,"smiles":null,"spectrum_id":"CCMSLIB00017293191","spectrum_index":39567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 891.4685 Da; putative annotation: N/A; putative formula: C61H65NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1204.61,"smiles":null,"spectrum_id":"CCMSLIB00017293194","spectrum_index":39568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 448.2179 Da; putative annotation: N/A; putative formula: C19H36N4O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.288,"smiles":null,"spectrum_id":"CCMSLIB00017293197","spectrum_index":39569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 90.0108 Da; putative annotation: N/A; putative formula: C6H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.134,"smiles":null,"spectrum_id":"CCMSLIB00017293200","spectrum_index":39570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 312.1607 Da; putative annotation: N/A; putative formula: C15H25N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.219,"smiles":null,"spectrum_id":"CCMSLIB00017293201","spectrum_index":39571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 5.3723 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017293204","spectrum_index":39572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 91.0424 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017293207","spectrum_index":39573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 121.0639 Da; putative annotation: N/A; putative formula: C6H7N3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.129,"smiles":null,"spectrum_id":"CCMSLIB00017293208","spectrum_index":39574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 170.0696 Da; putative annotation: N/A; putative formula: C7H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017293211","spectrum_index":39575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 75.0346 Da; putative annotation: N/A; putative formula: CH6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.08,"smiles":null,"spectrum_id":"CCMSLIB00017293214","spectrum_index":39576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (delta mass: 64.0168 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.15,"smiles":null,"spectrum_id":"CCMSLIB00017293217","spectrum_index":39577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of codeine (delta mass: 36.0202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.18,"smiles":null,"spectrum_id":"CCMSLIB00017293218","spectrum_index":39578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 74.0365 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.112,"smiles":null,"spectrum_id":"CCMSLIB00017293221","spectrum_index":39579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 20.0 eV (delta mass: 632.9314 Da; putative annotation: N/A; putative formula: C10H16N5O17P5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.045,"smiles":null,"spectrum_id":"CCMSLIB00017293224","spectrum_index":39580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to cis,cis-9,12-Octadecadien-1-ol from NIST14 (delta mass: 48.0366 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.305,"smiles":null,"spectrum_id":"CCMSLIB00017293226","spectrum_index":39581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 570.251 Da; putative annotation: N/A; putative formula: C21H34N10O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.29,"smiles":null,"spectrum_id":"CCMSLIB00017293228","spectrum_index":39582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 431.3616 Da; putative annotation: N/A; putative formula: C24H49NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.432,"smiles":null,"spectrum_id":"CCMSLIB00017293231","spectrum_index":39583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 421.3423 Da; putative annotation: N/A; putative formula: C23H43N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.466,"smiles":null,"spectrum_id":"CCMSLIB00017293234","spectrum_index":39584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 769.9015 Da; putative annotation: N/A; putative formula: C31H30O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":991.999,"smiles":null,"spectrum_id":"CCMSLIB00017293236","spectrum_index":39585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 53.0628 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017293238","spectrum_index":39586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dioxy-creatinine - 40.0 eV (delta mass: 1.922 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":116.972,"smiles":null,"spectrum_id":"CCMSLIB00017293241","spectrum_index":39587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 182.0699 Da; putative annotation: N/A; putative formula: C9H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.156,"smiles":null,"spectrum_id":"CCMSLIB00017293243","spectrum_index":39588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 263.0667 Da; putative annotation: N/A; putative formula: C11H5N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.243,"smiles":null,"spectrum_id":"CCMSLIB00017293245","spectrum_index":39589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 86.0434 Da; putative annotation: N/A; putative formula: C3H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.07,"smiles":null,"spectrum_id":"CCMSLIB00017293248","spectrum_index":39590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 619.4449 Da; putative annotation: N/A; putative formula: C36H61NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.521,"smiles":null,"spectrum_id":"CCMSLIB00017293251","spectrum_index":39591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 233.1626 Da; putative annotation: N/A; putative formula: C11H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.233,"smiles":null,"spectrum_id":"CCMSLIB00017293253","spectrum_index":39592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 71.9693 Da; putative annotation: N/A; putative formula: C2H2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.139,"smiles":null,"spectrum_id":"CCMSLIB00017293255","spectrum_index":39593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 720.358 Da; putative annotation: N/A; putative formula: C45H53O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.428,"smiles":null,"spectrum_id":"CCMSLIB00017293258","spectrum_index":39594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 338.0768 Da; putative annotation: N/A; putative formula: C12H19O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.252,"smiles":null,"spectrum_id":"CCMSLIB00017293260","spectrum_index":39595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCOSAMINE 6-PHOSPHATE SODIUM SALT - 40.0 eV (delta mass: 779.5195 Da; putative annotation: N/A; putative formula: C44H69N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1039.57,"smiles":null,"spectrum_id":"CCMSLIB00017293263","spectrum_index":39596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 15.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.16,"smiles":null,"spectrum_id":"CCMSLIB00017293266","spectrum_index":39597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 92.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.155,"smiles":null,"spectrum_id":"CCMSLIB00017293268","spectrum_index":39598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of caffeic acid CollisionEnergy:102040 (delta mass: 59.9416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.991,"smiles":null,"spectrum_id":"CCMSLIB00017293271","spectrum_index":39599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 100.0749 Da; putative annotation: N/A; putative formula: C3H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.125,"smiles":null,"spectrum_id":"CCMSLIB00017293274","spectrum_index":39600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 420.0917 Da; putative annotation: N/A; putative formula: C17H16N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.142,"smiles":null,"spectrum_id":"CCMSLIB00017293276","spectrum_index":39601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 221.0762 Da; putative annotation: N/A; putative formula: C5H11N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.235,"smiles":null,"spectrum_id":"CCMSLIB00017293279","spectrum_index":39602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phthalyl-L-tryptophan (delta mass: 17.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.124,"smiles":null,"spectrum_id":"CCMSLIB00017293282","spectrum_index":39603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan monopalmitate (delta mass: 130.0496 Da; putative annotation: N/A; putative formula: C3H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.355,"smiles":null,"spectrum_id":"CCMSLIB00017293283","spectrum_index":39604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 212.046 Da; putative annotation: N/A; putative formula: C7H9N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.169,"smiles":null,"spectrum_id":"CCMSLIB00017293286","spectrum_index":39605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 401.0944 Da; putative annotation: N/A; putative formula: C21H23NOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.28,"smiles":null,"spectrum_id":"CCMSLIB00017293289","spectrum_index":39606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 159.0904 Da; putative annotation: N/A; putative formula: C8H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.187,"smiles":null,"spectrum_id":"CCMSLIB00017293291","spectrum_index":39607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.164,"smiles":null,"spectrum_id":"CCMSLIB00017293294","spectrum_index":39608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 120.094 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.363,"smiles":null,"spectrum_id":"CCMSLIB00017293296","spectrum_index":39609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 74.0554 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.23,"smiles":null,"spectrum_id":"CCMSLIB00017293299","spectrum_index":39610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 82.0626 Da; putative annotation: N/A; putative formula: C3H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.18,"smiles":null,"spectrum_id":"CCMSLIB00017293302","spectrum_index":39611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 202.0993 Da; putative annotation: N/A; putative formula: C13H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.144,"smiles":null,"spectrum_id":"CCMSLIB00017293304","spectrum_index":39612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 71.1819 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.242,"smiles":null,"spectrum_id":"CCMSLIB00017293306","spectrum_index":39613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 47.0378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.181,"smiles":null,"spectrum_id":"CCMSLIB00017293309","spectrum_index":39614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mandelic acid (delta mass: 67.9901 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.045,"smiles":null,"spectrum_id":"CCMSLIB00017293312","spectrum_index":39615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384639-01_C14H16N2O3_Pyrrolo[1,2-a]pyrazine-1,4-dione, hexahydro-3-[(4-hydroxyphenyl)methyl]- (delta mass: 1.9769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.1,"smiles":null,"spectrum_id":"CCMSLIB00017293313","spectrum_index":39616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 100.0675 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.149,"smiles":null,"spectrum_id":"CCMSLIB00017293316","spectrum_index":39617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 362.3021 Da; putative annotation: N/A; putative formula: C17H34N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.399,"smiles":null,"spectrum_id":"CCMSLIB00017293319","spectrum_index":39618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 40.0313 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.154,"smiles":null,"spectrum_id":"CCMSLIB00017293322","spectrum_index":39619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 328.0582 Da; putative annotation: 3',5'-Dimethoxy-3,5,7,4'-tetrahydroxyflavone; putative formula: C17H12O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.134,"smiles":null,"spectrum_id":"CCMSLIB00017293324","spectrum_index":39620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 308.0679 Da; putative annotation: 4-{(1E)-3-[4-(Carboxymethoxy)phenyl]-3-oxo-1-propenyl}benzoic acid; putative formula: C18H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.128,"smiles":null,"spectrum_id":"CCMSLIB00017293326","spectrum_index":39621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 131.0734 Da; putative annotation: S(-)-Cathinone; putative formula: C9H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.134,"smiles":null,"spectrum_id":"CCMSLIB00017293329","spectrum_index":39622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 230.0944 Da; putative annotation: 8-Hydroxy-3-(4-oxopentyl)-3,4-dihydroisochromen-1-one; putative formula: C14H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.165,"smiles":null,"spectrum_id":"CCMSLIB00017293331","spectrum_index":39623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 153.0787 Da; putative annotation: 1-Acetamidocyclopentane-1-carboxylic acid; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017293333","spectrum_index":39624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 163.0629 Da; putative annotation: 3-Hydroxyphenylalanine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.118,"smiles":null,"spectrum_id":"CCMSLIB00017293336","spectrum_index":39625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 139.0269 Da; putative annotation: (2,5-Dioxo-1-pyrrolidinyl)acetic acid; putative formula: C6H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.113,"smiles":null,"spectrum_id":"CCMSLIB00017293339","spectrum_index":39626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 131.0482 Da; putative annotation: 7-Methylimidazo[1,2-a]pyrimidin-5(1H)-one; putative formula: C7H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.109,"smiles":null,"spectrum_id":"CCMSLIB00017293340","spectrum_index":39627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 198.1046 Da; putative annotation: (1R,6R)-6-Benzylcyclohex-3-enecarboxylic acid; putative formula: C14H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.191,"smiles":null,"spectrum_id":"CCMSLIB00017293343","spectrum_index":39628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 153.0581 Da; putative annotation: 1,4-Dihydrocyclopenta[b]indol-3(2H)-one; putative formula: C11H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017293346","spectrum_index":39629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 382.1769 Da; putative annotation: N/A; putative formula: C17H27N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.258,"smiles":null,"spectrum_id":"CCMSLIB00017293349","spectrum_index":39630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 125.0843 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.223,"smiles":null,"spectrum_id":"CCMSLIB00017293351","spectrum_index":39631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 122.0517 Da; putative annotation: N/A; putative formula: C11H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.175,"smiles":null,"spectrum_id":"CCMSLIB00017293353","spectrum_index":39632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 167.0614 Da; putative annotation: N/A; putative formula: C7H10N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.173,"smiles":null,"spectrum_id":"CCMSLIB00017293356","spectrum_index":39633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 46.038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.06,"smiles":null,"spectrum_id":"CCMSLIB00017293359","spectrum_index":39634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydromorphone (delta mass: 145.0599 Da; putative annotation: N/A; putative formula: C3H7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.204,"smiles":null,"spectrum_id":"CCMSLIB00017293361","spectrum_index":39635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 198.1042 Da; putative annotation: N/A; putative formula: C14H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017293363","spectrum_index":39636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thelephoric acid (delta mass: 184.1399 Da; putative annotation: N/A; putative formula: C10H20N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.169,"smiles":null,"spectrum_id":"CCMSLIB00017293366","spectrum_index":39637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 78.032 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.202,"smiles":null,"spectrum_id":"CCMSLIB00017293369","spectrum_index":39638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.087,"smiles":null,"spectrum_id":"CCMSLIB00017293372","spectrum_index":39639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-BUTYRIC ACID (delta mass: 45.021 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017293373","spectrum_index":39640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 9.984 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.153,"smiles":null,"spectrum_id":"CCMSLIB00017293376","spectrum_index":39641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 286.1808 Da; putative annotation: N/A; putative formula: C14H27N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.251,"smiles":null,"spectrum_id":"CCMSLIB00017293379","spectrum_index":39642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 12.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.159,"smiles":null,"spectrum_id":"CCMSLIB00017293382","spectrum_index":39643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate (delta mass: 18.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.17,"smiles":null,"spectrum_id":"CCMSLIB00017293383","spectrum_index":39644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(6-Methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-furaldehyde (delta mass: 18.1215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.17,"smiles":null,"spectrum_id":"CCMSLIB00017293386","spectrum_index":39645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnuside A (delta mass: 35.0298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.226,"smiles":null,"spectrum_id":"CCMSLIB00017293389","spectrum_index":39646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 42.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.143,"smiles":null,"spectrum_id":"CCMSLIB00017293391","spectrum_index":39647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2,3-dihydrobenzoic acid (delta mass: 59.0358 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.106,"smiles":null,"spectrum_id":"CCMSLIB00017293393","spectrum_index":39648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Bromoquinolin-8-ol (delta mass: 27.0151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.986,"smiles":null,"spectrum_id":"CCMSLIB00017293396","spectrum_index":39649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 62.0598 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.152,"smiles":null,"spectrum_id":"CCMSLIB00017293399","spectrum_index":39650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 736.4329 Da; putative annotation: N/A; putative formula: C31H60N8O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1065.62,"smiles":null,"spectrum_id":"CCMSLIB00017293400","spectrum_index":39651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(3-Chlorophenyl)-1H-pyrazol-5-amine (delta mass: 32.9969 Da; putative annotation: N/A; putative formula: C3H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.045,"smiles":null,"spectrum_id":"CCMSLIB00017293403","spectrum_index":39652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 387.2566 Da; putative annotation: N/A; putative formula: C20H33N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.369,"smiles":null,"spectrum_id":"CCMSLIB00017293406","spectrum_index":39653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 56.0616 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.283,"smiles":null,"spectrum_id":"CCMSLIB00017293409","spectrum_index":39654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 730.4265 Da; putative annotation: N/A; putative formula: C37H58N6O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":955.539,"smiles":null,"spectrum_id":"CCMSLIB00017293412","spectrum_index":39655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 22.0203 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017293413","spectrum_index":39656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 144.0423 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.118,"smiles":null,"spectrum_id":"CCMSLIB00017293416","spectrum_index":39657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 108.1088 Da; putative annotation: N/A; putative formula: C7H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.19,"smiles":null,"spectrum_id":"CCMSLIB00017293420","spectrum_index":39658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 282.0523 Da; putative annotation: N/A; putative formula: C8H14N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.176,"smiles":null,"spectrum_id":"CCMSLIB00017293422","spectrum_index":39659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 87.0659 Da; putative annotation: N/A; putative formula: H5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.187,"smiles":null,"spectrum_id":"CCMSLIB00017293425","spectrum_index":39660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 87.0314 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.118,"smiles":null,"spectrum_id":"CCMSLIB00017293428","spectrum_index":39661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Fluoro[1,1'-biphenyl]-4-yl)acetic acid (delta mass: 83.0324 Da; putative annotation: N/A; putative formula: HN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.114,"smiles":null,"spectrum_id":"CCMSLIB00017293431","spectrum_index":39662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 14.3338 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.414,"smiles":null,"spectrum_id":"CCMSLIB00017293432","spectrum_index":39663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 270.0948 Da; putative annotation: N/A; putative formula: C9H18O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.16,"smiles":null,"spectrum_id":"CCMSLIB00017293435","spectrum_index":39664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 126.0822 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.148,"smiles":null,"spectrum_id":"CCMSLIB00017293438","spectrum_index":39665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 56.0632 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.16,"smiles":null,"spectrum_id":"CCMSLIB00017293440","spectrum_index":39666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 114.0833 Da; putative annotation: N/A; putative formula: C10H10O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017293442","spectrum_index":39667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phlorin (delta mass: 290.1001 Da; putative annotation: N/A; putative formula: C12H18O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.192,"smiles":null,"spectrum_id":"CCMSLIB00017293445","spectrum_index":39668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxymorphinan (delta mass: 80.0315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.201,"smiles":null,"spectrum_id":"CCMSLIB00017293448","spectrum_index":39669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Entecavir (delta mass: 80.0696 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.194,"smiles":null,"spectrum_id":"CCMSLIB00017293451","spectrum_index":39670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 134.0532 Da; putative annotation: N/A; putative formula: C4H12N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.138,"smiles":null,"spectrum_id":"CCMSLIB00017293452","spectrum_index":39671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Ile (delta mass: 99.0679 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.238,"smiles":null,"spectrum_id":"CCMSLIB00017293455","spectrum_index":39672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 235.0164 Da; putative annotation: N/A; putative formula: C8H5N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.077,"smiles":null,"spectrum_id":"CCMSLIB00017293458","spectrum_index":39673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 534.2163 Da; putative annotation: N/A; putative formula: C34H34N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.303,"smiles":null,"spectrum_id":"CCMSLIB00017293459","spectrum_index":39674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 10.9985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.074,"smiles":null,"spectrum_id":"CCMSLIB00017293462","spectrum_index":39675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 84.021 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.086,"smiles":null,"spectrum_id":"CCMSLIB00017293464","spectrum_index":39676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 89.0483 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.129,"smiles":null,"spectrum_id":"CCMSLIB00017293466","spectrum_index":39677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 1113.6855 Da; putative annotation: N/A; putative formula: C56H99N5O15S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1268.72,"smiles":null,"spectrum_id":"CCMSLIB00017293469","spectrum_index":39678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 486.3342 Da; putative annotation: N/A; putative formula: C30H46O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.394,"smiles":null,"spectrum_id":"CCMSLIB00017293472","spectrum_index":39679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 62.0523 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.326,"smiles":null,"spectrum_id":"CCMSLIB00017293475","spectrum_index":39680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,3,5-Pentamethyl-1,2,3,8-tetrahydro-7H-pyrrolo[3,2-g]quinolin-7-one (delta mass: 196.0025 Da; putative annotation: N/A; putative formula: C2H8N6O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.167,"smiles":null,"spectrum_id":"CCMSLIB00017293477","spectrum_index":39681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 302.1256 Da; putative annotation: N/A; putative formula: C10H19N6O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.238,"smiles":null,"spectrum_id":"CCMSLIB00017293480","spectrum_index":39682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 633.4552 Da; putative annotation: N/A; putative formula: C29H55N13O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.49,"smiles":null,"spectrum_id":"CCMSLIB00017293482","spectrum_index":39683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 118.0423 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.123,"smiles":null,"spectrum_id":"CCMSLIB00017293485","spectrum_index":39684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1,9-dihydro-8-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-6H-purin-6-one (delta mass: 28.0273 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.108,"smiles":null,"spectrum_id":"CCMSLIB00017293488","spectrum_index":39685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 44.6306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.696,"smiles":null,"spectrum_id":"CCMSLIB00017293491","spectrum_index":39686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 118.9782 Da; putative annotation: N/A; putative formula: CHN3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.034,"smiles":null,"spectrum_id":"CCMSLIB00017293493","spectrum_index":39687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-3-pyridinol (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.086,"smiles":null,"spectrum_id":"CCMSLIB00017293495","spectrum_index":39688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 294.2535 Da; putative annotation: N/A; putative formula: C15H30N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.324,"smiles":null,"spectrum_id":"CCMSLIB00017293498","spectrum_index":39689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 245.0449 Da; putative annotation: N/A; putative formula: C12H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.178,"smiles":null,"spectrum_id":"CCMSLIB00017293501","spectrum_index":39690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004403 1-hydroxypyrene|pyren-1-ol (delta mass: 78.0142 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.095,"smiles":null,"spectrum_id":"CCMSLIB00017293504","spectrum_index":39691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006044 Indole-3-acetonitrile|2-(1H-indol-3-yl)acetonitrile (delta mass: 46.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.139,"smiles":null,"spectrum_id":"CCMSLIB00017293505","spectrum_index":39692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 221.054 Da; putative annotation: N/A; putative formula: C10H12N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.166,"smiles":null,"spectrum_id":"CCMSLIB00017293508","spectrum_index":39693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 42.0622 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017293509","spectrum_index":39694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 23.035 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.137,"smiles":null,"spectrum_id":"CCMSLIB00017293512","spectrum_index":39695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 179.0795 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.181,"smiles":null,"spectrum_id":"CCMSLIB00017293515","spectrum_index":39696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 154.8826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.979,"smiles":null,"spectrum_id":"CCMSLIB00017293516","spectrum_index":39697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 68.0261 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.123,"smiles":null,"spectrum_id":"CCMSLIB00017293519","spectrum_index":39698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine (delta mass: 84.0298 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.179,"smiles":null,"spectrum_id":"CCMSLIB00017293522","spectrum_index":39699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 34.0893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.17,"smiles":null,"spectrum_id":"CCMSLIB00017293525","spectrum_index":39700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 217.1311 Da; putative annotation: N/A; putative formula: C10H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.196,"smiles":null,"spectrum_id":"CCMSLIB00017293526","spectrum_index":39701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 513.3292 Da; putative annotation: N/A; putative formula: C32H43N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.4,"smiles":null,"spectrum_id":"CCMSLIB00017293529","spectrum_index":39702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 42.082 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.142,"smiles":null,"spectrum_id":"CCMSLIB00017293532","spectrum_index":39703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 501.6846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.771,"smiles":null,"spectrum_id":"CCMSLIB00017293535","spectrum_index":39704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 76.016 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017293536","spectrum_index":39705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 43.0499 Da; putative annotation: N/A; putative formula: CH5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.111,"smiles":null,"spectrum_id":"CCMSLIB00017293539","spectrum_index":39706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 22.8088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.89,"smiles":null,"spectrum_id":"CCMSLIB00017293542","spectrum_index":39707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 78.0365 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.139,"smiles":null,"spectrum_id":"CCMSLIB00017293544","spectrum_index":39708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyridylethanol (delta mass: 42.0308 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.107,"smiles":null,"spectrum_id":"CCMSLIB00017293546","spectrum_index":39709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 106.0852 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.172,"smiles":null,"spectrum_id":"CCMSLIB00017293549","spectrum_index":39710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 16.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.217,"smiles":null,"spectrum_id":"CCMSLIB00017293552","spectrum_index":39711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 81.0932 Da; putative annotation: N/A; putative formula: C6H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.283,"smiles":null,"spectrum_id":"CCMSLIB00017293553","spectrum_index":39712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 224.0587 Da; putative annotation: N/A; putative formula: C6H16N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.113,"smiles":null,"spectrum_id":"CCMSLIB00017293556","spectrum_index":39713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 286.144 Da; putative annotation: N/A; putative formula: C15H28O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.24,"smiles":null,"spectrum_id":"CCMSLIB00017293559","spectrum_index":39714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 30.0 eV (delta mass: 24.0002 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017293560","spectrum_index":39715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-4-yl)acetic acid (delta mass: 37.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.107,"smiles":null,"spectrum_id":"CCMSLIB00017293563","spectrum_index":39716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 249.173 Da; putative annotation: N/A; putative formula: C15H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.297,"smiles":null,"spectrum_id":"CCMSLIB00017293566","spectrum_index":39717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 73.9991 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.064,"smiles":null,"spectrum_id":"CCMSLIB00017293569","spectrum_index":39718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amlexanox (delta mass: 86.044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.147,"smiles":null,"spectrum_id":"CCMSLIB00017293570","spectrum_index":39719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE - 70.0 eV (delta mass: 24.9912 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.042,"smiles":null,"spectrum_id":"CCMSLIB00017293573","spectrum_index":39720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 113.0845 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.197,"smiles":null,"spectrum_id":"CCMSLIB00017293576","spectrum_index":39721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 286.0455 Da; putative annotation: N/A; putative formula: C15H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.116,"smiles":null,"spectrum_id":"CCMSLIB00017293579","spectrum_index":39722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 113.0266 Da; putative annotation: N/A; putative formula: C8H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.15,"smiles":null,"spectrum_id":"CCMSLIB00017293580","spectrum_index":39723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 290.0939 Da; putative annotation: N/A; putative formula: C11H18N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.243,"smiles":null,"spectrum_id":"CCMSLIB00017293583","spectrum_index":39724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of sinomenine (delta mass: 192.0644 Da; putative annotation: N/A; putative formula: C8H16OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.234,"smiles":null,"spectrum_id":"CCMSLIB00017293586","spectrum_index":39725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 144.0416 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.154,"smiles":null,"spectrum_id":"CCMSLIB00017293587","spectrum_index":39726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 174.1257 Da; putative annotation: N/A; putative formula: C9H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.233,"smiles":null,"spectrum_id":"CCMSLIB00017293590","spectrum_index":39727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE\"\" (delta mass: 67.0713 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.173,"smiles":null,"spectrum_id":"CCMSLIB00017293593","spectrum_index":39728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 160.07 Da; putative annotation: N/A; putative formula: C3H8N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.165,"smiles":null,"spectrum_id":"CCMSLIB00017293594","spectrum_index":39729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 300.1899 Da; putative annotation: N/A; putative formula: C14H29N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.25,"smiles":null,"spectrum_id":"CCMSLIB00017293597","spectrum_index":39730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 105.1199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.212,"smiles":null,"spectrum_id":"CCMSLIB00017293598","spectrum_index":39731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 33.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017293601","spectrum_index":39732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxycamptothecin CollisionEnergy:102040 (delta mass: 182.0697 Da; putative annotation: N/A; putative formula: C8H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.183,"smiles":null,"spectrum_id":"CCMSLIB00017293604","spectrum_index":39733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 647.3731 Da; putative annotation: N/A; putative formula: C34H49N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":836.522,"smiles":null,"spectrum_id":"CCMSLIB00017293606","spectrum_index":39734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 137.157 Da; putative annotation: N/A; putative formula: C10H19NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.337,"smiles":null,"spectrum_id":"CCMSLIB00017293609","spectrum_index":39735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017293612","spectrum_index":39736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-ALANINE (delta mass: 42.0222 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.077,"smiles":null,"spectrum_id":"CCMSLIB00017293614","spectrum_index":39737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucitol (delta mass: 98.0727 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.164,"smiles":null,"spectrum_id":"CCMSLIB00017293617","spectrum_index":39738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 50.9955 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.092,"smiles":null,"spectrum_id":"CCMSLIB00017293619","spectrum_index":39739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin D (delta mass: 64.0347 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.22,"smiles":null,"spectrum_id":"CCMSLIB00017293622","spectrum_index":39740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 23.8927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.0,"smiles":null,"spectrum_id":"CCMSLIB00017293625","spectrum_index":39741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 151.0999 Da; putative annotation: N/A; putative formula: C9H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.176,"smiles":null,"spectrum_id":"CCMSLIB00017293627","spectrum_index":39742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 306.1589 Da; putative annotation: N/A; putative formula: C17H26N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.24,"smiles":null,"spectrum_id":"CCMSLIB00017293629","spectrum_index":39743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 162.0679 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017293632","spectrum_index":39744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 18.0713 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.184,"smiles":null,"spectrum_id":"CCMSLIB00017293635","spectrum_index":39745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 76.0669 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017293637","spectrum_index":39746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of aminoadipic-acid-C4:0 (delta mass: 45.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.175,"smiles":null,"spectrum_id":"CCMSLIB00017293639","spectrum_index":39747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 121.0784 Da; putative annotation: N/A; putative formula: C5H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.084,"smiles":null,"spectrum_id":"CCMSLIB00017293642","spectrum_index":39748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 137.061 Da; putative annotation: N/A; putative formula: C11H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.2,"smiles":null,"spectrum_id":"CCMSLIB00017293645","spectrum_index":39749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 256.1463 Da; putative annotation: N/A; putative formula: C17H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.338,"smiles":null,"spectrum_id":"CCMSLIB00017293646","spectrum_index":39750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 763.5818 Da; putative annotation: N/A; putative formula: C42H77N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.642,"smiles":null,"spectrum_id":"CCMSLIB00017293649","spectrum_index":39751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 895.6199 Da; putative annotation: N/A; putative formula: C55H77N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1058.68,"smiles":null,"spectrum_id":"CCMSLIB00017293652","spectrum_index":39752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indazole-3-carboxamide, N-[(1S)-1-(aminocarbonyl)-2-methylpropyl]-1-(5-chloropentyl)- (delta mass: 297.1277 Da; putative annotation: N/A; putative formula: C10H24N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.302,"smiles":null,"spectrum_id":"CCMSLIB00017293655","spectrum_index":39753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-ethyl-2,4-dihydroxy-6-methoxyphenyl)butan-1-one (delta mass: 107.0263 Da; putative annotation: N/A; putative formula: CH6N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.154,"smiles":null,"spectrum_id":"CCMSLIB00017293656","spectrum_index":39754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 71.0006 Da; putative annotation: N/A; putative formula: C2HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.082,"smiles":null,"spectrum_id":"CCMSLIB00017293659","spectrum_index":39755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 488.9149 Da; putative annotation: N/A; putative formula: C12H11NO12S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.975,"smiles":null,"spectrum_id":"CCMSLIB00017293662","spectrum_index":39756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 167.131 Da; putative annotation: N/A; putative formula: C10H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.228,"smiles":null,"spectrum_id":"CCMSLIB00017293663","spectrum_index":39757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 525.2803 Da; putative annotation: N/A; putative formula: C25H43N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.317,"smiles":null,"spectrum_id":"CCMSLIB00017293666","spectrum_index":39758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 41.025 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.1,"smiles":null,"spectrum_id":"CCMSLIB00017293669","spectrum_index":39759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 846.9025 Da; putative annotation: N/A; putative formula: C60H114N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1000.99,"smiles":null,"spectrum_id":"CCMSLIB00017293672","spectrum_index":39760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 227.1006 Da; putative annotation: N/A; putative formula: C10H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.171,"smiles":null,"spectrum_id":"CCMSLIB00017293673","spectrum_index":39761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethan CollisionEnergy:102040 (delta mass: 144.0417 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.191,"smiles":null,"spectrum_id":"CCMSLIB00017293676","spectrum_index":39762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.134,"smiles":null,"spectrum_id":"CCMSLIB00017293679","spectrum_index":39763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norhydrocodone (delta mass: 32.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.169,"smiles":null,"spectrum_id":"CCMSLIB00017293680","spectrum_index":39764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 127.0705 Da; putative annotation: N/A; putative formula: CH5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.209,"smiles":null,"spectrum_id":"CCMSLIB00017293683","spectrum_index":39765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 264.1449 Da; putative annotation: N/A; putative formula: C10H16N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.244,"smiles":null,"spectrum_id":"CCMSLIB00017293686","spectrum_index":39766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 166.0584 Da; putative annotation: N/A; putative formula: C5H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.16,"smiles":null,"spectrum_id":"CCMSLIB00017293689","spectrum_index":39767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 109.0464 Da; putative annotation: N/A; putative formula: C6H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.342,"smiles":null,"spectrum_id":"CCMSLIB00017293690","spectrum_index":39768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 371.9975 Da; putative annotation: N/A; putative formula: C14H12O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.105,"smiles":null,"spectrum_id":"CCMSLIB00017293693","spectrum_index":39769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 32.0048 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.086,"smiles":null,"spectrum_id":"CCMSLIB00017293696","spectrum_index":39770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 37.0042 Da; putative annotation: N/A; putative formula: CH-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.086,"smiles":null,"spectrum_id":"CCMSLIB00017293699","spectrum_index":39771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 278.2093 Da; putative annotation: N/A; putative formula: C11H22N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.358,"smiles":null,"spectrum_id":"CCMSLIB00017293700","spectrum_index":39772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 45.0221 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.119,"smiles":null,"spectrum_id":"CCMSLIB00017293703","spectrum_index":39773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 74.0372 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.171,"smiles":null,"spectrum_id":"CCMSLIB00017293706","spectrum_index":39774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 152.0363 Da; putative annotation: N/A; putative formula: C4H5N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.175,"smiles":null,"spectrum_id":"CCMSLIB00017293709","spectrum_index":39775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 311.9495 Da; putative annotation: N/A; putative formula: C14H6N2O-1P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.036,"smiles":null,"spectrum_id":"CCMSLIB00017293710","spectrum_index":39776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reserpic acid (delta mass: 368.1731 Da; putative annotation: N/A; putative formula: C13H28N4O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.38,"smiles":null,"spectrum_id":"CCMSLIB00017293713","spectrum_index":39777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 243.2623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.432,"smiles":null,"spectrum_id":"CCMSLIB00017293716","spectrum_index":39778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 29.9997 Da; putative annotation: N/A; putative formula: CH3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.055,"smiles":null,"spectrum_id":"CCMSLIB00017293719","spectrum_index":39779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 162.0533 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.165,"smiles":null,"spectrum_id":"CCMSLIB00017293720","spectrum_index":39780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 562.2852 Da; putative annotation: N/A; putative formula: C26H49N2O5P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.356,"smiles":null,"spectrum_id":"CCMSLIB00017293723","spectrum_index":39781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-(benzo[d][1,3]dioxol-5-ylmethyl)-2-hydroxy-5-oxo-4,5-dihydro-1H-imidazol-4-yl)-N-((1-methyl-1H-pyrrol-2-yl)methyl)acetamide (delta mass: 45.0505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.201,"smiles":null,"spectrum_id":"CCMSLIB00017293726","spectrum_index":39782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 633.3927 Da; putative annotation: N/A; putative formula: C33H55N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.541,"smiles":null,"spectrum_id":"CCMSLIB00017293729","spectrum_index":39783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 84.0208 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.149,"smiles":null,"spectrum_id":"CCMSLIB00017293730","spectrum_index":39784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 90.0526 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.217,"smiles":null,"spectrum_id":"CCMSLIB00017293733","spectrum_index":39785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 104.0482 Da; putative annotation: N/A; putative formula: C5H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.129,"smiles":null,"spectrum_id":"CCMSLIB00017293736","spectrum_index":39786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 231.122 Da; putative annotation: N/A; putative formula: C9H17N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.245,"smiles":null,"spectrum_id":"CCMSLIB00017293738","spectrum_index":39787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(4-Chlorophenyl)-5-nitro-2-piperidinone (delta mass: 42.001 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.054,"smiles":null,"spectrum_id":"CCMSLIB00017293740","spectrum_index":39788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 69.0581 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017293743","spectrum_index":39789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 68.062 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017293746","spectrum_index":39790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 50.0412 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.18,"smiles":null,"spectrum_id":"CCMSLIB00017293748","spectrum_index":39791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 28.354 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.457,"smiles":null,"spectrum_id":"CCMSLIB00017293750","spectrum_index":39792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 100.0412 Da; putative annotation: N/A; putative formula: C7H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.159,"smiles":null,"spectrum_id":"CCMSLIB00017293753","spectrum_index":39793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydromorphone (delta mass: 3.3562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.5,"smiles":null,"spectrum_id":"CCMSLIB00017293756","spectrum_index":39794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 68.0731 Da; putative annotation: N/A; putative formula: C4H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.17,"smiles":null,"spectrum_id":"CCMSLIB00017293758","spectrum_index":39795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 813.6191 Da; putative annotation: N/A; putative formula: C52H83N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1002.77,"smiles":null,"spectrum_id":"CCMSLIB00017293760","spectrum_index":39796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 26.9485 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":110.009,"smiles":null,"spectrum_id":"CCMSLIB00017293763","spectrum_index":39797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 111.146 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.233,"smiles":null,"spectrum_id":"CCMSLIB00017293766","spectrum_index":39798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Roccellaric acid (delta mass: 68.0614 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.314,"smiles":null,"spectrum_id":"CCMSLIB00017293769","spectrum_index":39799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 16.0555 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017293770","spectrum_index":39800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 186.1007 Da; putative annotation: N/A; putative formula: C8H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.214,"smiles":null,"spectrum_id":"CCMSLIB00017293773","spectrum_index":39801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 118.1359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.264,"smiles":null,"spectrum_id":"CCMSLIB00017293776","spectrum_index":39802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 84.0091 Da; putative annotation: N/A; putative formula: CN4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017293777","spectrum_index":39803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 207.1262 Da; putative annotation: N/A; putative formula: C12H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.207,"smiles":null,"spectrum_id":"CCMSLIB00017293780","spectrum_index":39804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.159,"smiles":null,"spectrum_id":"CCMSLIB00017293783","spectrum_index":39805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 158.1455 Da; putative annotation: N/A; putative formula: C13H18O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.57,"smiles":null,"spectrum_id":"CCMSLIB00017293785","spectrum_index":39806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:205060 (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017293787","spectrum_index":39807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 76.0426 Da; putative annotation: N/A; putative formula: C5H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.129,"smiles":null,"spectrum_id":"CCMSLIB00017293790","spectrum_index":39808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 211.0761 Da; putative annotation: N/A; putative formula: C10H14NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.162,"smiles":null,"spectrum_id":"CCMSLIB00017293793","spectrum_index":39809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 99.0686 Da; putative annotation: Isovaline; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.16,"smiles":null,"spectrum_id":"CCMSLIB00017293796","spectrum_index":39810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 132.094 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.227,"smiles":null,"spectrum_id":"CCMSLIB00017293797","spectrum_index":39811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 129.0425 Da; putative annotation: L-(+)-Glutamic acid - 30.0 eV; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.134,"smiles":null,"spectrum_id":"CCMSLIB00017293800","spectrum_index":39812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 264.2456 Da; putative annotation: trans-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.316,"smiles":null,"spectrum_id":"CCMSLIB00017293803","spectrum_index":39813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 238.2302 Da; putative annotation: 14-Methylpentadecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.29,"smiles":null,"spectrum_id":"CCMSLIB00017293806","spectrum_index":39814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 172.0835 Da; putative annotation: Ala-Thr; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.165,"smiles":null,"spectrum_id":"CCMSLIB00017293807","spectrum_index":39815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 180.0802 Da; putative annotation: Modiolide A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.151,"smiles":null,"spectrum_id":"CCMSLIB00017293810","spectrum_index":39816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 195.0414 Da; putative annotation: Baclofen; putative formula: C10H10ClNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.138,"smiles":null,"spectrum_id":"CCMSLIB00017293813","spectrum_index":39817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 115.0637 Da; putative annotation: (1S,2S,3R,4R)-4-Amino-1,2,3-cyclopentanetriol; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.124,"smiles":null,"spectrum_id":"CCMSLIB00017293816","spectrum_index":39818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 308.1737 Da; putative annotation: 13-cis-Acitretin; putative formula: C21H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.233,"smiles":null,"spectrum_id":"CCMSLIB00017293818","spectrum_index":39819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 48.0322 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017293820","spectrum_index":39820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 314.09 Da; putative annotation: N/A; putative formula: C16H14N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.166,"smiles":null,"spectrum_id":"CCMSLIB00017293823","spectrum_index":39821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 54.9483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.987,"smiles":null,"spectrum_id":"CCMSLIB00017293826","spectrum_index":39822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 366.2501 Da; putative annotation: N/A; putative formula: C24H34N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.32,"smiles":null,"spectrum_id":"CCMSLIB00017293829","spectrum_index":39823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 62.0397 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.174,"smiles":null,"spectrum_id":"CCMSLIB00017293832","spectrum_index":39824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 98.0447 Da; putative annotation: N/A; putative formula: H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.147,"smiles":null,"spectrum_id":"CCMSLIB00017293834","spectrum_index":39825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 103.0447 Da; putative annotation: N/A; putative formula: C4H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.24,"smiles":null,"spectrum_id":"CCMSLIB00017293836","spectrum_index":39826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 64.0689 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.238,"smiles":null,"spectrum_id":"CCMSLIB00017293839","spectrum_index":39827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 77.0838 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.165,"smiles":null,"spectrum_id":"CCMSLIB00017293842","spectrum_index":39828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 14.9983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.063,"smiles":null,"spectrum_id":"CCMSLIB00017293843","spectrum_index":39829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 254.0399 Da; putative annotation: N/A; putative formula: C7H6N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.079,"smiles":null,"spectrum_id":"CCMSLIB00017293846","spectrum_index":39830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017293849","spectrum_index":39831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTITOL (delta mass: 10.044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.13,"smiles":null,"spectrum_id":"CCMSLIB00017293852","spectrum_index":39832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 135.1037 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.19,"smiles":null,"spectrum_id":"CCMSLIB00017293853","spectrum_index":39833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.129,"smiles":null,"spectrum_id":"CCMSLIB00017293856","spectrum_index":39834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-pyrazol-4-yl)-1H-benzimidazole (delta mass: 18.0456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.143,"smiles":null,"spectrum_id":"CCMSLIB00017293859","spectrum_index":39835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 720.3709 Da; putative annotation: N/A; putative formula: C43H52N4O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":927.457,"smiles":null,"spectrum_id":"CCMSLIB00017293862","spectrum_index":39836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, 2-[2-(aminooxy)acetyl]hydrazide, (3aS,4S,6aR)- (delta mass: 17.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.202,"smiles":null,"spectrum_id":"CCMSLIB00017293863","spectrum_index":39837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 138.0414 Da; putative annotation: N/A; putative formula: C2H2N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.118,"smiles":null,"spectrum_id":"CCMSLIB00017293866","spectrum_index":39838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloropropyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 46.9936 Da; putative annotation: N/A; putative formula: H2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.057,"smiles":null,"spectrum_id":"CCMSLIB00017293869","spectrum_index":39839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+/-)-Synephrine (delta mass: 54.0114 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017293871","spectrum_index":39840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 101.061 Da; putative annotation: N/A; putative formula: C8H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.128,"smiles":null,"spectrum_id":"CCMSLIB00017293873","spectrum_index":39841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 124.042 Da; putative annotation: N/A; putative formula: C9H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.118,"smiles":null,"spectrum_id":"CCMSLIB00017293876","spectrum_index":39842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 364.0984 Da; putative annotation: N/A; putative formula: C11H20N6O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.222,"smiles":null,"spectrum_id":"CCMSLIB00017293879","spectrum_index":39843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 211.0677 Da; putative annotation: N/A; putative formula: C3H5N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.217,"smiles":null,"spectrum_id":"CCMSLIB00017293881","spectrum_index":39844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 74.044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.151,"smiles":null,"spectrum_id":"CCMSLIB00017293884","spectrum_index":39845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 164.043 Da; putative annotation: N/A; putative formula: C4H8N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.07,"smiles":null,"spectrum_id":"CCMSLIB00017293887","spectrum_index":39846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 95.0503 Da; putative annotation: N/A; putative formula: C4H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.147,"smiles":null,"spectrum_id":"CCMSLIB00017293889","spectrum_index":39847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 277.3137 Da; putative annotation: N/A; putative formula: C20H39NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.4,"smiles":null,"spectrum_id":"CCMSLIB00017293891","spectrum_index":39848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 65.1945 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.259,"smiles":null,"spectrum_id":"CCMSLIB00017293894","spectrum_index":39849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 455.2728 Da; putative annotation: N/A; putative formula: C33H33N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.421,"smiles":null,"spectrum_id":"CCMSLIB00017293897","spectrum_index":39850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 86.037 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.238,"smiles":null,"spectrum_id":"CCMSLIB00017293899","spectrum_index":39851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 144.0371 Da; putative annotation: N/A; putative formula: C5H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.161,"smiles":null,"spectrum_id":"CCMSLIB00017293901","spectrum_index":39852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 505.1947 Da; putative annotation: N/A; putative formula: C25H31NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.281,"smiles":null,"spectrum_id":"CCMSLIB00017293904","spectrum_index":39853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 483.1793 Da; putative annotation: N/A; putative formula: C28H25N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.302,"smiles":null,"spectrum_id":"CCMSLIB00017293907","spectrum_index":39854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 208.0343 Da; putative annotation: N/A; putative formula: C6H4N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.183,"smiles":null,"spectrum_id":"CCMSLIB00017293909","spectrum_index":39855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 65.9892 Da; putative annotation: N/A; putative formula: C7H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.07,"smiles":null,"spectrum_id":"CCMSLIB00017293911","spectrum_index":39856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_prop_2_en_1_yl__1H_indole_3_carboxylic_acid (delta mass: 381.1679 Da; putative annotation: N/A; putative formula: C23H28NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.254,"smiles":null,"spectrum_id":"CCMSLIB00017293914","spectrum_index":39857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 275.1511 Da; putative annotation: N/A; putative formula: C16H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.305,"smiles":null,"spectrum_id":"CCMSLIB00017293917","spectrum_index":39858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 407.1111 Da; putative annotation: N/A; putative formula: C13H21N5O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.185,"smiles":null,"spectrum_id":"CCMSLIB00017293918","spectrum_index":39859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 507.3405 Da; putative annotation: N/A; putative formula: C25H49NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.411,"smiles":null,"spectrum_id":"CCMSLIB00017293921","spectrum_index":39860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 284.0948 Da; putative annotation: N/A; putative formula: C19H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.144,"smiles":null,"spectrum_id":"CCMSLIB00017293924","spectrum_index":39861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-(1H-indol-3-yl)ethyl)thiourea (delta mass: 176.0858 Da; putative annotation: N/A; putative formula: C10H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.176,"smiles":null,"spectrum_id":"CCMSLIB00017293927","spectrum_index":39862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltose from NIST14 (delta mass: 124.0888 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.212,"smiles":null,"spectrum_id":"CCMSLIB00017293928","spectrum_index":39863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 52.0049 Da; putative annotation: N/A; putative formula: C2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017293931","spectrum_index":39864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 518.3602 Da; putative annotation: N/A; putative formula: C31H50O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.42,"smiles":null,"spectrum_id":"CCMSLIB00017293934","spectrum_index":39865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 480.177 Da; putative annotation: N/A; putative formula: C24H20N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.289,"smiles":null,"spectrum_id":"CCMSLIB00017293936","spectrum_index":39866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 70.8491 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.952,"smiles":null,"spectrum_id":"CCMSLIB00017293939","spectrum_index":39867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 256.1101 Da; putative annotation: N/A; putative formula: C16H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.181,"smiles":null,"spectrum_id":"CCMSLIB00017293942","spectrum_index":39868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 445.1419 Da; putative annotation: N/A; putative formula: C30H24NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.223,"smiles":null,"spectrum_id":"CCMSLIB00017293945","spectrum_index":39869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 500.2441 Da; putative annotation: N/A; putative formula: C27H37N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.367,"smiles":null,"spectrum_id":"CCMSLIB00017293947","spectrum_index":39870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 55.0572 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.133,"smiles":null,"spectrum_id":"CCMSLIB00017293950","spectrum_index":39871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 74.0715 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.12,"smiles":null,"spectrum_id":"CCMSLIB00017293953","spectrum_index":39872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 257.1137 Da; putative annotation: N/A; putative formula: C10H11N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.267,"smiles":null,"spectrum_id":"CCMSLIB00017293955","spectrum_index":39873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 1116.3561 Da; putative annotation: N/A; putative formula: C66H64N6O-1S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1459.48,"smiles":null,"spectrum_id":"CCMSLIB00017293958","spectrum_index":39874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 97.0726 Da; putative annotation: N/A; putative formula: C3H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.153,"smiles":null,"spectrum_id":"CCMSLIB00017293961","spectrum_index":39875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 191.0794 Da; putative annotation: N/A; putative formula: C7H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.15,"smiles":null,"spectrum_id":"CCMSLIB00017293964","spectrum_index":39876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 181.4493 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.52,"smiles":null,"spectrum_id":"CCMSLIB00017293965","spectrum_index":39877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydromorphone (delta mass: 311.1552 Da; putative annotation: N/A; putative formula: C18H22N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.299,"smiles":null,"spectrum_id":"CCMSLIB00017293968","spectrum_index":39878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 176.1062 Da; putative annotation: N/A; putative formula: C9H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.177,"smiles":null,"spectrum_id":"CCMSLIB00017293971","spectrum_index":39879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 26.1511 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.223,"smiles":null,"spectrum_id":"CCMSLIB00017293973","spectrum_index":39880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 105.0883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.164,"smiles":null,"spectrum_id":"CCMSLIB00017293975","spectrum_index":39881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one (delta mass: 71.0336 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.11,"smiles":null,"spectrum_id":"CCMSLIB00017293978","spectrum_index":39882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinemethanol (delta mass: 79.0866 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.147,"smiles":null,"spectrum_id":"CCMSLIB00017293981","spectrum_index":39883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 51.9948 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.071,"smiles":null,"spectrum_id":"CCMSLIB00017293983","spectrum_index":39884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine (delta mass: 129.4042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.5,"smiles":null,"spectrum_id":"CCMSLIB00017293985","spectrum_index":39885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 377.2696 Da; putative annotation: N/A; putative formula: C19H40NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.346,"smiles":null,"spectrum_id":"CCMSLIB00017293988","spectrum_index":39886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 322.1913 Da; putative annotation: N/A; putative formula: C15H31O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.288,"smiles":null,"spectrum_id":"CCMSLIB00017293991","spectrum_index":39887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 138.0768 Da; putative annotation: N/A; putative formula: C3H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.154,"smiles":null,"spectrum_id":"CCMSLIB00017293993","spectrum_index":39888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.128,"smiles":null,"spectrum_id":"CCMSLIB00017293995","spectrum_index":39889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 46.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017293998","spectrum_index":39890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine; AIF; CE0; MS2Dec (delta mass: 349.1539 Da; putative annotation: N/A; putative formula: C19H19N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.25,"smiles":null,"spectrum_id":"CCMSLIB00017294001","spectrum_index":39891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 40.0403 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.148,"smiles":null,"spectrum_id":"CCMSLIB00017294003","spectrum_index":39892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 52.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.087,"smiles":null,"spectrum_id":"CCMSLIB00017294005","spectrum_index":39893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 384.0311 Da; putative annotation: N/A; putative formula: C12H12N6O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.155,"smiles":null,"spectrum_id":"CCMSLIB00017294008","spectrum_index":39894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 210.0532 Da; putative annotation: N/A; putative formula: C10H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.124,"smiles":null,"spectrum_id":"CCMSLIB00017294011","spectrum_index":39895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 42.039 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.105,"smiles":null,"spectrum_id":"CCMSLIB00017294014","spectrum_index":39896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 46.0634 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017294016","spectrum_index":39897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 509.2331 Da; putative annotation: N/A; putative formula: C29H36NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.408,"smiles":null,"spectrum_id":"CCMSLIB00017294018","spectrum_index":39898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 71.5272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.65,"smiles":null,"spectrum_id":"CCMSLIB00017294021","spectrum_index":39899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 462.3695 Da; putative annotation: N/A; putative formula: C23H51N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.456,"smiles":null,"spectrum_id":"CCMSLIB00017294024","spectrum_index":39900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 164.0463 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.18,"smiles":null,"spectrum_id":"CCMSLIB00017294026","spectrum_index":39901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 16.0488 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.16,"smiles":null,"spectrum_id":"CCMSLIB00017294028","spectrum_index":39902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 501.2471 Da; putative annotation: N/A; putative formula: C26H35N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.433,"smiles":null,"spectrum_id":"CCMSLIB00017294031","spectrum_index":39903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 133.6218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.867,"smiles":null,"spectrum_id":"CCMSLIB00017294034","spectrum_index":39904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 214.961 Da; putative annotation: N/A; putative formula: H3N5O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.105,"smiles":null,"spectrum_id":"CCMSLIB00017294036","spectrum_index":39905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 353.683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.76,"smiles":null,"spectrum_id":"CCMSLIB00017294038","spectrum_index":39906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 87.0417 Da; putative annotation: N/A; putative formula: C2H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.128,"smiles":null,"spectrum_id":"CCMSLIB00017294041","spectrum_index":39907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 57.0199 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.116,"smiles":null,"spectrum_id":"CCMSLIB00017294043","spectrum_index":39908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 165.075 Da; putative annotation: N/A; putative formula: C4H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.13,"smiles":null,"spectrum_id":"CCMSLIB00017294046","spectrum_index":39909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 17.0858 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.14,"smiles":null,"spectrum_id":"CCMSLIB00017294049","spectrum_index":39910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 84.9989 Da; putative annotation: N/A; putative formula: C3H3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.038,"smiles":null,"spectrum_id":"CCMSLIB00017294052","spectrum_index":39911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Didodecyl 3,3'-thiodipropionate oxide from NIST14 - Hydroxylated variant ? (delta mass: 73.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.497,"smiles":null,"spectrum_id":"CCMSLIB00017294054","spectrum_index":39912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine (delta mass: 151.0629 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.175,"smiles":null,"spectrum_id":"CCMSLIB00017294056","spectrum_index":39913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (delta mass: 242.0097 Da; putative annotation: N/A; putative formula: C10H14O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.154,"smiles":null,"spectrum_id":"CCMSLIB00017294059","spectrum_index":39914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 148.0754 Da; putative annotation: N/A; putative formula: C7H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.147,"smiles":null,"spectrum_id":"CCMSLIB00017294062","spectrum_index":39915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 458.2707 Da; putative annotation: N/A; putative formula: C25H46OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.394,"smiles":null,"spectrum_id":"CCMSLIB00017294064","spectrum_index":39916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 188.0314 Da; putative annotation: N/A; putative formula: C11H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.112,"smiles":null,"spectrum_id":"CCMSLIB00017294066","spectrum_index":39917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 180.0782 Da; putative annotation: N/A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.175,"smiles":null,"spectrum_id":"CCMSLIB00017294069","spectrum_index":39918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 1016.3533 Da; putative annotation: N/A; putative formula: C48H60N10O7S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1238.45,"smiles":null,"spectrum_id":"CCMSLIB00017294072","spectrum_index":39919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 1018.3274 Da; putative annotation: N/A; putative formula: C70H46N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1240.42,"smiles":null,"spectrum_id":"CCMSLIB00017294075","spectrum_index":39920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 490.2197 Da; putative annotation: N/A; putative formula: C20H35N4O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.29,"smiles":null,"spectrum_id":"CCMSLIB00017294076","spectrum_index":39921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 55.0422 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.102,"smiles":null,"spectrum_id":"CCMSLIB00017294079","spectrum_index":39922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 82.005 Da; putative annotation: N/A; putative formula: C4H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.076,"smiles":null,"spectrum_id":"CCMSLIB00017294082","spectrum_index":39923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 776.4521 Da; putative annotation: N/A; putative formula: C48H64N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.523,"smiles":null,"spectrum_id":"CCMSLIB00017294085","spectrum_index":39924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 69.0541 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.114,"smiles":null,"spectrum_id":"CCMSLIB00017294087","spectrum_index":39925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 329.1263 Da; putative annotation: N/A; putative formula: C18H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.223,"smiles":null,"spectrum_id":"CCMSLIB00017294089","spectrum_index":39926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 158.0578 Da; putative annotation: N/A; putative formula: C7H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017294092","spectrum_index":39927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 88.0157 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.102,"smiles":null,"spectrum_id":"CCMSLIB00017294095","spectrum_index":39928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 182.1145 Da; putative annotation: N/A; putative formula: C4H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.211,"smiles":null,"spectrum_id":"CCMSLIB00017294097","spectrum_index":39929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 2.024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.04,"smiles":null,"spectrum_id":"CCMSLIB00017294101","spectrum_index":39930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 30.0 eV (delta mass: 129.0465 Da; putative annotation: N/A; putative formula: C3H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.185,"smiles":null,"spectrum_id":"CCMSLIB00017294102","spectrum_index":39931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 131.971 Da; putative annotation: N/A; putative formula: C4H6O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.048,"smiles":null,"spectrum_id":"CCMSLIB00017294105","spectrum_index":39932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 131.0584 Da; putative annotation: N/A; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.134,"smiles":null,"spectrum_id":"CCMSLIB00017294108","spectrum_index":39933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 250.0627 Da; putative annotation: N/A; putative formula: C8H14N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.138,"smiles":null,"spectrum_id":"CCMSLIB00017294111","spectrum_index":39934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 510.1581 Da; putative annotation: N/A; putative formula: C26H30N4OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.218,"smiles":null,"spectrum_id":"CCMSLIB00017294113","spectrum_index":39935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 144.0405 Da; putative annotation: N/A; putative formula: C10H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.19,"smiles":null,"spectrum_id":"CCMSLIB00017294115","spectrum_index":39936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 395.5524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.639,"smiles":null,"spectrum_id":"CCMSLIB00017294118","spectrum_index":39937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 343.1478 Da; putative annotation: N/A; putative formula: C12H25NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.255,"smiles":null,"spectrum_id":"CCMSLIB00017294121","spectrum_index":39938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid (delta mass: 56.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.09,"smiles":null,"spectrum_id":"CCMSLIB00017294123","spectrum_index":39939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Lys (delta mass: 99.0682 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.234,"smiles":null,"spectrum_id":"CCMSLIB00017294125","spectrum_index":39940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 88.0161 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.066,"smiles":null,"spectrum_id":"CCMSLIB00017294128","spectrum_index":39941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 128.0216 Da; putative annotation: N/A; putative formula: C6H9O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.175,"smiles":null,"spectrum_id":"CCMSLIB00017294131","spectrum_index":39942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 88.0678 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017294132","spectrum_index":39943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 228.1626 Da; putative annotation: N/A; putative formula: C15H20N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.254,"smiles":null,"spectrum_id":"CCMSLIB00017294135","spectrum_index":39944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 749.5599 Da; putative annotation: N/A; putative formula: C47H75NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.62,"smiles":null,"spectrum_id":"CCMSLIB00017294138","spectrum_index":39945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 260.2138 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.274,"smiles":null,"spectrum_id":"CCMSLIB00017294139","spectrum_index":39946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 330.2769 Da; putative annotation: N/A; putative formula: C19H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.316,"smiles":null,"spectrum_id":"CCMSLIB00017294142","spectrum_index":39947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 10.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.092,"smiles":null,"spectrum_id":"CCMSLIB00017294145","spectrum_index":39948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paprotrain (delta mass: 193.034 Da; putative annotation: N/A; putative formula: C6H14NP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.137,"smiles":null,"spectrum_id":"CCMSLIB00017294148","spectrum_index":39949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 504.3305 Da; putative annotation: N/A; putative formula: C37H45O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.558,"smiles":null,"spectrum_id":"CCMSLIB00017294149","spectrum_index":39950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 4.0513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017294152","spectrum_index":39951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 748.4405 Da; putative annotation: N/A; putative formula: C52H61O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.553,"smiles":null,"spectrum_id":"CCMSLIB00017294155","spectrum_index":39952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 90.0469 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.149,"smiles":null,"spectrum_id":"CCMSLIB00017294158","spectrum_index":39953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7H-Pyrrolo[2,3-g]benzothiazol-7-one, 6,8-dihydro-8-(1H-imidazol-5-ylmethylene)- (delta mass: 46.0011 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.05,"smiles":null,"spectrum_id":"CCMSLIB00017294161","spectrum_index":39954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-[4-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triaz ol-3-ylthio]acetamide CollisionEnergy:205060\"\" (delta mass: 422.1138 Da; putative annotation: N/A; putative formula: C21H27O3PS2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":867.231,"smiles":null,"spectrum_id":"CCMSLIB00017294164","spectrum_index":39955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-2-amine, 4,5-dihydro-N-[4-[[4-(1-methylethoxy)phenyl]methyl]phenyl]- (delta mass: 28.0202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.212,"smiles":null,"spectrum_id":"CCMSLIB00017294167","spectrum_index":39956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 144.112 Da; putative annotation: N/A; putative formula: C4H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.123,"smiles":null,"spectrum_id":"CCMSLIB00017294170","spectrum_index":39957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 158.1883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.264,"smiles":null,"spectrum_id":"CCMSLIB00017294172","spectrum_index":39958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 215.1186 Da; putative annotation: N/A; putative formula: C9H18N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.215,"smiles":null,"spectrum_id":"CCMSLIB00017294175","spectrum_index":39959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 82.0531 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.156,"smiles":null,"spectrum_id":"CCMSLIB00017294178","spectrum_index":39960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 144.042 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.146,"smiles":null,"spectrum_id":"CCMSLIB00017294181","spectrum_index":39961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid; LC-tDDA; CE30 (delta mass: 97.0637 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.103,"smiles":null,"spectrum_id":"CCMSLIB00017294183","spectrum_index":39962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 163.0481 Da; putative annotation: N/A; putative formula: C5H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.113,"smiles":null,"spectrum_id":"CCMSLIB00017294185","spectrum_index":39963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 312.0759 Da; putative annotation: N/A; putative formula: C17H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.224,"smiles":null,"spectrum_id":"CCMSLIB00017294188","spectrum_index":39964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084605 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 60.0688 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017294191","spectrum_index":39965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 230.1625 Da; putative annotation: N/A; putative formula: C13H27O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.317,"smiles":null,"spectrum_id":"CCMSLIB00017294194","spectrum_index":39966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 69.1008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.196,"smiles":null,"spectrum_id":"CCMSLIB00017294196","spectrum_index":39967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNFP III (delta mass: 186.0523 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1040.37,"smiles":null,"spectrum_id":"CCMSLIB00017294199","spectrum_index":39968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 156.0936 Da; putative annotation: N/A; putative formula: C12H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.164,"smiles":null,"spectrum_id":"CCMSLIB00017294202","spectrum_index":39969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 40.0313 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.102,"smiles":null,"spectrum_id":"CCMSLIB00017294205","spectrum_index":39970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 86.0347 Da; putative annotation: N/A; putative formula: H2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.132,"smiles":null,"spectrum_id":"CCMSLIB00017294208","spectrum_index":39971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4'-O-.beta.-D-Glucosyl-5-O-methylvisamminol (delta mass: 144.0411 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.217,"smiles":null,"spectrum_id":"CCMSLIB00017294211","spectrum_index":39972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 319.311 Da; putative annotation: N/A; putative formula: C19H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.402,"smiles":null,"spectrum_id":"CCMSLIB00017294213","spectrum_index":39973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 45.9689 Da; putative annotation: N/A; putative formula: H-2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.029,"smiles":null,"spectrum_id":"CCMSLIB00017294216","spectrum_index":39974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 577.2591 Da; putative annotation: N/A; putative formula: C36H31N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.319,"smiles":null,"spectrum_id":"CCMSLIB00017294219","spectrum_index":39975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 162.2517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.31,"smiles":null,"spectrum_id":"CCMSLIB00017294222","spectrum_index":39976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 118.0744 Da; putative annotation: N/A; putative formula: C4H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017294224","spectrum_index":39977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 287.4953 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.555,"smiles":null,"spectrum_id":"CCMSLIB00017294227","spectrum_index":39978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 168.0039 Da; putative annotation: N/A; putative formula: C11H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.046,"smiles":null,"spectrum_id":"CCMSLIB00017294229","spectrum_index":39979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 13.0784 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.154,"smiles":null,"spectrum_id":"CCMSLIB00017294232","spectrum_index":39980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 214.1565 Da; putative annotation: N/A; putative formula: C12H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.305,"smiles":null,"spectrum_id":"CCMSLIB00017294235","spectrum_index":39981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lofemizole (delta mass: 12.4473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017294237","spectrum_index":39982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 53.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.197,"smiles":null,"spectrum_id":"CCMSLIB00017294239","spectrum_index":39983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 40.0316 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017294242","spectrum_index":39984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 125.0476 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017294245","spectrum_index":39985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 258.2358 Da; putative annotation: N/A; putative formula: C19H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.328,"smiles":null,"spectrum_id":"CCMSLIB00017294248","spectrum_index":39986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yersiniabactin (delta mass: 276.039 Da; putative annotation: N/A; putative formula: C4H14N4O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.163,"smiles":null,"spectrum_id":"CCMSLIB00017294251","spectrum_index":39987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 695.3813 Da; putative annotation: N/A; putative formula: C25H41N23O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.44,"smiles":null,"spectrum_id":"CCMSLIB00017294254","spectrum_index":39988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR302351 3,4-Dimethoxycinnamic acid (delta mass: 27.0098 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.091,"smiles":null,"spectrum_id":"CCMSLIB00017294257","spectrum_index":39989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 148.0522 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.128,"smiles":null,"spectrum_id":"CCMSLIB00017294260","spectrum_index":39990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid CollisionEnergy:205060 (delta mass: 57.025 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.127,"smiles":null,"spectrum_id":"CCMSLIB00017294263","spectrum_index":39991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 262.157 Da; putative annotation: N/A; putative formula: C16H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.281,"smiles":null,"spectrum_id":"CCMSLIB00017294266","spectrum_index":39992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 67.9893 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.065,"smiles":null,"spectrum_id":"CCMSLIB00017294270","spectrum_index":39993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 267.0892 Da; putative annotation: 2-(3,4-Dimethoxyphenyl)-2,3-dihydro-4H-1,3-benzoxazin-4-one; putative formula: C16H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.16,"smiles":null,"spectrum_id":"CCMSLIB00017294271","spectrum_index":39994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 85.0528 Da; putative annotation: Massbank:PR100220 gamma-Amino-n-butyric acid|GABA|4-Aminobutyric acid|4-Aminobutylate|4-Aminobutanoic acid|Piperidic acid|Piperidinic acid|Aminalon; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017294274","spectrum_index":39995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 203.0786 Da; putative annotation: N-Acetyl-D-glucosamine; putative formula: C8H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.176,"smiles":null,"spectrum_id":"CCMSLIB00017294277","spectrum_index":39996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 120.0577 Da; putative annotation: 2,3-Dimethylhydroquinone; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017294280","spectrum_index":39997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 228.1103 Da; putative annotation: Leu-Asp; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.26,"smiles":null,"spectrum_id":"CCMSLIB00017294283","spectrum_index":39998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 228.1148 Da; putative annotation: Asp-Leu; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017294286","spectrum_index":39999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 187.0642 Da; putative annotation: Indolelactic acid; AIF; CE0; MS2Dec; putative formula: C11H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.14,"smiles":null,"spectrum_id":"CCMSLIB00017294289","spectrum_index":40000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 164.0465 Da; putative annotation: Massbank:RP029402 DL-4-Hydroxyphenyllactic acid|2-hydroxy-2-(4-hydroxyphenyl)propanoic acid; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.086,"smiles":null,"spectrum_id":"CCMSLIB00017294292","spectrum_index":40001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 143.0584 Da; putative annotation: Acetyl-L-threonine; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017294295","spectrum_index":40002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 148.0715 Da; putative annotation: L-Fucitol; putative formula: C6H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.142,"smiles":null,"spectrum_id":"CCMSLIB00017294298","spectrum_index":40003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 190.1358 Da; putative annotation: 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.259,"smiles":null,"spectrum_id":"CCMSLIB00017294301","spectrum_index":40004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 80.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.364,"smiles":null,"spectrum_id":"CCMSLIB00017294303","spectrum_index":40005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 130.0741 Da; putative annotation: N/A; putative formula: C5H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.15,"smiles":null,"spectrum_id":"CCMSLIB00017294306","spectrum_index":40006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 307.254 Da; putative annotation: N/A; putative formula: C18H34N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.34,"smiles":null,"spectrum_id":"CCMSLIB00017294309","spectrum_index":40007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 71.0724 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.196,"smiles":null,"spectrum_id":"CCMSLIB00017294312","spectrum_index":40008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 90.0832 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.326,"smiles":null,"spectrum_id":"CCMSLIB00017294313","spectrum_index":40009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 875.3641 Da; putative annotation: N/A; putative formula: C60H50N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1056.43,"smiles":null,"spectrum_id":"CCMSLIB00017294316","spectrum_index":40010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 356.0947 Da; putative annotation: N/A; putative formula: C25H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.186,"smiles":null,"spectrum_id":"CCMSLIB00017294319","spectrum_index":40011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylserotonin (delta mass: 197.1147 Da; putative annotation: N/A; putative formula: C5H11N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.228,"smiles":null,"spectrum_id":"CCMSLIB00017294322","spectrum_index":40012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 70.0516 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.149,"smiles":null,"spectrum_id":"CCMSLIB00017294325","spectrum_index":40013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 174.1009 Da; putative annotation: N/A; putative formula: C7H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.198,"smiles":null,"spectrum_id":"CCMSLIB00017294327","spectrum_index":40014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 248.0559 Da; putative annotation: N/A; putative formula: C11H4N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.101,"smiles":null,"spectrum_id":"CCMSLIB00017294330","spectrum_index":40015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 837.4532 Da; putative annotation: N/A; putative formula: C37H63N11O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1044.54,"smiles":null,"spectrum_id":"CCMSLIB00017294333","spectrum_index":40016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 260.1221 Da; putative annotation: N/A; putative formula: C10H21N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.187,"smiles":null,"spectrum_id":"CCMSLIB00017294336","spectrum_index":40017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 30.0232 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.146,"smiles":null,"spectrum_id":"CCMSLIB00017294338","spectrum_index":40018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 132.0618 Da; putative annotation: N/A; putative formula: C6H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.227,"smiles":null,"spectrum_id":"CCMSLIB00017294341","spectrum_index":40019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384831-01_C20H16N4O2_4-(1H-Indol-3-ylmethyl)-2H-pyrazino[2,1-b]quinazoline-3,6(1H,4H)-dione (delta mass: 344.1225 Da; putative annotation: N/A; putative formula: C17H21N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.257,"smiles":null,"spectrum_id":"CCMSLIB00017294344","spectrum_index":40020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.103,"smiles":null,"spectrum_id":"CCMSLIB00017294347","spectrum_index":40021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 244.1577 Da; putative annotation: N/A; putative formula: C15H20N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.26,"smiles":null,"spectrum_id":"CCMSLIB00017294350","spectrum_index":40022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 164.1734 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.285,"smiles":null,"spectrum_id":"CCMSLIB00017294353","spectrum_index":40023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 229.0884 Da; putative annotation: N/A; putative formula: C9H15N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.159,"smiles":null,"spectrum_id":"CCMSLIB00017294354","spectrum_index":40024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00347404-02_C15H20O8_4-Acetyl-3-hydroxy-5-methylphenyl beta-D-glucopyranoside (delta mass: 76.0304 Da; putative annotation: N/A; putative formula: H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.154,"smiles":null,"spectrum_id":"CCMSLIB00017294357","spectrum_index":40025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 218.3515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.5,"smiles":null,"spectrum_id":"CCMSLIB00017294360","spectrum_index":40026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 112.0515 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.164,"smiles":null,"spectrum_id":"CCMSLIB00017294363","spectrum_index":40027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 247.6687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.755,"smiles":null,"spectrum_id":"CCMSLIB00017294366","spectrum_index":40028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 78.0473 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.092,"smiles":null,"spectrum_id":"CCMSLIB00017294369","spectrum_index":40029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNITOL - 60.0 eV (delta mass: 17.8847 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.971,"smiles":null,"spectrum_id":"CCMSLIB00017294372","spectrum_index":40030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucrose (delta mass: 341.1321 Da; putative annotation: N/A; putative formula: C12H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.256,"smiles":null,"spectrum_id":"CCMSLIB00017294375","spectrum_index":40031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01043 Hexahydrocurcumin (delta mass: 228.0665 Da; putative annotation: N/A; putative formula: C9H13N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.247,"smiles":null,"spectrum_id":"CCMSLIB00017294378","spectrum_index":40032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 284.1219 Da; putative annotation: N/A; putative formula: C9H20N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.177,"smiles":null,"spectrum_id":"CCMSLIB00017294382","spectrum_index":40033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of haplamine (delta mass: 75.0278 Da; putative annotation: N/A; putative formula: CH5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.14,"smiles":null,"spectrum_id":"CCMSLIB00017294385","spectrum_index":40034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 221.0952 Da; putative annotation: N/A; putative formula: C14H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.291,"smiles":null,"spectrum_id":"CCMSLIB00017294388","spectrum_index":40035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087703 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 87.9309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.996,"smiles":null,"spectrum_id":"CCMSLIB00017294391","spectrum_index":40036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 11.0059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.092,"smiles":null,"spectrum_id":"CCMSLIB00017294394","spectrum_index":40037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 292.1156 Da; putative annotation: N/A; putative formula: C12H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.207,"smiles":null,"spectrum_id":"CCMSLIB00017294397","spectrum_index":40038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 713.3835 Da; putative annotation: N/A; putative formula: C38H51N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.454,"smiles":null,"spectrum_id":"CCMSLIB00017294400","spectrum_index":40039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 380.1805 Da; putative annotation: N/A; putative formula: C26H25N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.35,"smiles":null,"spectrum_id":"CCMSLIB00017294403","spectrum_index":40040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 112.0675 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017294406","spectrum_index":40041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 101.0535 Da; putative annotation: N/A; putative formula: C3H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.115,"smiles":null,"spectrum_id":"CCMSLIB00017294409","spectrum_index":40042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Bromo-1H-pyrrolo[3,2-c]pyridine (delta mass: 23.0135 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.984,"smiles":null,"spectrum_id":"CCMSLIB00017294412","spectrum_index":40043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-Hydroxy-4,6-dimethoxyacetophenone\"\" (delta mass: 216.0423 Da; putative annotation: N/A; putative formula: C12H8O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.123,"smiles":null,"spectrum_id":"CCMSLIB00017294415","spectrum_index":40044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 146.0351 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.164,"smiles":null,"spectrum_id":"CCMSLIB00017294419","spectrum_index":40045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 80.0615 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.19,"smiles":null,"spectrum_id":"CCMSLIB00017294422","spectrum_index":40046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 49.9924 Da; putative annotation: N/A; putative formula: C2H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.104,"smiles":null,"spectrum_id":"CCMSLIB00017294425","spectrum_index":40047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 290.2243 Da; putative annotation: N/A; putative formula: C19H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.348,"smiles":null,"spectrum_id":"CCMSLIB00017294428","spectrum_index":40048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 92.0617 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.106,"smiles":null,"spectrum_id":"CCMSLIB00017294431","spectrum_index":40049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 188.0833 Da; putative annotation: N/A; putative formula: C12H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.138,"smiles":null,"spectrum_id":"CCMSLIB00017294435","spectrum_index":40050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindoleacetic acid; AIF; CE0; MS2Dec (delta mass: 71.0629 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017294437","spectrum_index":40051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 85.0349 Da; putative annotation: N/A; putative formula: C4H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.1,"smiles":null,"spectrum_id":"CCMSLIB00017294440","spectrum_index":40052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 262.0835 Da; putative annotation: N/A; putative formula: C8H15N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.164,"smiles":null,"spectrum_id":"CCMSLIB00017294443","spectrum_index":40053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 232.0733 Da; putative annotation: N/A; putative formula: C13H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.154,"smiles":null,"spectrum_id":"CCMSLIB00017294446","spectrum_index":40054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 464.2538 Da; putative annotation: N/A; putative formula: C33H36S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.34,"smiles":null,"spectrum_id":"CCMSLIB00017294449","spectrum_index":40055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 128.1171 Da; putative annotation: N/A; putative formula: C4H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.23,"smiles":null,"spectrum_id":"CCMSLIB00017294452","spectrum_index":40056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 362.0234 Da; putative annotation: N/A; putative formula: C14H19O3PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.135,"smiles":null,"spectrum_id":"CCMSLIB00017294455","spectrum_index":40057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 145.111 Da; putative annotation: N/A; putative formula: C7H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.208,"smiles":null,"spectrum_id":"CCMSLIB00017294458","spectrum_index":40058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 145.1061 Da; putative annotation: N/A; putative formula: C3H11N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.26,"smiles":null,"spectrum_id":"CCMSLIB00017294461","spectrum_index":40059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 126.0318 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.097,"smiles":null,"spectrum_id":"CCMSLIB00017294464","spectrum_index":40060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 84.0576 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.149,"smiles":null,"spectrum_id":"CCMSLIB00017294467","spectrum_index":40061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 1,6-dimethyl-4-phenyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate (delta mass: 18.0145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.131,"smiles":null,"spectrum_id":"CCMSLIB00017294469","spectrum_index":40062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 145.1446 Da; putative annotation: N/A; putative formula: C4H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.204,"smiles":null,"spectrum_id":"CCMSLIB00017294471","spectrum_index":40063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 148.1613 Da; putative annotation: N/A; putative formula: C12H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.232,"smiles":null,"spectrum_id":"CCMSLIB00017294474","spectrum_index":40064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 84.0229 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.104,"smiles":null,"spectrum_id":"CCMSLIB00017294477","spectrum_index":40065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 165.079 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.223,"smiles":null,"spectrum_id":"CCMSLIB00017294479","spectrum_index":40066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 185.1155 Da; putative annotation: N/A; putative formula: C8H15N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.166,"smiles":null,"spectrum_id":"CCMSLIB00017294481","spectrum_index":40067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhistamine (delta mass: 25.0186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.121,"smiles":null,"spectrum_id":"CCMSLIB00017294484","spectrum_index":40068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 210.1372 Da; putative annotation: N/A; putative formula: C11H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.313,"smiles":null,"spectrum_id":"CCMSLIB00017294487","spectrum_index":40069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 125.0499 Da; putative annotation: N/A; putative formula: C5H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.141,"smiles":null,"spectrum_id":"CCMSLIB00017294490","spectrum_index":40070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenyl-1H-pyrazol-3-ylamine (delta mass: 73.0466 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.133,"smiles":null,"spectrum_id":"CCMSLIB00017294492","spectrum_index":40071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 9.9958 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.055,"smiles":null,"spectrum_id":"CCMSLIB00017294495","spectrum_index":40072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 125.2461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.333,"smiles":null,"spectrum_id":"CCMSLIB00017294497","spectrum_index":40073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005923 Tetrahydropapaveroline|1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 18.1535 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.276,"smiles":null,"spectrum_id":"CCMSLIB00017294500","spectrum_index":40074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 142.0265 Da; putative annotation: N/A; putative formula: C6H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.108,"smiles":null,"spectrum_id":"CCMSLIB00017294503","spectrum_index":40075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Imidazoleacetic acid (delta mass: 105.0678 Da; putative annotation: N/A; putative formula: C6H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017294505","spectrum_index":40076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 162.0628 Da; putative annotation: N/A; putative formula: C7H15PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.097,"smiles":null,"spectrum_id":"CCMSLIB00017294508","spectrum_index":40077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 140.1444 Da; putative annotation: N/A; putative formula: C7H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.252,"smiles":null,"spectrum_id":"CCMSLIB00017294511","spectrum_index":40078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 214.1589 Da; putative annotation: N/A; putative formula: C13H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.238,"smiles":null,"spectrum_id":"CCMSLIB00017294514","spectrum_index":40079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 202.1972 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017294516","spectrum_index":40080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 554.3025 Da; putative annotation: N/A; putative formula: C28H46N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":856.441,"smiles":null,"spectrum_id":"CCMSLIB00017294519","spectrum_index":40081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 70.9199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.991,"smiles":null,"spectrum_id":"CCMSLIB00017294522","spectrum_index":40082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 142.2171 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.288,"smiles":null,"spectrum_id":"CCMSLIB00017294524","spectrum_index":40083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-.beta.-D-ribofuranosyl-1H-imidazole-4-carboxamide (delta mass: 283.0666 Da; putative annotation: N/A; putative formula: C8H9N7O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.17,"smiles":null,"spectrum_id":"CCMSLIB00017294527","spectrum_index":40084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 116.099 Da; putative annotation: N/A; putative formula: C10H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.341,"smiles":null,"spectrum_id":"CCMSLIB00017294529","spectrum_index":40085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 136.0169 Da; putative annotation: N/A; putative formula: C8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.125,"smiles":null,"spectrum_id":"CCMSLIB00017294532","spectrum_index":40086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 31.0786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.138,"smiles":null,"spectrum_id":"CCMSLIB00017294535","spectrum_index":40087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Paxitriol (delta mass: 474.2896 Da; putative annotation: N/A; putative formula: C31H34N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.554,"smiles":null,"spectrum_id":"CCMSLIB00017294538","spectrum_index":40088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one (delta mass: 128.0582 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.135,"smiles":null,"spectrum_id":"CCMSLIB00017294539","spectrum_index":40089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 235.2576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.417,"smiles":null,"spectrum_id":"CCMSLIB00017294542","spectrum_index":40090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 207.0886 Da; putative annotation: N/A; putative formula: C11H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.128,"smiles":null,"spectrum_id":"CCMSLIB00017294545","spectrum_index":40091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 200.1202 Da; putative annotation: N/A; putative formula: C14H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017294547","spectrum_index":40092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 63.9624 Da; putative annotation: N/A; putative formula: O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.117,"smiles":null,"spectrum_id":"CCMSLIB00017294550","spectrum_index":40093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 98.0478 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017294552","spectrum_index":40094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 229.2451 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.352,"smiles":null,"spectrum_id":"CCMSLIB00017294555","spectrum_index":40095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 96.0939 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.268,"smiles":null,"spectrum_id":"CCMSLIB00017294557","spectrum_index":40096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 240.1359 Da; putative annotation: N/A; putative formula: C13H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.248,"smiles":null,"spectrum_id":"CCMSLIB00017294559","spectrum_index":40097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000511 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 173.1158 Da; putative annotation: N/A; putative formula: C7H15N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.186,"smiles":null,"spectrum_id":"CCMSLIB00017294562","spectrum_index":40098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 58.0414 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.086,"smiles":null,"spectrum_id":"CCMSLIB00017294565","spectrum_index":40099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diphenyl(4-piperidinyl)methanol (delta mass: 114.0494 Da; putative annotation: N/A; putative formula: C6H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.219,"smiles":null,"spectrum_id":"CCMSLIB00017294568","spectrum_index":40100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 87.0331 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.12,"smiles":null,"spectrum_id":"CCMSLIB00017294569","spectrum_index":40101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 65.0636 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017294572","spectrum_index":40102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 65.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.192,"smiles":null,"spectrum_id":"CCMSLIB00017294575","spectrum_index":40103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 218.1149 Da; putative annotation: N/A; putative formula: C10H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.216,"smiles":null,"spectrum_id":"CCMSLIB00017294578","spectrum_index":40104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 17.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.138,"smiles":null,"spectrum_id":"CCMSLIB00017294580","spectrum_index":40105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 399.1897 Da; putative annotation: N/A; putative formula: C22H30N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.276,"smiles":null,"spectrum_id":"CCMSLIB00017294582","spectrum_index":40106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU228201 10,11-Dihydro-10-Hydroxycarbazepine|Licarbazepine|5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 17.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.149,"smiles":null,"spectrum_id":"CCMSLIB00017294585","spectrum_index":40107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 284.1988 Da; putative annotation: N/A; putative formula: C16H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.285,"smiles":null,"spectrum_id":"CCMSLIB00017294588","spectrum_index":40108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine (delta mass: 47.0153 Da; putative annotation: N/A; putative formula: C4HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017294591","spectrum_index":40109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 231.2227 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.309,"smiles":null,"spectrum_id":"CCMSLIB00017294593","spectrum_index":40110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 95.0623 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.169,"smiles":null,"spectrum_id":"CCMSLIB00017294595","spectrum_index":40111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 141.0786 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.165,"smiles":null,"spectrum_id":"CCMSLIB00017294598","spectrum_index":40112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 197.0684 Da; putative annotation: N/A; putative formula: C9H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.155,"smiles":null,"spectrum_id":"CCMSLIB00017294601","spectrum_index":40113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 524.3518 Da; putative annotation: N/A; putative formula: C19H40N16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.423,"smiles":null,"spectrum_id":"CCMSLIB00017294604","spectrum_index":40114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 446.2039 Da; putative annotation: N/A; putative formula: C20H22N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.29,"smiles":null,"spectrum_id":"CCMSLIB00017294605","spectrum_index":40115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[4-[Acetyl(hydroxy)amino]butylcarbamoyl]-5-[3-[acetyl(hydroxy)amino]propylamino]-3-hydroxy-5-oxopentanoic acid (delta mass: 17.0194 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.228,"smiles":null,"spectrum_id":"CCMSLIB00017294608","spectrum_index":40116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 125.0252 Da; putative annotation: N/A; putative formula: C3H4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.138,"smiles":null,"spectrum_id":"CCMSLIB00017294611","spectrum_index":40117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380682-01_C13H18O8_ (delta mass: 35.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.144,"smiles":null,"spectrum_id":"CCMSLIB00017294614","spectrum_index":40118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 40.9844 Da; putative annotation: N/A; putative formula: CNO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.044,"smiles":null,"spectrum_id":"CCMSLIB00017294615","spectrum_index":40119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 859.6027 Da; putative annotation: N/A; putative formula: C47H89NO8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1243.75,"smiles":null,"spectrum_id":"CCMSLIB00017294618","spectrum_index":40120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 66.0223 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.125,"smiles":null,"spectrum_id":"CCMSLIB00017294621","spectrum_index":40121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 538.1518 Da; putative annotation: N/A; putative formula: C26H34O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.212,"smiles":null,"spectrum_id":"CCMSLIB00017294623","spectrum_index":40122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 30.4403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017294625","spectrum_index":40123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 462.2104 Da; putative annotation: N/A; putative formula: C24H35N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.359,"smiles":null,"spectrum_id":"CCMSLIB00017294628","spectrum_index":40124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 119.0735 Da; putative annotation: N/A; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.129,"smiles":null,"spectrum_id":"CCMSLIB00017294631","spectrum_index":40125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 431.2836 Da; putative annotation: N/A; putative formula: C22H37N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.386,"smiles":null,"spectrum_id":"CCMSLIB00017294634","spectrum_index":40126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 434.3749 Da; putative annotation: N/A; putative formula: C28H50O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.446,"smiles":null,"spectrum_id":"CCMSLIB00017294635","spectrum_index":40127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 353.2428 Da; putative annotation: N/A; putative formula: C17H31N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.329,"smiles":null,"spectrum_id":"CCMSLIB00017294638","spectrum_index":40128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin (delta mass: 131.0829 Da; putative annotation: N/A; putative formula: C8H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.178,"smiles":null,"spectrum_id":"CCMSLIB00017294641","spectrum_index":40129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine CollisionEnergy:102040 (delta mass: 328.2218 Da; putative annotation: N/A; putative formula: C16H33N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.318,"smiles":null,"spectrum_id":"CCMSLIB00017294644","spectrum_index":40130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 179.0699 Da; putative annotation: N/A; putative formula: C8H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1008.35,"smiles":null,"spectrum_id":"CCMSLIB00017294645","spectrum_index":40131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 883.3536 Da; putative annotation: N/A; putative formula: C48H57N3O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1226.48,"smiles":null,"spectrum_id":"CCMSLIB00017294648","spectrum_index":40132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 394.2561 Da; putative annotation: N/A; putative formula: C19H38O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.316,"smiles":null,"spectrum_id":"CCMSLIB00017294651","spectrum_index":40133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 898.5314 Da; putative annotation: N/A; putative formula: C49H70N8O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1053.6,"smiles":null,"spectrum_id":"CCMSLIB00017294654","spectrum_index":40134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 413.2777 Da; putative annotation: N/A; putative formula: C22H39NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.348,"smiles":null,"spectrum_id":"CCMSLIB00017294656","spectrum_index":40135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 110.1094 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.18,"smiles":null,"spectrum_id":"CCMSLIB00017294658","spectrum_index":40136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 46.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.159,"smiles":null,"spectrum_id":"CCMSLIB00017294661","spectrum_index":40137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 439.3327 Da; putative annotation: N/A; putative formula: C24H46N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.481,"smiles":null,"spectrum_id":"CCMSLIB00017294664","spectrum_index":40138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 78.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.161,"smiles":null,"spectrum_id":"CCMSLIB00017294666","spectrum_index":40139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 204.0421 Da; putative annotation: N/A; putative formula: C11H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.102,"smiles":null,"spectrum_id":"CCMSLIB00017294669","spectrum_index":40140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Pyrrole-2,5-dione, 3-(2,4-dichlorophenyl)-4-(1-methyl-1H-indol-3-yl)- (delta mass: 41.1841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.219,"smiles":null,"spectrum_id":"CCMSLIB00017294672","spectrum_index":40141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 113.0365 Da; putative annotation: N/A; putative formula: C7H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.207,"smiles":null,"spectrum_id":"CCMSLIB00017294674","spectrum_index":40142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 27.0375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.142,"smiles":null,"spectrum_id":"CCMSLIB00017294677","spectrum_index":40143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 287.1796 Da; putative annotation: N/A; putative formula: C18H26NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.275,"smiles":null,"spectrum_id":"CCMSLIB00017294680","spectrum_index":40144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 117.4187 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.49,"smiles":null,"spectrum_id":"CCMSLIB00017294681","spectrum_index":40145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084606 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 51.0472 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.102,"smiles":null,"spectrum_id":"CCMSLIB00017294684","spectrum_index":40146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 163.0635 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.155,"smiles":null,"spectrum_id":"CCMSLIB00017294687","spectrum_index":40147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 17.1199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.3,"smiles":null,"spectrum_id":"CCMSLIB00017294690","spectrum_index":40148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 66.0214 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.124,"smiles":null,"spectrum_id":"CCMSLIB00017294693","spectrum_index":40149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-MANNOSAMINE (delta mass: 95.0245 Da; putative annotation: N/A; putative formula: C2HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.122,"smiles":null,"spectrum_id":"CCMSLIB00017294696","spectrum_index":40150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 41.0333 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.192,"smiles":null,"spectrum_id":"CCMSLIB00017294698","spectrum_index":40151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 40.0314 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.118,"smiles":null,"spectrum_id":"CCMSLIB00017294700","spectrum_index":40152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2,5-Dihydroxyhexyl)oxolan-2-one (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.122,"smiles":null,"spectrum_id":"CCMSLIB00017294703","spectrum_index":40153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antipain (delta mass: 14.0168 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.369,"smiles":null,"spectrum_id":"CCMSLIB00017294706","spectrum_index":40154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5,5-trimethyl-1,3-oxazolidin-2-one (delta mass: 256.1076 Da; putative annotation: N/A; putative formula: C12H12N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.242,"smiles":null,"spectrum_id":"CCMSLIB00017294708","spectrum_index":40155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 48.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.137,"smiles":null,"spectrum_id":"CCMSLIB00017294710","spectrum_index":40156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 48.0403 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017294713","spectrum_index":40157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 92.0261 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.086,"smiles":null,"spectrum_id":"CCMSLIB00017294716","spectrum_index":40158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 152.2301 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.316,"smiles":null,"spectrum_id":"CCMSLIB00017294719","spectrum_index":40159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 91.0092 Da; putative annotation: N/A; putative formula: C2H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.074,"smiles":null,"spectrum_id":"CCMSLIB00017294720","spectrum_index":40160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 107.0468 Da; putative annotation: N/A; putative formula: C5H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.187,"smiles":null,"spectrum_id":"CCMSLIB00017294723","spectrum_index":40161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 212.1534 Da; putative annotation: N/A; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.266,"smiles":null,"spectrum_id":"CCMSLIB00017294726","spectrum_index":40162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile (delta mass: 60.0052 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.017,"smiles":null,"spectrum_id":"CCMSLIB00017294729","spectrum_index":40163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSE 1-PHOSPHATE (delta mass: 114.0171 Da; putative annotation: N/A; putative formula: C2H2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.054,"smiles":null,"spectrum_id":"CCMSLIB00017294731","spectrum_index":40164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 27.0208 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.071,"smiles":null,"spectrum_id":"CCMSLIB00017294733","spectrum_index":40165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-NORMETANEPHRINE - 20.0 eV (delta mass: 38.9998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.097,"smiles":null,"spectrum_id":"CCMSLIB00017294736","spectrum_index":40166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 15.0196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.081,"smiles":null,"spectrum_id":"CCMSLIB00017294739","spectrum_index":40167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017294742","spectrum_index":40168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 222.0975 Da; putative annotation: N/A; putative formula: C7H10N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.189,"smiles":null,"spectrum_id":"CCMSLIB00017294744","spectrum_index":40169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 131.8791 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.939,"smiles":null,"spectrum_id":"CCMSLIB00017294746","spectrum_index":40170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Santacruzamate A (delta mass: 46.1019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.272,"smiles":null,"spectrum_id":"CCMSLIB00017294749","spectrum_index":40171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 60.0205 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.143,"smiles":null,"spectrum_id":"CCMSLIB00017294752","spectrum_index":40172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 120.0573 Da; putative annotation: R-(-)-Phenyl-1,2-ethanediol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.154,"smiles":null,"spectrum_id":"CCMSLIB00017294754","spectrum_index":40173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 168.1512 Da; putative annotation: Serricornin; putative formula: C11H20O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.216,"smiles":null,"spectrum_id":"CCMSLIB00017294756","spectrum_index":40174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 156.0572 Da; putative annotation: (2E,4E)-5-Phenyl-2,4-pentadienoic acid; putative formula: C11H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.117,"smiles":null,"spectrum_id":"CCMSLIB00017294759","spectrum_index":40175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 116.064 Da; putative annotation: Cinnamyl alcohol; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.14,"smiles":null,"spectrum_id":"CCMSLIB00017294762","spectrum_index":40176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of OCTOPAMINE (delta mass: 331.1697 Da; putative annotation: \"\"MLS001049080-01!2-[6-(cyclohexylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol\"\"; putative formula: C16H21N5O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.256,"smiles":null,"spectrum_id":"CCMSLIB00017294765","spectrum_index":40177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match] (delta mass: 260.214 Da; putative annotation: ?-linolenic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.483,"smiles":null,"spectrum_id":"CCMSLIB00017294768","spectrum_index":40178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 216.0779 Da; putative annotation: 7-Acetyl-3,6-dihydroxy-8-methyl-3,4-dihydronaphthalen-1(2H)-one; putative formula: C13H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.149,"smiles":null,"spectrum_id":"CCMSLIB00017294769","spectrum_index":40179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 177.0791 Da; putative annotation: (2S)-2-amino-3-(4-methoxyphenyl)propanoic acid CollisionEnergy:102040; putative formula: C10H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017294772","spectrum_index":40180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 178.0471 Da; putative annotation: 1,7-Dimethyluric acid; putative formula: C7H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.086,"smiles":null,"spectrum_id":"CCMSLIB00017294775","spectrum_index":40181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phenol, 4-(2-aminoethyl)- from NIST14 (delta mass: 313.0687 Da; putative annotation: N/A; putative formula: C17H16NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.16,"smiles":null,"spectrum_id":"CCMSLIB00017294778","spectrum_index":40182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 295.2401 Da; putative annotation: N/A; putative formula: C20H29N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017294781","spectrum_index":40183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 116.0472 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.144,"smiles":null,"spectrum_id":"CCMSLIB00017294783","spectrum_index":40184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 234.0378 Da; putative annotation: N/A; putative formula: C8H10O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.135,"smiles":null,"spectrum_id":"CCMSLIB00017294785","spectrum_index":40185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 446.008 Da; putative annotation: N/A; putative formula: C12H-2N16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.141,"smiles":null,"spectrum_id":"CCMSLIB00017294788","spectrum_index":40186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 672.4505 Da; putative annotation: N/A; putative formula: C42H60N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":861.599,"smiles":null,"spectrum_id":"CCMSLIB00017294791","spectrum_index":40187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 71.992 Da; putative annotation: N/A; putative formula: N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.079,"smiles":null,"spectrum_id":"CCMSLIB00017294794","spectrum_index":40188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 131.0218 Da; putative annotation: N/A; putative formula: C4H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.113,"smiles":null,"spectrum_id":"CCMSLIB00017294796","spectrum_index":40189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Naphthyl)-1H-indole (delta mass: 45.0237 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.136,"smiles":null,"spectrum_id":"CCMSLIB00017294798","spectrum_index":40190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 189.0636 Da; putative annotation: N/A; putative formula: C7H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.098,"smiles":null,"spectrum_id":"CCMSLIB00017294801","spectrum_index":40191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 170.0688 Da; putative annotation: N/A; putative formula: C7H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.129,"smiles":null,"spectrum_id":"CCMSLIB00017294804","spectrum_index":40192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 460.217 Da; putative annotation: N/A; putative formula: C19H32N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.309,"smiles":null,"spectrum_id":"CCMSLIB00017294806","spectrum_index":40193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 325.2247 Da; putative annotation: N/A; putative formula: C18H31NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.337,"smiles":null,"spectrum_id":"CCMSLIB00017294808","spectrum_index":40194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 226.1195 Da; putative annotation: N/A; putative formula: C12H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.216,"smiles":null,"spectrum_id":"CCMSLIB00017294811","spectrum_index":40195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 637.1632 Da; putative annotation: N/A; putative formula: C22H32N5O15P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":976.286,"smiles":null,"spectrum_id":"CCMSLIB00017294814","spectrum_index":40196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 753.394 Da; putative annotation: N/A; putative formula: C31H59N7O12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.48,"smiles":null,"spectrum_id":"CCMSLIB00017294816","spectrum_index":40197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 124.9316 Da; putative annotation: N/A; putative formula: NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.992,"smiles":null,"spectrum_id":"CCMSLIB00017294819","spectrum_index":40198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 332.1292 Da; putative annotation: N/A; putative formula: C15H24O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.189,"smiles":null,"spectrum_id":"CCMSLIB00017294821","spectrum_index":40199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 716.5139 Da; putative annotation: N/A; putative formula: C46H64N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":961.609,"smiles":null,"spectrum_id":"CCMSLIB00017294824","spectrum_index":40200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 62.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.211,"smiles":null,"spectrum_id":"CCMSLIB00017294827","spectrum_index":40201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 42.0107 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017294828","spectrum_index":40202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 270.2766 Da; putative annotation: N/A; putative formula: C15H34N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.368,"smiles":null,"spectrum_id":"CCMSLIB00017294831","spectrum_index":40203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 292.0728 Da; putative annotation: N/A; putative formula: C10H16N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.159,"smiles":null,"spectrum_id":"CCMSLIB00017294834","spectrum_index":40204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 240.1206 Da; putative annotation: N/A; putative formula: C12H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.191,"smiles":null,"spectrum_id":"CCMSLIB00017294837","spectrum_index":40205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 407.2172 Da; putative annotation: N/A; putative formula: C20H41NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.256,"smiles":null,"spectrum_id":"CCMSLIB00017294839","spectrum_index":40206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine - 40.0 eV (delta mass: 48.0458 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.096,"smiles":null,"spectrum_id":"CCMSLIB00017294841","spectrum_index":40207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTITOL (delta mass: 186.0315 Da; putative annotation: N/A; putative formula: C11H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.118,"smiles":null,"spectrum_id":"CCMSLIB00017294844","spectrum_index":40208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017294847","spectrum_index":40209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 465.2478 Da; putative annotation: N/A; putative formula: C26H36N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.328,"smiles":null,"spectrum_id":"CCMSLIB00017294849","spectrum_index":40210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017294851","spectrum_index":40211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-2-methylphenol (delta mass: 176.0343 Da; putative annotation: N/A; putative formula: C7H14O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.11,"smiles":null,"spectrum_id":"CCMSLIB00017294854","spectrum_index":40212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 28.9786 Da; putative annotation: N/A; putative formula: NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017294857","spectrum_index":40213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 60.0194 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.189,"smiles":null,"spectrum_id":"CCMSLIB00017294860","spectrum_index":40214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 404.2415 Da; putative annotation: N/A; putative formula: C21H40O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.307,"smiles":null,"spectrum_id":"CCMSLIB00017294862","spectrum_index":40215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 336.1778 Da; putative annotation: N/A; putative formula: C20H24N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.243,"smiles":null,"spectrum_id":"CCMSLIB00017294864","spectrum_index":40216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 121.054 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.229,"smiles":null,"spectrum_id":"CCMSLIB00017294867","spectrum_index":40217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 278.2223 Da; putative annotation: N/A; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.35,"smiles":null,"spectrum_id":"CCMSLIB00017294870","spectrum_index":40218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxy-3-[(9-methyl-6-oxohydropurin-8-ylthio)methyl]benzaldehyde CollisionEnergy:205060 (delta mass: 98.0029 Da; putative annotation: N/A; putative formula: C3H3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.089,"smiles":null,"spectrum_id":"CCMSLIB00017294872","spectrum_index":40219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 238.1609 Da; putative annotation: N/A; putative formula: C12H22N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.309,"smiles":null,"spectrum_id":"CCMSLIB00017294874","spectrum_index":40220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 42.0095 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.075,"smiles":null,"spectrum_id":"CCMSLIB00017294877","spectrum_index":40221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 132.0824 Da; putative annotation: N/A; putative formula: C5H13N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.221,"smiles":null,"spectrum_id":"CCMSLIB00017294880","spectrum_index":40222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 81.0788 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.118,"smiles":null,"spectrum_id":"CCMSLIB00017294882","spectrum_index":40223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 343.1371 Da; putative annotation: N/A; putative formula: C16H26NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.302,"smiles":null,"spectrum_id":"CCMSLIB00017294884","spectrum_index":40224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 920.4765 Da; putative annotation: N/A; putative formula: C46H60N14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1101.55,"smiles":null,"spectrum_id":"CCMSLIB00017294887","spectrum_index":40225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 87.4243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.5,"smiles":null,"spectrum_id":"CCMSLIB00017294890","spectrum_index":40226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 86.0584 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.171,"smiles":null,"spectrum_id":"CCMSLIB00017294892","spectrum_index":40227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 155.0908 Da; putative annotation: N/A; putative formula: C4H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.13,"smiles":null,"spectrum_id":"CCMSLIB00017294894","spectrum_index":40228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Phenyl-8-azabicyclo[3.2.1]oct-2-ene (delta mass: 90.0477 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.175,"smiles":null,"spectrum_id":"CCMSLIB00017294897","spectrum_index":40229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MECILLINAM (delta mass: 64.0137 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.167,"smiles":null,"spectrum_id":"CCMSLIB00017294900","spectrum_index":40230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 60.9919 Da; putative annotation: N/A; putative formula: C4H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.119,"smiles":null,"spectrum_id":"CCMSLIB00017294903","spectrum_index":40231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 15.0086 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.12,"smiles":null,"spectrum_id":"CCMSLIB00017294904","spectrum_index":40232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 297.0739 Da; putative annotation: N/A; putative formula: C9H12N7O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.176,"smiles":null,"spectrum_id":"CCMSLIB00017294907","spectrum_index":40233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 249.1595 Da; putative annotation: N/A; putative formula: C12H19N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.23,"smiles":null,"spectrum_id":"CCMSLIB00017294910","spectrum_index":40234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-MANNOSAMINE - 20.0 eV (delta mass: 130.042 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.129,"smiles":null,"spectrum_id":"CCMSLIB00017294913","spectrum_index":40235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 130.1106 Da; putative annotation: N/A; putative formula: C6H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.218,"smiles":null,"spectrum_id":"CCMSLIB00017294915","spectrum_index":40236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00918 Demethoxycurcumin (delta mass: 162.051 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.174,"smiles":null,"spectrum_id":"CCMSLIB00017294917","spectrum_index":40237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myrtucommulone B (delta mass: 71.058 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.27,"smiles":null,"spectrum_id":"CCMSLIB00017294920","spectrum_index":40238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 341.07 Da; putative annotation: N/A; putative formula: C22H15NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.161,"smiles":null,"spectrum_id":"CCMSLIB00017294923","spectrum_index":40239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 69.0715 Da; putative annotation: N/A; putative formula: C3H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.143,"smiles":null,"spectrum_id":"CCMSLIB00017294925","spectrum_index":40240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 640.2092 Da; putative annotation: N/A; putative formula: C32H36N2O10S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":867.301,"smiles":null,"spectrum_id":"CCMSLIB00017294927","spectrum_index":40241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 154.0962 Da; putative annotation: N/A; putative formula: C5H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.172,"smiles":null,"spectrum_id":"CCMSLIB00017294930","spectrum_index":40242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 60.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.154,"smiles":null,"spectrum_id":"CCMSLIB00017294933","spectrum_index":40243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 383.1591 Da; putative annotation: N/A; putative formula: C19H29NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.261,"smiles":null,"spectrum_id":"CCMSLIB00017294935","spectrum_index":40244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 102.0012 Da; putative annotation: N/A; putative formula: CH2N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.051,"smiles":null,"spectrum_id":"CCMSLIB00017294937","spectrum_index":40245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 378.2252 Da; putative annotation: N/A; putative formula: C18H34O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.348,"smiles":null,"spectrum_id":"CCMSLIB00017294940","spectrum_index":40246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 64.0164 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017294943","spectrum_index":40247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 43.9901 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.066,"smiles":null,"spectrum_id":"CCMSLIB00017294944","spectrum_index":40248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017294947","spectrum_index":40249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 293.149 Da; putative annotation: N/A; putative formula: C13H19N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.318,"smiles":null,"spectrum_id":"CCMSLIB00017294950","spectrum_index":40250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 206.0864 Da; putative annotation: N/A; putative formula: C12H15OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.251,"smiles":null,"spectrum_id":"CCMSLIB00017294953","spectrum_index":40251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 62.0002 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.055,"smiles":null,"spectrum_id":"CCMSLIB00017294956","spectrum_index":40252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-N-Acetyltryptophan - 40.0 eV (delta mass: 42.011 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.119,"smiles":null,"spectrum_id":"CCMSLIB00017294957","spectrum_index":40253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 27.9942 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.053,"smiles":null,"spectrum_id":"CCMSLIB00017294960","spectrum_index":40254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 188.0469 Da; putative annotation: N/A; putative formula: C11H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.128,"smiles":null,"spectrum_id":"CCMSLIB00017294963","spectrum_index":40255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 230.1715 Da; putative annotation: N/A; putative formula: C6H18N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.286,"smiles":null,"spectrum_id":"CCMSLIB00017294964","spectrum_index":40256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4H-Pyrrolo[3,2-c]pyridin-4-one, 1,5,6,7-tetrahydro-2-[2-(3-quinolinyl)-4-pyridinyl]- (delta mass: 164.0675 Da; putative annotation: N/A; putative formula: C3H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.207,"smiles":null,"spectrum_id":"CCMSLIB00017294967","spectrum_index":40257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 132.0538 Da; putative annotation: N/A; putative formula: C4H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.14,"smiles":null,"spectrum_id":"CCMSLIB00017294970","spectrum_index":40258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 27.0697 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.145,"smiles":null,"spectrum_id":"CCMSLIB00017294973","spectrum_index":40259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 256.1643 Da; putative annotation: N/A; putative formula: C10H20N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.256,"smiles":null,"spectrum_id":"CCMSLIB00017294974","spectrum_index":40260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 32.1561 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.3,"smiles":null,"spectrum_id":"CCMSLIB00017294977","spectrum_index":40261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 42.0176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.125,"smiles":null,"spectrum_id":"CCMSLIB00017294980","spectrum_index":40262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 55.0457 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.096,"smiles":null,"spectrum_id":"CCMSLIB00017294983","spectrum_index":40263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 52.0718 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.148,"smiles":null,"spectrum_id":"CCMSLIB00017294985","spectrum_index":40264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 507.2786 Da; putative annotation: N/A; putative formula: C35H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.365,"smiles":null,"spectrum_id":"CCMSLIB00017294987","spectrum_index":40265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 490.2242 Da; putative annotation: N/A; putative formula: C24H42O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.31,"smiles":null,"spectrum_id":"CCMSLIB00017294990","spectrum_index":40266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 26.9987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.101,"smiles":null,"spectrum_id":"CCMSLIB00017294993","spectrum_index":40267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 50.0156 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017294996","spectrum_index":40268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 46.9919 Da; putative annotation: N/A; putative formula: H2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.079,"smiles":null,"spectrum_id":"CCMSLIB00017294997","spectrum_index":40269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 117.0676 Da; putative annotation: N/A; putative formula: C7H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017295000","spectrum_index":40270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 107.0564 Da; putative annotation: N/A; putative formula: C4H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.123,"smiles":null,"spectrum_id":"CCMSLIB00017295003","spectrum_index":40271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dehydrocoelenterazine (delta mass: 121.0198 Da; putative annotation: N/A; putative formula: C3H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.17,"smiles":null,"spectrum_id":"CCMSLIB00017295006","spectrum_index":40272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 276.266 Da; putative annotation: N/A; putative formula: C17H32N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.456,"smiles":null,"spectrum_id":"CCMSLIB00017295009","spectrum_index":40273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 31.0808 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.24,"smiles":null,"spectrum_id":"CCMSLIB00017295010","spectrum_index":40274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 110.0107 Da; putative annotation: N/A; putative formula: C4H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.108,"smiles":null,"spectrum_id":"CCMSLIB00017295013","spectrum_index":40275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 365.3062 Da; putative annotation: N/A; putative formula: C21H39N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.43,"smiles":null,"spectrum_id":"CCMSLIB00017295016","spectrum_index":40276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 111.9532 Da; putative annotation: N/A; putative formula: C4HPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.05,"smiles":null,"spectrum_id":"CCMSLIB00017295019","spectrum_index":40277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 290.0423 Da; putative annotation: N/A; putative formula: C9H15N4OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.201,"smiles":null,"spectrum_id":"CCMSLIB00017295021","spectrum_index":40278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 99.0686 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017295023","spectrum_index":40279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 64.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.154,"smiles":null,"spectrum_id":"CCMSLIB00017295026","spectrum_index":40280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 61.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.201,"smiles":null,"spectrum_id":"CCMSLIB00017295029","spectrum_index":40281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 134.0733 Da; putative annotation: N/A; putative formula: C9H10O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.128,"smiles":null,"spectrum_id":"CCMSLIB00017295032","spectrum_index":40282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 230.0782 Da; putative annotation: N/A; putative formula: C14H16O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.17,"smiles":null,"spectrum_id":"CCMSLIB00017295034","spectrum_index":40283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 30.0033 Da; putative annotation: N/A; putative formula: CH3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.063,"smiles":null,"spectrum_id":"CCMSLIB00017295036","spectrum_index":40284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.149,"smiles":null,"spectrum_id":"CCMSLIB00017295039","spectrum_index":40285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.107,"smiles":null,"spectrum_id":"CCMSLIB00017295042","spectrum_index":40286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 283.1423 Da; putative annotation: N/A; putative formula: C14H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.27,"smiles":null,"spectrum_id":"CCMSLIB00017295045","spectrum_index":40287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 112.0311 Da; putative annotation: N/A; putative formula: C9H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.18,"smiles":null,"spectrum_id":"CCMSLIB00017295047","spectrum_index":40288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 246.0999 Da; putative annotation: N/A; putative formula: C15H19O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.191,"smiles":null,"spectrum_id":"CCMSLIB00017295049","spectrum_index":40289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of d-Dethiobiotin CollisionEnergy:205060 (delta mass: 81.0353 Da; putative annotation: N/A; putative formula: C3H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.174,"smiles":null,"spectrum_id":"CCMSLIB00017295052","spectrum_index":40290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 279.1542 Da; putative annotation: N/A; putative formula: C19H22NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.241,"smiles":null,"spectrum_id":"CCMSLIB00017295056","spectrum_index":40291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 394.181 Da; putative annotation: N/A; putative formula: C23H27N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.22,"smiles":null,"spectrum_id":"CCMSLIB00017295058","spectrum_index":40292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 288.1574 Da; putative annotation: N/A; putative formula: C20H20N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.327,"smiles":null,"spectrum_id":"CCMSLIB00017295061","spectrum_index":40293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 143.0586 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.124,"smiles":null,"spectrum_id":"CCMSLIB00017295064","spectrum_index":40294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 10.0209 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017295067","spectrum_index":40295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 48.0365 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.289,"smiles":null,"spectrum_id":"CCMSLIB00017295068","spectrum_index":40296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Pipecolic acid (delta mass: 44.9822 Da; putative annotation: N/A; putative formula: H-1NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.068,"smiles":null,"spectrum_id":"CCMSLIB00017295071","spectrum_index":40297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 48.0583 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.118,"smiles":null,"spectrum_id":"CCMSLIB00017295074","spectrum_index":40298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 97.0485 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.197,"smiles":null,"spectrum_id":"CCMSLIB00017295077","spectrum_index":40299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 603.3757 Da; putative annotation: N/A; putative formula: C31H45N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.415,"smiles":null,"spectrum_id":"CCMSLIB00017295080","spectrum_index":40300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 60.0397 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.128,"smiles":null,"spectrum_id":"CCMSLIB00017295081","spectrum_index":40301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 72.0459 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.128,"smiles":null,"spectrum_id":"CCMSLIB00017295084","spectrum_index":40302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[(3,4,5-Trimethoxyphenyl)methyl]pyridin-2-amine (delta mass: 18.0117 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.151,"smiles":null,"spectrum_id":"CCMSLIB00017295087","spectrum_index":40303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 90.0836 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.196,"smiles":null,"spectrum_id":"CCMSLIB00017295090","spectrum_index":40304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 260.1371 Da; putative annotation: N/A; putative formula: C11H20N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.208,"smiles":null,"spectrum_id":"CCMSLIB00017295093","spectrum_index":40305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311040 Threonylleucine (isomer of 809, 926) (delta mass: 114.0893 Da; putative annotation: N/A; putative formula: C4H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.239,"smiles":null,"spectrum_id":"CCMSLIB00017295094","spectrum_index":40306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 122.0771 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.21,"smiles":null,"spectrum_id":"CCMSLIB00017295097","spectrum_index":40307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 121.9751 Da; putative annotation: N/A; putative formula: C4H-2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.037,"smiles":null,"spectrum_id":"CCMSLIB00017295100","spectrum_index":40308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 84.0938 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.191,"smiles":null,"spectrum_id":"CCMSLIB00017295102","spectrum_index":40309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 72.0214 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.081,"smiles":null,"spectrum_id":"CCMSLIB00017295105","spectrum_index":40310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 17.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.249,"smiles":null,"spectrum_id":"CCMSLIB00017295108","spectrum_index":40311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 614.1973 Da; putative annotation: N/A; putative formula: C27H30N6O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":836.294,"smiles":null,"spectrum_id":"CCMSLIB00017295110","spectrum_index":40312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 203.0424 Da; putative annotation: N/A; putative formula: C11H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.129,"smiles":null,"spectrum_id":"CCMSLIB00017295113","spectrum_index":40313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 111.0936 Da; putative annotation: N/A; putative formula: C4H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017295116","spectrum_index":40314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 467.3803 Da; putative annotation: N/A; putative formula: C21H45N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.534,"smiles":null,"spectrum_id":"CCMSLIB00017295119","spectrum_index":40315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Methyl-1-piperazinyl)butanoic acid (delta mass: 68.027 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.171,"smiles":null,"spectrum_id":"CCMSLIB00017295122","spectrum_index":40316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 144.0603 Da; putative annotation: N/A; putative formula: C7H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.219,"smiles":null,"spectrum_id":"CCMSLIB00017295125","spectrum_index":40317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 148.0494 Da; putative annotation: N/A; putative formula: C5H12N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.136,"smiles":null,"spectrum_id":"CCMSLIB00017295127","spectrum_index":40318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C17:1 (delta mass: 16.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.427,"smiles":null,"spectrum_id":"CCMSLIB00017295130","spectrum_index":40319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 90.0797 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.186,"smiles":null,"spectrum_id":"CCMSLIB00017295132","spectrum_index":40320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 9.0134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.089,"smiles":null,"spectrum_id":"CCMSLIB00017295135","spectrum_index":40321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 139.1081 Da; putative annotation: N/A; putative formula: C7H13N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.246,"smiles":null,"spectrum_id":"CCMSLIB00017295137","spectrum_index":40322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 703.317 Da; putative annotation: N/A; putative formula: C37H41N11O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.44,"smiles":null,"spectrum_id":"CCMSLIB00017295140","spectrum_index":40323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 393.2721 Da; putative annotation: N/A; putative formula: C19H39NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.421,"smiles":null,"spectrum_id":"CCMSLIB00017295143","spectrum_index":40324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 41.0592 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.14,"smiles":null,"spectrum_id":"CCMSLIB00017295144","spectrum_index":40325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 62.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.133,"smiles":null,"spectrum_id":"CCMSLIB00017295147","spectrum_index":40326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 930.0256 Da; putative annotation: N/A; putative formula: C34H34N2O17P4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1084.11,"smiles":null,"spectrum_id":"CCMSLIB00017295150","spectrum_index":40327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 694.6665 Da; putative annotation: N/A; putative formula: C45H90O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.764,"smiles":null,"spectrum_id":"CCMSLIB00017295153","spectrum_index":40328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 28.0313 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.081,"smiles":null,"spectrum_id":"CCMSLIB00017295156","spectrum_index":40329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 946.7081 Da; putative annotation: N/A; putative formula: C52H94N6O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1238.82,"smiles":null,"spectrum_id":"CCMSLIB00017295159","spectrum_index":40330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 259.1489 Da; putative annotation: N/A; putative formula: C16H22NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.224,"smiles":null,"spectrum_id":"CCMSLIB00017295161","spectrum_index":40331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 331.1996 Da; putative annotation: N/A; putative formula: C16H29NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.291,"smiles":null,"spectrum_id":"CCMSLIB00017295164","spectrum_index":40332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 278.1302 Da; putative annotation: N/A; putative formula: C11H22N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.206,"smiles":null,"spectrum_id":"CCMSLIB00017295166","spectrum_index":40333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 170.1306 Da; putative annotation: N/A; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.243,"smiles":null,"spectrum_id":"CCMSLIB00017295169","spectrum_index":40334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 73.0529 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017295172","spectrum_index":40335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 414.0927 Da; putative annotation: N/A; putative formula: C14H23O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.241,"smiles":null,"spectrum_id":"CCMSLIB00017295175","spectrum_index":40336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C8:0 (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.274,"smiles":null,"spectrum_id":"CCMSLIB00017295177","spectrum_index":40337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 74.0369 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017295180","spectrum_index":40338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 389.0717 Da; putative annotation: N/A; putative formula: C14H19N3O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.136,"smiles":null,"spectrum_id":"CCMSLIB00017295183","spectrum_index":40339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 50.0228 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.098,"smiles":null,"spectrum_id":"CCMSLIB00017295186","spectrum_index":40340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 82.0412 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.321,"smiles":null,"spectrum_id":"CCMSLIB00017295189","spectrum_index":40341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 140.0474 Da; putative annotation: N/A; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017295192","spectrum_index":40342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 300.1708 Da; putative annotation: N/A; putative formula: C13H25N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.304,"smiles":null,"spectrum_id":"CCMSLIB00017295195","spectrum_index":40343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 50.0471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.169,"smiles":null,"spectrum_id":"CCMSLIB00017295197","spectrum_index":40344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carbaldehyde (delta mass: 16.0336 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.089,"smiles":null,"spectrum_id":"CCMSLIB00017295200","spectrum_index":40345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 74.0504 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.142,"smiles":null,"spectrum_id":"CCMSLIB00017295203","spectrum_index":40346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 92.0472 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.128,"smiles":null,"spectrum_id":"CCMSLIB00017295205","spectrum_index":40347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 27.9767 Da; putative annotation: N/A; putative formula: CO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.047,"smiles":null,"spectrum_id":"CCMSLIB00017295207","spectrum_index":40348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 91.0424 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.129,"smiles":null,"spectrum_id":"CCMSLIB00017295210","spectrum_index":40349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 144.115 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.191,"smiles":null,"spectrum_id":"CCMSLIB00017295213","spectrum_index":40350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 614.3117 Da; putative annotation: N/A; putative formula: C36H38N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.403,"smiles":null,"spectrum_id":"CCMSLIB00017295214","spectrum_index":40351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 15.0354 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017295217","spectrum_index":40352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 35.1195 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.206,"smiles":null,"spectrum_id":"CCMSLIB00017295220","spectrum_index":40353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 28.9916 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.094,"smiles":null,"spectrum_id":"CCMSLIB00017295222","spectrum_index":40354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 60.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.138,"smiles":null,"spectrum_id":"CCMSLIB00017295225","spectrum_index":40355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 115.9833 Da; putative annotation: N/A; putative formula: C6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.101,"smiles":null,"spectrum_id":"CCMSLIB00017295228","spectrum_index":40356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 53.0334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.098,"smiles":null,"spectrum_id":"CCMSLIB00017295230","spectrum_index":40357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 310.117 Da; putative annotation: N/A; putative formula: C15H22N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.194,"smiles":null,"spectrum_id":"CCMSLIB00017295233","spectrum_index":40358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 156.106 Da; putative annotation: N/A; putative formula: C9H17P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.178,"smiles":null,"spectrum_id":"CCMSLIB00017295236","spectrum_index":40359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 185.1277 Da; putative annotation: N/A; putative formula: C7H15N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.208,"smiles":null,"spectrum_id":"CCMSLIB00017295238","spectrum_index":40360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 74.18 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.217,"smiles":null,"spectrum_id":"CCMSLIB00017295240","spectrum_index":40361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 55.0006 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.145,"smiles":null,"spectrum_id":"CCMSLIB00017295243","spectrum_index":40362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 266.2607 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.301,"smiles":null,"spectrum_id":"CCMSLIB00017295246","spectrum_index":40363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 102.0317 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.144,"smiles":null,"spectrum_id":"CCMSLIB00017295249","spectrum_index":40364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 232.1097 Da; putative annotation: N/A; putative formula: C14H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.3,"smiles":null,"spectrum_id":"CCMSLIB00017295252","spectrum_index":40365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 164.1043 Da; putative annotation: N/A; putative formula: C8H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.144,"smiles":null,"spectrum_id":"CCMSLIB00017295253","spectrum_index":40366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 127.0628 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.123,"smiles":null,"spectrum_id":"CCMSLIB00017295256","spectrum_index":40367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Threonylleucine (isomer of 809, 926) (delta mass: 113.0838 Da; putative annotation: NORLEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.233,"smiles":null,"spectrum_id":"CCMSLIB00017295259","spectrum_index":40368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 111.0316 Da; putative annotation: L-Pyroglutamic acid - 40.0 eV; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.113,"smiles":null,"spectrum_id":"CCMSLIB00017295261","spectrum_index":40369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 40.0 eV (delta mass: 242.0087 Da; putative annotation: (E)-1-Hydroxy-2-methylbut-2-enyl 4-diphosphate; putative formula: C6H12O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.046,"smiles":null,"spectrum_id":"CCMSLIB00017295263","spectrum_index":40370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 192.1872 Da; putative annotation: (Z,E)-Tetradeca-9,12-dienol; putative formula: C14H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.456,"smiles":null,"spectrum_id":"CCMSLIB00017295266","spectrum_index":40371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 288.2085 Da; putative annotation: Oxandrolone; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.332,"smiles":null,"spectrum_id":"CCMSLIB00017295268","spectrum_index":40372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 230.0571 Da; putative annotation: Asp-Asp; putative formula: C8H10N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.122,"smiles":null,"spectrum_id":"CCMSLIB00017295271","spectrum_index":40373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 146.0456 Da; putative annotation: 8-Amino-2H-1,4-benzoxazin-3(4H)-one; putative formula: C8H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.127,"smiles":null,"spectrum_id":"CCMSLIB00017295273","spectrum_index":40374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 136.125 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017295276","spectrum_index":40375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380158-01!2-[2-[2-[[2-[2-(2-hydroxypropanoylamino)-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoyl]oxypropanoylamino]-3-methylbutanoic acid (delta mass: 271.1403 Da; putative annotation: N/A; putative formula: C10H13N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":831.458,"smiles":null,"spectrum_id":"CCMSLIB00017295279","spectrum_index":40376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 282.0321 Da; putative annotation: N/A; putative formula: C4H2N12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.207,"smiles":null,"spectrum_id":"CCMSLIB00017295282","spectrum_index":40377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 571.2858 Da; putative annotation: N/A; putative formula: C28H42N7O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.39,"smiles":null,"spectrum_id":"CCMSLIB00017295283","spectrum_index":40378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 170.0469 Da; putative annotation: N/A; putative formula: C4H7N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.186,"smiles":null,"spectrum_id":"CCMSLIB00017295286","spectrum_index":40379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 52.0313 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.097,"smiles":null,"spectrum_id":"CCMSLIB00017295289","spectrum_index":40380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU022001 Labetalol|2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide (delta mass: 123.0823 Da; putative annotation: N/A; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.268,"smiles":null,"spectrum_id":"CCMSLIB00017295292","spectrum_index":40381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 127.9364 Da; putative annotation: N/A; putative formula: C7H-2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.09,"smiles":null,"spectrum_id":"CCMSLIB00017295294","spectrum_index":40382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C10:0 (delta mass: 155.1163 Da; putative annotation: N/A; putative formula: C6H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.359,"smiles":null,"spectrum_id":"CCMSLIB00017295297","spectrum_index":40383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylserotonin (delta mass: 209.1432 Da; putative annotation: N/A; putative formula: C11H20N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.256,"smiles":null,"spectrum_id":"CCMSLIB00017295300","spectrum_index":40384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 153.098 Da; putative annotation: N/A; putative formula: C9H15NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.193,"smiles":null,"spectrum_id":"CCMSLIB00017295303","spectrum_index":40385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 229.3303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.5,"smiles":null,"spectrum_id":"CCMSLIB00017295305","spectrum_index":40386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 27.9919 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.113,"smiles":null,"spectrum_id":"CCMSLIB00017295308","spectrum_index":40387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 29.0733 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.16,"smiles":null,"spectrum_id":"CCMSLIB00017295311","spectrum_index":40388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 115.0261 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.216,"smiles":null,"spectrum_id":"CCMSLIB00017295313","spectrum_index":40389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 333.1946 Da; putative annotation: N/A; putative formula: C12H27N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.385,"smiles":null,"spectrum_id":"CCMSLIB00017295316","spectrum_index":40390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 141.0598 Da; putative annotation: N/A; putative formula: C7H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.355,"smiles":null,"spectrum_id":"CCMSLIB00017295318","spectrum_index":40391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 511.2535 Da; putative annotation: N/A; putative formula: C17H37N9O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.35,"smiles":null,"spectrum_id":"CCMSLIB00017295321","spectrum_index":40392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 274.2509 Da; putative annotation: N/A; putative formula: C17H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.337,"smiles":null,"spectrum_id":"CCMSLIB00017295323","spectrum_index":40393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 306.1415 Da; putative annotation: N/A; putative formula: C16H24N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.223,"smiles":null,"spectrum_id":"CCMSLIB00017295326","spectrum_index":40394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 152.0841 Da; putative annotation: N/A; putative formula: C9H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.16,"smiles":null,"spectrum_id":"CCMSLIB00017295329","spectrum_index":40395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 79.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.108,"smiles":null,"spectrum_id":"CCMSLIB00017295332","spectrum_index":40396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 188.0432 Da; putative annotation: N/A; putative formula: C6H8N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.14,"smiles":null,"spectrum_id":"CCMSLIB00017295335","spectrum_index":40397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.128,"smiles":null,"spectrum_id":"CCMSLIB00017295337","spectrum_index":40398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 791.3495 Da; putative annotation: N/A; putative formula: C32H57N9O8S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.472,"smiles":null,"spectrum_id":"CCMSLIB00017295339","spectrum_index":40399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 24.9949 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.102,"smiles":null,"spectrum_id":"CCMSLIB00017295342","spectrum_index":40400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 69.0941 Da; putative annotation: N/A; putative formula: C5H11NO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.185,"smiles":null,"spectrum_id":"CCMSLIB00017295345","spectrum_index":40401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 125.0868 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.157,"smiles":null,"spectrum_id":"CCMSLIB00017295347","spectrum_index":40402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 121.2204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.301,"smiles":null,"spectrum_id":"CCMSLIB00017295349","spectrum_index":40403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 176.1511 Da; putative annotation: N/A; putative formula: C4H16N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.237,"smiles":null,"spectrum_id":"CCMSLIB00017295352","spectrum_index":40404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 29.44 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017295355","spectrum_index":40405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 29.4287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017295358","spectrum_index":40406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 401.1329 Da; putative annotation: N/A; putative formula: C18H27NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.234,"smiles":null,"spectrum_id":"CCMSLIB00017295360","spectrum_index":40407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutaryl-carnitine; AIF; CE30; MS2Dec (delta mass: 84.02 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.164,"smiles":null,"spectrum_id":"CCMSLIB00017295362","spectrum_index":40408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 324.1059 Da; putative annotation: N/A; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.229,"smiles":null,"spectrum_id":"CCMSLIB00017295365","spectrum_index":40409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 347.174 Da; putative annotation: N/A; putative formula: C12H25N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.328,"smiles":null,"spectrum_id":"CCMSLIB00017295368","spectrum_index":40410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole_3_butyric_acid (delta mass: 124.1314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.233,"smiles":null,"spectrum_id":"CCMSLIB00017295370","spectrum_index":40411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385712-01![5-chloro-3-[(1E,3E,5E)-hepta-1,3,5-trienyl]-7-methyl-6,8-dioxo-2H-isoquinolin-7-yl] 3,5-dihydroxyhexanoate (delta mass: 447.1391 Da; putative annotation: N/A; putative formula: C19H21N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.291,"smiles":null,"spectrum_id":"CCMSLIB00017295373","spectrum_index":40412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 454.1131 Da; putative annotation: N/A; putative formula: C13H24N6O8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.173,"smiles":null,"spectrum_id":"CCMSLIB00017295376","spectrum_index":40413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304041 p-Coumaraldehyde (delta mass: 126.0314 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017295378","spectrum_index":40414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 96.0579 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.16,"smiles":null,"spectrum_id":"CCMSLIB00017295381","spectrum_index":40415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 282.1565 Da; putative annotation: N/A; putative formula: C19H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.289,"smiles":null,"spectrum_id":"CCMSLIB00017295383","spectrum_index":40416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coniferaldehyde (delta mass: 411.1737 Da; putative annotation: N/A; putative formula: C29H21N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.244,"smiles":null,"spectrum_id":"CCMSLIB00017295386","spectrum_index":40417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 586.3865 Da; putative annotation: N/A; putative formula: C35H54O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.447,"smiles":null,"spectrum_id":"CCMSLIB00017295389","spectrum_index":40418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 281.1342 Da; putative annotation: N/A; putative formula: C9H15N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.288,"smiles":null,"spectrum_id":"CCMSLIB00017295392","spectrum_index":40419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 265.2773 Da; putative annotation: N/A; putative formula: C18H35N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.41,"smiles":null,"spectrum_id":"CCMSLIB00017295394","spectrum_index":40420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 478.315 Da; putative annotation: N/A; putative formula: C35H43O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.464,"smiles":null,"spectrum_id":"CCMSLIB00017295397","spectrum_index":40421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 522.3383 Da; putative annotation: N/A; putative formula: C30H50O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.487,"smiles":null,"spectrum_id":"CCMSLIB00017295399","spectrum_index":40422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.342,"smiles":null,"spectrum_id":"CCMSLIB00017295402","spectrum_index":40423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 388.2042 Da; putative annotation: N/A; putative formula: C19H36N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.358,"smiles":null,"spectrum_id":"CCMSLIB00017295405","spectrum_index":40424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leupeptin Pr-LL (delta mass: 325.167 Da; putative annotation: N/A; putative formula: C12H27N3O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.485,"smiles":null,"spectrum_id":"CCMSLIB00017295408","spectrum_index":40425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 48.1412 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.238,"smiles":null,"spectrum_id":"CCMSLIB00017295409","spectrum_index":40426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 119.0563 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.16,"smiles":null,"spectrum_id":"CCMSLIB00017295412","spectrum_index":40427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 9.9842 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.091,"smiles":null,"spectrum_id":"CCMSLIB00017295415","spectrum_index":40428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 241.0795 Da; putative annotation: N/A; putative formula: C7H15NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.16,"smiles":null,"spectrum_id":"CCMSLIB00017295417","spectrum_index":40429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 726.8619 Da; putative annotation: N/A; putative formula: C16H29N3O3S13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1013.01,"smiles":null,"spectrum_id":"CCMSLIB00017295419","spectrum_index":40430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1109.5518 Da; putative annotation: N/A; putative formula: C52H71N17O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1272.61,"smiles":null,"spectrum_id":"CCMSLIB00017295422","spectrum_index":40431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatinine (delta mass: 141.0803 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.146,"smiles":null,"spectrum_id":"CCMSLIB00017295425","spectrum_index":40432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 306.3257 Da; putative annotation: N/A; putative formula: C22H42)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.459,"smiles":null,"spectrum_id":"CCMSLIB00017295426","spectrum_index":40433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 91.0113 Da; putative annotation: N/A; putative formula: C2H7NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.057,"smiles":null,"spectrum_id":"CCMSLIB00017295429","spectrum_index":40434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 282.1545 Da; putative annotation: N/A; putative formula: C15H23ClN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.246,"smiles":null,"spectrum_id":"CCMSLIB00017295432","spectrum_index":40435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1199.5937 Da; putative annotation: N/A; putative formula: C53H81N15O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1362.65,"smiles":null,"spectrum_id":"CCMSLIB00017295435","spectrum_index":40436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 122.0255 Da; putative annotation: N/A; putative formula: CH6N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.164,"smiles":null,"spectrum_id":"CCMSLIB00017295436","spectrum_index":40437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 276.0839 Da; putative annotation: N/A; putative formula: C11H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.17,"smiles":null,"spectrum_id":"CCMSLIB00017295439","spectrum_index":40438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 264.0399 Da; putative annotation: N/A; putative formula: C9H13O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.1,"smiles":null,"spectrum_id":"CCMSLIB00017295442","spectrum_index":40439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 368.3445 Da; putative annotation: N/A; putative formula: C27H44)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.431,"smiles":null,"spectrum_id":"CCMSLIB00017295445","spectrum_index":40440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 77.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.087,"smiles":null,"spectrum_id":"CCMSLIB00017295447","spectrum_index":40441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,5-Hexadien-3-ol (delta mass: 24.0404 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":123.121,"smiles":null,"spectrum_id":"CCMSLIB00017295450","spectrum_index":40442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 187.119 Da; putative annotation: N/A; putative formula: C5H13N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.19,"smiles":null,"spectrum_id":"CCMSLIB00017295452","spectrum_index":40443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 14.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017295455","spectrum_index":40444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 51.0608 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.138,"smiles":null,"spectrum_id":"CCMSLIB00017295458","spectrum_index":40445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-L-phenylalanine (delta mass: 78.0837 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.16,"smiles":null,"spectrum_id":"CCMSLIB00017295460","spectrum_index":40446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 110.0325 Da; putative annotation: N/A; putative formula: C2H2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.134,"smiles":null,"spectrum_id":"CCMSLIB00017295463","spectrum_index":40447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 340.3082 Da; putative annotation: N/A; putative formula: C20H40N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.467,"smiles":null,"spectrum_id":"CCMSLIB00017295466","spectrum_index":40448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 121.089 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.144,"smiles":null,"spectrum_id":"CCMSLIB00017295469","spectrum_index":40449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 170.0567 Da; putative annotation: N/A; putative formula: C8H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.132,"smiles":null,"spectrum_id":"CCMSLIB00017295471","spectrum_index":40450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 11.0244 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.124,"smiles":null,"spectrum_id":"CCMSLIB00017295473","spectrum_index":40451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 25.9774 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.127,"smiles":null,"spectrum_id":"CCMSLIB00017295476","spectrum_index":40452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 281.0899 Da; putative annotation: N/A; putative formula: C13H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":948.319,"smiles":null,"spectrum_id":"CCMSLIB00017295478","spectrum_index":40453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 14.0241 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.105,"smiles":null,"spectrum_id":"CCMSLIB00017295481","spectrum_index":40454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 17.9041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.022,"smiles":null,"spectrum_id":"CCMSLIB00017295483","spectrum_index":40455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 76.0942 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.176,"smiles":null,"spectrum_id":"CCMSLIB00017295486","spectrum_index":40456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 356.2693 Da; putative annotation: N/A; putative formula: C20H32N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.382,"smiles":null,"spectrum_id":"CCMSLIB00017295489","spectrum_index":40457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatine - CASMI2016 Category 1 - Challenge 10 (delta mass: 115.05 Da; putative annotation: N/A; putative formula: C2H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.116,"smiles":null,"spectrum_id":"CCMSLIB00017295490","spectrum_index":40458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 107.1376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.233,"smiles":null,"spectrum_id":"CCMSLIB00017295493","spectrum_index":40459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 77.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.123,"smiles":null,"spectrum_id":"CCMSLIB00017295496","spectrum_index":40460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 78.0618 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.201,"smiles":null,"spectrum_id":"CCMSLIB00017295499","spectrum_index":40461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 78.0182 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.105,"smiles":null,"spectrum_id":"CCMSLIB00017295500","spectrum_index":40462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 52.0321 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.108,"smiles":null,"spectrum_id":"CCMSLIB00017295503","spectrum_index":40463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 36.0364 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017295506","spectrum_index":40464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Paxitriol (delta mass: 60.1153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.379,"smiles":null,"spectrum_id":"CCMSLIB00017295507","spectrum_index":40465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucrose (delta mass: 494.1796 Da; putative annotation: N/A; putative formula: C25H34O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":837.303,"smiles":null,"spectrum_id":"CCMSLIB00017295510","spectrum_index":40466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 88.0392 Da; putative annotation: N/A; putative formula: CH4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.13,"smiles":null,"spectrum_id":"CCMSLIB00017295513","spectrum_index":40467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 165.0255 Da; putative annotation: N/A; putative formula: C8H7NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.101,"smiles":null,"spectrum_id":"CCMSLIB00017295516","spectrum_index":40468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 61.9997 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.154,"smiles":null,"spectrum_id":"CCMSLIB00017295517","spectrum_index":40469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 657.4312 Da; putative annotation: N/A; putative formula: C42H60NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.58,"smiles":null,"spectrum_id":"CCMSLIB00017295520","spectrum_index":40470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy Mirtazapine (delta mass: 17.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.196,"smiles":null,"spectrum_id":"CCMSLIB00017295523","spectrum_index":40471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 479.2887 Da; putative annotation: N/A; putative formula: C26H41NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.412,"smiles":null,"spectrum_id":"CCMSLIB00017295526","spectrum_index":40472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 44.0448 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.152,"smiles":null,"spectrum_id":"CCMSLIB00017295527","spectrum_index":40473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 110.0376 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.124,"smiles":null,"spectrum_id":"CCMSLIB00017295530","spectrum_index":40474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 27.9326 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.024,"smiles":null,"spectrum_id":"CCMSLIB00017295533","spectrum_index":40475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 192.1883 Da; putative annotation: N/A; putative formula: C14H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.275,"smiles":null,"spectrum_id":"CCMSLIB00017295536","spectrum_index":40476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gentianose (delta mass: 108.0213 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.198,"smiles":null,"spectrum_id":"CCMSLIB00017295537","spectrum_index":40477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 194.0433 Da; putative annotation: N/A; putative formula: C9H11N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.134,"smiles":null,"spectrum_id":"CCMSLIB00017295540","spectrum_index":40478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 158.0395 Da; putative annotation: N/A; putative formula: C9H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.199,"smiles":null,"spectrum_id":"CCMSLIB00017295543","spectrum_index":40479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 23.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.06,"smiles":null,"spectrum_id":"CCMSLIB00017295546","spectrum_index":40480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 51.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.186,"smiles":null,"spectrum_id":"CCMSLIB00017295549","spectrum_index":40481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 61.0296 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.11,"smiles":null,"spectrum_id":"CCMSLIB00017295551","spectrum_index":40482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 173.1623 Da; putative annotation: N/A; putative formula: C7H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.238,"smiles":null,"spectrum_id":"CCMSLIB00017295553","spectrum_index":40483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 287.1095 Da; putative annotation: N/A; putative formula: C15H17N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.207,"smiles":null,"spectrum_id":"CCMSLIB00017295556","spectrum_index":40484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 45.0483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.14,"smiles":null,"spectrum_id":"CCMSLIB00017295559","spectrum_index":40485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 64.0309 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.128,"smiles":null,"spectrum_id":"CCMSLIB00017295562","spectrum_index":40486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 228.0079 Da; putative annotation: N/A; putative formula: C11H5N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.094,"smiles":null,"spectrum_id":"CCMSLIB00017295565","spectrum_index":40487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 214.255 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.31,"smiles":null,"spectrum_id":"CCMSLIB00017295566","spectrum_index":40488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 140.0955 Da; putative annotation: N/A; putative formula: C7H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.182,"smiles":null,"spectrum_id":"CCMSLIB00017295569","spectrum_index":40489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 301.1602 Da; putative annotation: N/A; putative formula: C18H24NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.283,"smiles":null,"spectrum_id":"CCMSLIB00017295572","spectrum_index":40490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-Methylphloracetophenone (delta mass: 222.2345 Da; putative annotation: N/A; putative formula: C16H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.3,"smiles":null,"spectrum_id":"CCMSLIB00017295574","spectrum_index":40491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Prolyl-L-leucylglycylamide (delta mass: 142.0997 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.292,"smiles":null,"spectrum_id":"CCMSLIB00017295576","spectrum_index":40492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 318.1301 Da; putative annotation: N/A; putative formula: C11H14N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.232,"smiles":null,"spectrum_id":"CCMSLIB00017295579","spectrum_index":40493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 57.0692 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.171,"smiles":null,"spectrum_id":"CCMSLIB00017295582","spectrum_index":40494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 109.0739 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.233,"smiles":null,"spectrum_id":"CCMSLIB00017295585","spectrum_index":40495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 489.2345 Da; putative annotation: N/A; putative formula: C23H35N7OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.358,"smiles":null,"spectrum_id":"CCMSLIB00017295588","spectrum_index":40496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 263.1726 Da; putative annotation: N/A; putative formula: C12H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.259,"smiles":null,"spectrum_id":"CCMSLIB00017295589","spectrum_index":40497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diaveridine (delta mass: 60.0102 Da; putative annotation: N/A; putative formula: C4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017295592","spectrum_index":40498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 86.052 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017295595","spectrum_index":40499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 606.7731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.859,"smiles":null,"spectrum_id":"CCMSLIB00017295597","spectrum_index":40500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 27.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017295599","spectrum_index":40501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-tert-Butyl-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 187.0789 Da; putative annotation: N/A; putative formula: C15H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.233,"smiles":null,"spectrum_id":"CCMSLIB00017295602","spectrum_index":40502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 30.0191 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.1,"smiles":null,"spectrum_id":"CCMSLIB00017295605","spectrum_index":40503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 16.4447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017295606","spectrum_index":40504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 149.0752 Da; putative annotation: N/A; putative formula: C9H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.166,"smiles":null,"spectrum_id":"CCMSLIB00017295609","spectrum_index":40505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 101.0842 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.233,"smiles":null,"spectrum_id":"CCMSLIB00017295612","spectrum_index":40506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 317.1148 Da; putative annotation: N/A; putative formula: C14H27NO-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.18,"smiles":null,"spectrum_id":"CCMSLIB00017295615","spectrum_index":40507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 339.1117 Da; putative annotation: N/A; putative formula: C20H21NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.235,"smiles":null,"spectrum_id":"CCMSLIB00017295617","spectrum_index":40508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 306.0911 Da; putative annotation: N/A; putative formula: C10H19N4O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.162,"smiles":null,"spectrum_id":"CCMSLIB00017295619","spectrum_index":40509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 30.0 eV (delta mass: 339.11 Da; putative annotation: N/A; putative formula: C11H21N3O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.234,"smiles":null,"spectrum_id":"CCMSLIB00017295622","spectrum_index":40510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(furan-2-ylmethyl)-3-methylbutanamide (delta mass: 345.124 Da; putative annotation: N/A; putative formula: C17H20N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":909.394,"smiles":null,"spectrum_id":"CCMSLIB00017295625","spectrum_index":40511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 437.2982 Da; putative annotation: N/A; putative formula: C26H39N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.447,"smiles":null,"spectrum_id":"CCMSLIB00017295626","spectrum_index":40512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 660.2986 Da; putative annotation: N/A; putative formula: C44H40N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":823.359,"smiles":null,"spectrum_id":"CCMSLIB00017295629","spectrum_index":40513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 213.0995 Da; putative annotation: N/A; putative formula: C10H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.18,"smiles":null,"spectrum_id":"CCMSLIB00017295632","spectrum_index":40514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 161.9113 Da; putative annotation: N/A; putative formula: C3H2P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.992,"smiles":null,"spectrum_id":"CCMSLIB00017295633","spectrum_index":40515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 24.0352 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.116,"smiles":null,"spectrum_id":"CCMSLIB00017295636","spectrum_index":40516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 241.0722 Da; putative annotation: N/A; putative formula: C8H12N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.12,"smiles":null,"spectrum_id":"CCMSLIB00017295639","spectrum_index":40517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 166.0739 Da; putative annotation: N/A; putative formula: C8H10N2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.134,"smiles":null,"spectrum_id":"CCMSLIB00017295642","spectrum_index":40518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Deoxypyridoxine (delta mass: 121.0187 Da; putative annotation: N/A; putative formula: C5H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.105,"smiles":null,"spectrum_id":"CCMSLIB00017295645","spectrum_index":40519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 147.0536 Da; putative annotation: N/A; putative formula: C6H13NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.124,"smiles":null,"spectrum_id":"CCMSLIB00017295646","spectrum_index":40520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 112.0517 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.169,"smiles":null,"spectrum_id":"CCMSLIB00017295649","spectrum_index":40521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 62.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.145,"smiles":null,"spectrum_id":"CCMSLIB00017295652","spectrum_index":40522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(5-fluoropentyl)- (delta mass: 133.0562 Da; putative annotation: N/A; putative formula: C5H11NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.18,"smiles":null,"spectrum_id":"CCMSLIB00017295654","spectrum_index":40523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 260.027 Da; putative annotation: N/A; putative formula: C13H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.151,"smiles":null,"spectrum_id":"CCMSLIB00017295656","spectrum_index":40524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 97.0529 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.155,"smiles":null,"spectrum_id":"CCMSLIB00017295659","spectrum_index":40525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 74.0616 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.158,"smiles":null,"spectrum_id":"CCMSLIB00017295662","spectrum_index":40526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol (delta mass: 60.0029 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.162,"smiles":null,"spectrum_id":"CCMSLIB00017295664","spectrum_index":40527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 162.1223 Da; putative annotation: N/A; putative formula: C4H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.165,"smiles":null,"spectrum_id":"CCMSLIB00017295666","spectrum_index":40528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:205060 (delta mass: 260.1584 Da; putative annotation: N/A; putative formula: C9H20N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.254,"smiles":null,"spectrum_id":"CCMSLIB00017295669","spectrum_index":40529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 26.917 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.014,"smiles":null,"spectrum_id":"CCMSLIB00017295672","spectrum_index":40530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 166.9893 Da; putative annotation: N/A; putative formula: C4H9NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.076,"smiles":null,"spectrum_id":"CCMSLIB00017295675","spectrum_index":40531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 162.0534 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.121,"smiles":null,"spectrum_id":"CCMSLIB00017295677","spectrum_index":40532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of n-methyl-2,4-dihydroxy-3-phenylquinoline (delta mass: 14.0113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.113,"smiles":null,"spectrum_id":"CCMSLIB00017295679","spectrum_index":40533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 92.1085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.185,"smiles":null,"spectrum_id":"CCMSLIB00017295682","spectrum_index":40534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 147.0538 Da; putative annotation: N/A; putative formula: C6H13NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.118,"smiles":null,"spectrum_id":"CCMSLIB00017295685","spectrum_index":40535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 75.0688 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.181,"smiles":null,"spectrum_id":"CCMSLIB00017295686","spectrum_index":40536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-pyrazole (delta mass: 27.0108 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":110.071,"smiles":null,"spectrum_id":"CCMSLIB00017295689","spectrum_index":40537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 72.076 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.156,"smiles":null,"spectrum_id":"CCMSLIB00017295692","spectrum_index":40538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00017368-03!BUCHARAINE (delta mass: 117.0544 Da; putative annotation: N/A; putative formula: C3H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.24,"smiles":null,"spectrum_id":"CCMSLIB00017295695","spectrum_index":40539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alline (delta mass: 252.0858 Da; putative annotation: N/A; putative formula: C10H12N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.204,"smiles":null,"spectrum_id":"CCMSLIB00017295696","spectrum_index":40540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 61.1272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.23,"smiles":null,"spectrum_id":"CCMSLIB00017295699","spectrum_index":40541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Azaindole (delta mass: 99.0683 Da; putative annotation: Norvaline; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.129,"smiles":null,"spectrum_id":"CCMSLIB00017295702","spectrum_index":40542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 216.1193 Da; putative annotation: Massbank:NA001274 Pterosin G|(S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-1H-inden-1-one|(2S)-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-2,3-dihydroinden-1-one; putative formula: C14H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.19,"smiles":null,"spectrum_id":"CCMSLIB00017295705","spectrum_index":40543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 99.0684 Da; putative annotation: L-Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017295706","spectrum_index":40544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kasugamycin (delta mass: 111.0725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.239,"smiles":null,"spectrum_id":"CCMSLIB00017295709","spectrum_index":40545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 138.0467 Da; putative annotation: N/A; putative formula: C11H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.17,"smiles":null,"spectrum_id":"CCMSLIB00017295712","spectrum_index":40546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 116.0467 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.196,"smiles":null,"spectrum_id":"CCMSLIB00017295713","spectrum_index":40547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 73.0978 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.184,"smiles":null,"spectrum_id":"CCMSLIB00017295716","spectrum_index":40548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 162.1237 Da; putative annotation: N/A; putative formula: C4H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.303,"smiles":null,"spectrum_id":"CCMSLIB00017295719","spectrum_index":40549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 26.9802 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.16,"smiles":null,"spectrum_id":"CCMSLIB00017295722","spectrum_index":40550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 200.0085 Da; putative annotation: N/A; putative formula: C4H9O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.079,"smiles":null,"spectrum_id":"CCMSLIB00017295724","spectrum_index":40551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 32.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.175,"smiles":null,"spectrum_id":"CCMSLIB00017295726","spectrum_index":40552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 138.0578 Da; putative annotation: N/A; putative formula: C10H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.181,"smiles":null,"spectrum_id":"CCMSLIB00017295729","spectrum_index":40553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Untitled CollisionEnergy:205060 (delta mass: 46.0412 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.112,"smiles":null,"spectrum_id":"CCMSLIB00017295732","spectrum_index":40554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.113,"smiles":null,"spectrum_id":"CCMSLIB00017295733","spectrum_index":40555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Acetyl-3-hydroxy-5-methylphenyl .beta.-D-glucopyranoside (delta mass: 24.0098 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.133,"smiles":null,"spectrum_id":"CCMSLIB00017295736","spectrum_index":40556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 701.2702 Da; putative annotation: N/A; putative formula: C39H40N7O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1044.39,"smiles":null,"spectrum_id":"CCMSLIB00017295739","spectrum_index":40557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 821.4199 Da; putative annotation: N/A; putative formula: C42H63NO15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1014.49,"smiles":null,"spectrum_id":"CCMSLIB00017295742","spectrum_index":40558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ADENOSINE 5'-MONOPHOSPHATE - 20.00 eV (delta mass: 308.2793 Da; putative annotation: N/A; putative formula: C15H32N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.35,"smiles":null,"spectrum_id":"CCMSLIB00017295743","spectrum_index":40559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 83.0372 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.182,"smiles":null,"spectrum_id":"CCMSLIB00017295746","spectrum_index":40560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 424.3683 Da; putative annotation: N/A; putative formula: C30H48O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1253.65,"smiles":null,"spectrum_id":"CCMSLIB00017295749","spectrum_index":40561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 294.1348 Da; putative annotation: N/A; putative formula: C13H30O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.195,"smiles":null,"spectrum_id":"CCMSLIB00017295752","spectrum_index":40562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 147.0767 Da; putative annotation: N/A; putative formula: C3H9N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.178,"smiles":null,"spectrum_id":"CCMSLIB00017295754","spectrum_index":40563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Epinephrine (delta mass: 144.0423 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017295756","spectrum_index":40564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 107.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.124,"smiles":null,"spectrum_id":"CCMSLIB00017295759","spectrum_index":40565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Acetyloxy)-2-naphthoic acid (delta mass: 32.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017295760","spectrum_index":40566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 329.3311 Da; putative annotation: N/A; putative formula: C16H39N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.428,"smiles":null,"spectrum_id":"CCMSLIB00017295763","spectrum_index":40567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Mevalonic acid lactone (delta mass: 108.0939 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017295766","spectrum_index":40568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 579.361 Da; putative annotation: N/A; putative formula: C41H45N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.432,"smiles":null,"spectrum_id":"CCMSLIB00017295769","spectrum_index":40569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 51.9947 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.055,"smiles":null,"spectrum_id":"CCMSLIB00017295771","spectrum_index":40570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 144.0401 Da; putative annotation: N/A; putative formula: C10H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.152,"smiles":null,"spectrum_id":"CCMSLIB00017295774","spectrum_index":40571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-(Methylenedioxy)cinnamic acid (delta mass: 12.0 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.049,"smiles":null,"spectrum_id":"CCMSLIB00017295777","spectrum_index":40572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Mannitol from NIST14 (delta mass: 254.1512 Da; putative annotation: N/A; putative formula: C14H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.237,"smiles":null,"spectrum_id":"CCMSLIB00017295780","spectrum_index":40573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 237.1483 Da; putative annotation: N/A; putative formula: C12H19N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.235,"smiles":null,"spectrum_id":"CCMSLIB00017295782","spectrum_index":40574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 46.0049 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.118,"smiles":null,"spectrum_id":"CCMSLIB00017295785","spectrum_index":40575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mannitol (delta mass: 202.1723 Da; putative annotation: N/A; putative formula: C15H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.259,"smiles":null,"spectrum_id":"CCMSLIB00017295788","spectrum_index":40576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 629.2174 Da; putative annotation: N/A; putative formula: C38H27N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.278,"smiles":null,"spectrum_id":"CCMSLIB00017295791","spectrum_index":40577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 68.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.129,"smiles":null,"spectrum_id":"CCMSLIB00017295793","spectrum_index":40578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethylselegiline (delta mass: 55.0158 Da; putative annotation: N/A; putative formula: CHN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.143,"smiles":null,"spectrum_id":"CCMSLIB00017295795","spectrum_index":40579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 76.1236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.183,"smiles":null,"spectrum_id":"CCMSLIB00017295798","spectrum_index":40580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 118.0862 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.198,"smiles":null,"spectrum_id":"CCMSLIB00017295801","spectrum_index":40581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 221.162 Da; putative annotation: N/A; putative formula: C14H23NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.31,"smiles":null,"spectrum_id":"CCMSLIB00017295803","spectrum_index":40582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Aminoethoxy)acetic acid (delta mass: 11.9945 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.06,"smiles":null,"spectrum_id":"CCMSLIB00017295805","spectrum_index":40583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 110.0468 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.206,"smiles":null,"spectrum_id":"CCMSLIB00017295808","spectrum_index":40584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 758.4237 Da; putative annotation: N/A; putative formula: C55H54N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":939.494,"smiles":null,"spectrum_id":"CCMSLIB00017295811","spectrum_index":40585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 10.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.18,"smiles":null,"spectrum_id":"CCMSLIB00017295813","spectrum_index":40586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-tetrahydro-6-methoxy-1-oxo-beta-carboline (delta mass: 99.0685 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.166,"smiles":null,"spectrum_id":"CCMSLIB00017295816","spectrum_index":40587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 266.0326 Da; putative annotation: N/A; putative formula: C14H6N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.093,"smiles":null,"spectrum_id":"CCMSLIB00017295818","spectrum_index":40588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 118.0626 Da; putative annotation: N/A; putative formula: C5H10O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.133,"smiles":null,"spectrum_id":"CCMSLIB00017295821","spectrum_index":40589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 351.1509 Da; putative annotation: N/A; putative formula: C19H29NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.305,"smiles":null,"spectrum_id":"CCMSLIB00017295824","spectrum_index":40590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 12.0364 Da; putative annotation: N/A; putative formula: C2H4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.102,"smiles":null,"spectrum_id":"CCMSLIB00017295826","spectrum_index":40591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 70.0495 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.147,"smiles":null,"spectrum_id":"CCMSLIB00017295828","spectrum_index":40592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 374.1261 Da; putative annotation: N/A; putative formula: C14H22N4O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.25,"smiles":null,"spectrum_id":"CCMSLIB00017295831","spectrum_index":40593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 95.0729 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.153,"smiles":null,"spectrum_id":"CCMSLIB00017295834","spectrum_index":40594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-3-hydroxylysergic acid diethylamide (delta mass: 102.0602 Da; putative annotation: N/A; putative formula: C5H11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.257,"smiles":null,"spectrum_id":"CCMSLIB00017295835","spectrum_index":40595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydrazinobenzoic acid (delta mass: 12.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.092,"smiles":null,"spectrum_id":"CCMSLIB00017295838","spectrum_index":40596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300757 Cephaeline (delta mass: 535.3145 Da; putative annotation: N/A; putative formula: C29H45NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1002.6,"smiles":null,"spectrum_id":"CCMSLIB00017295841","spectrum_index":40597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Man3 a (delta mass: 126.0287 Da; putative annotation: N/A; putative formula: C2H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1037.36,"smiles":null,"spectrum_id":"CCMSLIB00017295844","spectrum_index":40598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 821.2658 Da; putative annotation: N/A; putative formula: C51H40N3O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1164.39,"smiles":null,"spectrum_id":"CCMSLIB00017295846","spectrum_index":40599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zinterol (delta mass: 35.9952 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.164,"smiles":null,"spectrum_id":"CCMSLIB00017295848","spectrum_index":40600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 256.1795 Da; putative annotation: N/A; putative formula: C18H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.25,"smiles":null,"spectrum_id":"CCMSLIB00017295851","spectrum_index":40601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 205.0935 Da; putative annotation: N/A; putative formula: C5H7N11O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.159,"smiles":null,"spectrum_id":"CCMSLIB00017295854","spectrum_index":40602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 73.0947 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.29,"smiles":null,"spectrum_id":"CCMSLIB00017295857","spectrum_index":40603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 67.0976 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.178,"smiles":null,"spectrum_id":"CCMSLIB00017295859","spectrum_index":40604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 534.1687 Da; putative annotation: N/A; putative formula: C34H30O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.234,"smiles":null,"spectrum_id":"CCMSLIB00017295861","spectrum_index":40605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 81.0573 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.211,"smiles":null,"spectrum_id":"CCMSLIB00017295864","spectrum_index":40606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flindersine CollisionEnergy:102040 (delta mass: 36.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.123,"smiles":null,"spectrum_id":"CCMSLIB00017295867","spectrum_index":40607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Keto-L-gulonic acid (delta mass: 105.115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.165,"smiles":null,"spectrum_id":"CCMSLIB00017295870","spectrum_index":40608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 147.0896 Da; putative annotation: N/A; putative formula: C6H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.165,"smiles":null,"spectrum_id":"CCMSLIB00017295872","spectrum_index":40609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.118,"smiles":null,"spectrum_id":"CCMSLIB00017295874","spectrum_index":40610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 94.078 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017295877","spectrum_index":40611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-((1H-Imidazol-1-yl)methyl)-1H-indole (delta mass: 111.025 Da; putative annotation: N/A; putative formula: C4H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.128,"smiles":null,"spectrum_id":"CCMSLIB00017295880","spectrum_index":40612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 346.1538 Da; putative annotation: N/A; putative formula: C19H26N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.355,"smiles":null,"spectrum_id":"CCMSLIB00017295883","spectrum_index":40613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 129.0568 Da; putative annotation: N/A; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017295884","spectrum_index":40614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 125.0621 Da; putative annotation: N/A; putative formula: C10H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.149,"smiles":null,"spectrum_id":"CCMSLIB00017295887","spectrum_index":40615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-pyrazole (delta mass: 28.0312 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":111.092,"smiles":null,"spectrum_id":"CCMSLIB00017295890","spectrum_index":40616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 146.0538 Da; putative annotation: N/A; putative formula: C5H12N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.349,"smiles":null,"spectrum_id":"CCMSLIB00017295892","spectrum_index":40617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-((4-hydroxy-6-methyl-5-oxo-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl)furan-2-carboxamide (delta mass: 18.0145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.123,"smiles":null,"spectrum_id":"CCMSLIB00017295894","spectrum_index":40618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 31.0096 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.074,"smiles":null,"spectrum_id":"CCMSLIB00017295897","spectrum_index":40619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 240.1267 Da; putative annotation: N/A; putative formula: C15H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.224,"smiles":null,"spectrum_id":"CCMSLIB00017295900","spectrum_index":40620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 202.0825 Da; putative annotation: N/A; putative formula: C6H6N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.123,"smiles":null,"spectrum_id":"CCMSLIB00017295903","spectrum_index":40621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 162.1635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.302,"smiles":null,"spectrum_id":"CCMSLIB00017295904","spectrum_index":40622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 482.2514 Da; putative annotation: N/A; putative formula: C25H38O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.322,"smiles":null,"spectrum_id":"CCMSLIB00017295907","spectrum_index":40623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 104.0667 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.072,"smiles":null,"spectrum_id":"CCMSLIB00017295910","spectrum_index":40624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 71.0157 Da; putative annotation: N/A; putative formula: C6HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.102,"smiles":null,"spectrum_id":"CCMSLIB00017295912","spectrum_index":40625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-4,6-dimethoxyphenyl)ethanone (delta mass: 94.078 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017295914","spectrum_index":40626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 39.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.093,"smiles":null,"spectrum_id":"CCMSLIB00017295917","spectrum_index":40627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 16.9569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.07,"smiles":null,"spectrum_id":"CCMSLIB00017295920","spectrum_index":40628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 143.0544 Da; putative annotation: N/A; putative formula: C2H5N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.152,"smiles":null,"spectrum_id":"CCMSLIB00017295923","spectrum_index":40629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 14.015 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.127,"smiles":null,"spectrum_id":"CCMSLIB00017295924","spectrum_index":40630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(8-Chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethanone (delta mass: 45.9957 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.075,"smiles":null,"spectrum_id":"CCMSLIB00017295927","spectrum_index":40631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 13.0316 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.18,"smiles":null,"spectrum_id":"CCMSLIB00017295930","spectrum_index":40632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetaminophen (delta mass: 41.9974 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.068,"smiles":null,"spectrum_id":"CCMSLIB00017295932","spectrum_index":40633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 259.2758 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.367,"smiles":null,"spectrum_id":"CCMSLIB00017295935","spectrum_index":40634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 88.0668 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.127,"smiles":null,"spectrum_id":"CCMSLIB00017295937","spectrum_index":40635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 268.1483 Da; putative annotation: N/A; putative formula: C4H12N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.24,"smiles":null,"spectrum_id":"CCMSLIB00017295940","spectrum_index":40636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 381.2077 Da; putative annotation: N/A; putative formula: C21H36NO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.242,"smiles":null,"spectrum_id":"CCMSLIB00017295943","spectrum_index":40637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 351.1558 Da; putative annotation: N/A; putative formula: C13H26N3O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.233,"smiles":null,"spectrum_id":"CCMSLIB00017295945","spectrum_index":40638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phenol, 4-(2-aminoethyl)- from NIST14 (delta mass: 23.0159 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.107,"smiles":null,"spectrum_id":"CCMSLIB00017295948","spectrum_index":40639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 262.1049 Da; putative annotation: N/A; putative formula: C11H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.201,"smiles":null,"spectrum_id":"CCMSLIB00017295951","spectrum_index":40640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 164.0828 Da; putative annotation: N/A; putative formula: C4H13N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.174,"smiles":null,"spectrum_id":"CCMSLIB00017295953","spectrum_index":40641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 240.1149 Da; putative annotation: N/A; putative formula: C16H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.186,"smiles":null,"spectrum_id":"CCMSLIB00017295955","spectrum_index":40642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 113.0708 Da; putative annotation: N/A; putative formula: C3H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.121,"smiles":null,"spectrum_id":"CCMSLIB00017295958","spectrum_index":40643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 181.0697 Da; putative annotation: N/A; putative formula: C4H11N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.198,"smiles":null,"spectrum_id":"CCMSLIB00017295961","spectrum_index":40644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 18.0406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.041,"smiles":null,"spectrum_id":"CCMSLIB00017295963","spectrum_index":40645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 116.0306 Da; putative annotation: N/A; putative formula: C5H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.081,"smiles":null,"spectrum_id":"CCMSLIB00017295966","spectrum_index":40646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 212.1203 Da; putative annotation: N/A; putative formula: C15H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.191,"smiles":null,"spectrum_id":"CCMSLIB00017295969","spectrum_index":40647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 167.044 Da; putative annotation: N/A; putative formula: C5H5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.13,"smiles":null,"spectrum_id":"CCMSLIB00017295971","spectrum_index":40648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 74.0518 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017295974","spectrum_index":40649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.282,"smiles":null,"spectrum_id":"CCMSLIB00017295976","spectrum_index":40650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 42.1201 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.217,"smiles":null,"spectrum_id":"CCMSLIB00017295979","spectrum_index":40651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Oxomorphine (delta mass: 113.0838 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.207,"smiles":null,"spectrum_id":"CCMSLIB00017295982","spectrum_index":40652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.082,"smiles":null,"spectrum_id":"CCMSLIB00017295983","spectrum_index":40653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-isoleucine (delta mass: 75.0524 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.17,"smiles":null,"spectrum_id":"CCMSLIB00017295986","spectrum_index":40654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 167.1167 Da; putative annotation: N/A; putative formula: C7H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.198,"smiles":null,"spectrum_id":"CCMSLIB00017295989","spectrum_index":40655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (1S,15S,17S)-17-[(1S)-1-hydroxyethyl]-3,13-diazapentacyclo[13.3.1.0,?.0?,?.0,?]nonadeca-2(10),4,6,8-tetraene-1-carboxylate (delta mass: 332.1527 Da; putative annotation: N/A; putative formula: C14H28N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.354,"smiles":null,"spectrum_id":"CCMSLIB00017295992","spectrum_index":40656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 390.1522 Da; putative annotation: N/A; putative formula: C15H22N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.212,"smiles":null,"spectrum_id":"CCMSLIB00017295993","spectrum_index":40657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 106.0187 Da; putative annotation: N/A; putative formula: C3H7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.09,"smiles":null,"spectrum_id":"CCMSLIB00017295996","spectrum_index":40658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 120.0935 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.185,"smiles":null,"spectrum_id":"CCMSLIB00017295999","spectrum_index":40659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 98.0845 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.208,"smiles":null,"spectrum_id":"CCMSLIB00017296002","spectrum_index":40660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 386.0366 Da; putative annotation: N/A; putative formula: C29H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.108,"smiles":null,"spectrum_id":"CCMSLIB00017296003","spectrum_index":40661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 321.1234 Da; putative annotation: N/A; putative formula: C17H15N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":988.352,"smiles":null,"spectrum_id":"CCMSLIB00017296006","spectrum_index":40662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 45.948 Da; putative annotation: N/A; putative formula: H-2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.076,"smiles":null,"spectrum_id":"CCMSLIB00017296009","spectrum_index":40663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 110.0361 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.16,"smiles":null,"spectrum_id":"CCMSLIB00017296011","spectrum_index":40664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 118.0407 Da; putative annotation: N/A; putative formula: C2H7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.148,"smiles":null,"spectrum_id":"CCMSLIB00017296013","spectrum_index":40665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 725.3687 Da; putative annotation: N/A; putative formula: C43H47N7O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":880.439,"smiles":null,"spectrum_id":"CCMSLIB00017296016","spectrum_index":40666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 749.4704 Da; putative annotation: N/A; putative formula: C46H63N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.541,"smiles":null,"spectrum_id":"CCMSLIB00017296019","spectrum_index":40667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 98.0368 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017296021","spectrum_index":40668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 57.0539 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.134,"smiles":null,"spectrum_id":"CCMSLIB00017296023","spectrum_index":40669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 27.9231 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.983,"smiles":null,"spectrum_id":"CCMSLIB00017296026","spectrum_index":40670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-7-carboxaldehyde (delta mass: 94.0447 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.105,"smiles":null,"spectrum_id":"CCMSLIB00017296029","spectrum_index":40671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311111 Caffeoyl putrescin (isomer of 1060) (delta mass: 234.1367 Da; putative annotation: N/A; putative formula: C13H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.276,"smiles":null,"spectrum_id":"CCMSLIB00017296030","spectrum_index":40672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 198.1369 Da; putative annotation: N/A; putative formula: C10H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.229,"smiles":null,"spectrum_id":"CCMSLIB00017296033","spectrum_index":40673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptoline (delta mass: 179.0607 Da; putative annotation: N/A; putative formula: C8H10N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.168,"smiles":null,"spectrum_id":"CCMSLIB00017296036","spectrum_index":40674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 321.1777 Da; putative annotation: N/A; putative formula: C14H27NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.274,"smiles":null,"spectrum_id":"CCMSLIB00017296039","spectrum_index":40675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylose (delta mass: 58.0567 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017296040","spectrum_index":40676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 401.143 Da; putative annotation: N/A; putative formula: C16H23N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.204,"smiles":null,"spectrum_id":"CCMSLIB00017296043","spectrum_index":40677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 96.0211 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017296046","spectrum_index":40678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 228.0944 Da; putative annotation: N/A; putative formula: C3H8N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.191,"smiles":null,"spectrum_id":"CCMSLIB00017296049","spectrum_index":40679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1114.557 Da; putative annotation: N/A; putative formula: C77H78O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1295.63,"smiles":null,"spectrum_id":"CCMSLIB00017296051","spectrum_index":40680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 146.0477 Da; putative annotation: N/A; putative formula: C8H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.113,"smiles":null,"spectrum_id":"CCMSLIB00017296054","spectrum_index":40681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 962.4867 Da; putative annotation: N/A; putative formula: C30H50N36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1346.64,"smiles":null,"spectrum_id":"CCMSLIB00017296057","spectrum_index":40682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300072 Kopsinoline (delta mass: 17.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.217,"smiles":null,"spectrum_id":"CCMSLIB00017296059","spectrum_index":40683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 177.9401 Da; putative annotation: N/A; putative formula: C5H6O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.09,"smiles":null,"spectrum_id":"CCMSLIB00017296062","spectrum_index":40684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 161.0747 Da; putative annotation: N/A; putative formula: C10H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.244,"smiles":null,"spectrum_id":"CCMSLIB00017296065","spectrum_index":40685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 429.2566 Da; putative annotation: N/A; putative formula: C31H31N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.405,"smiles":null,"spectrum_id":"CCMSLIB00017296068","spectrum_index":40686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 78.0315 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.134,"smiles":null,"spectrum_id":"CCMSLIB00017296069","spectrum_index":40687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 810.4792 Da; putative annotation: N/A; putative formula: C45H62N8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":965.549,"smiles":null,"spectrum_id":"CCMSLIB00017296072","spectrum_index":40688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 146.0577 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.144,"smiles":null,"spectrum_id":"CCMSLIB00017296075","spectrum_index":40689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 140.1197 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.168,"smiles":null,"spectrum_id":"CCMSLIB00017296077","spectrum_index":40690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 96.0466 Da; putative annotation: N/A; putative formula: C6H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.165,"smiles":null,"spectrum_id":"CCMSLIB00017296079","spectrum_index":40691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:205060 (delta mass: 290.1748 Da; putative annotation: N/A; putative formula: C15H22N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.27,"smiles":null,"spectrum_id":"CCMSLIB00017296082","spectrum_index":40692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 153.0425 Da; putative annotation: N/A; putative formula: C7H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.166,"smiles":null,"spectrum_id":"CCMSLIB00017296084","spectrum_index":40693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 92.0642 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.124,"smiles":null,"spectrum_id":"CCMSLIB00017296086","spectrum_index":40694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 67.0787 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.134,"smiles":null,"spectrum_id":"CCMSLIB00017296089","spectrum_index":40695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 246.0677 Da; putative annotation: N/A; putative formula: C9H14N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.154,"smiles":null,"spectrum_id":"CCMSLIB00017296092","spectrum_index":40696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 88.0519 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.165,"smiles":null,"spectrum_id":"CCMSLIB00017296095","spectrum_index":40697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 237.0273 Da; putative annotation: N/A; putative formula: C10H7NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.176,"smiles":null,"spectrum_id":"CCMSLIB00017296096","spectrum_index":40698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-benzimidazol-5-amine (delta mass: 83.0505 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.137,"smiles":null,"spectrum_id":"CCMSLIB00017296099","spectrum_index":40699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myrtucommulone B (delta mass: 104.0075 Da; putative annotation: N/A; putative formula: C7H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.219,"smiles":null,"spectrum_id":"CCMSLIB00017296102","spectrum_index":40700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01042 Hexahydrocurcumin (delta mass: 119.0437 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.224,"smiles":null,"spectrum_id":"CCMSLIB00017296105","spectrum_index":40701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 95.0624 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.176,"smiles":null,"spectrum_id":"CCMSLIB00017296107","spectrum_index":40702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 118.0623 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.143,"smiles":null,"spectrum_id":"CCMSLIB00017296109","spectrum_index":40703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Allyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol (delta mass: 158.0334 Da; putative annotation: N/A; putative formula: C6H10N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.198,"smiles":null,"spectrum_id":"CCMSLIB00017296112","spectrum_index":40704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norpropoxyphene (delta mass: 76.0312 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.243,"smiles":null,"spectrum_id":"CCMSLIB00017296115","spectrum_index":40705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 258.1225 Da; putative annotation: N/A; putative formula: C12H22N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.19,"smiles":null,"spectrum_id":"CCMSLIB00017296118","spectrum_index":40706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 18.096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017296121","spectrum_index":40707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 279.2992 Da; putative annotation: N/A; putative formula: C18H37N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.57,"smiles":null,"spectrum_id":"CCMSLIB00017296122","spectrum_index":40708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 357.0949 Da; putative annotation: N/A; putative formula: C21H17N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.145,"smiles":null,"spectrum_id":"CCMSLIB00017296125","spectrum_index":40709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 39.0091 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.117,"smiles":null,"spectrum_id":"CCMSLIB00017296128","spectrum_index":40710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 41.0494 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.152,"smiles":null,"spectrum_id":"CCMSLIB00017296131","spectrum_index":40711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 114.0442 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":789.29,"smiles":null,"spectrum_id":"CCMSLIB00017296134","spectrum_index":40712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 208.0689 Da; putative annotation: N/A; putative formula: C8H17O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.166,"smiles":null,"spectrum_id":"CCMSLIB00017296135","spectrum_index":40713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 40.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017296138","spectrum_index":40714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 340.9806 Da; putative annotation: N/A; putative formula: C15H3NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.046,"smiles":null,"spectrum_id":"CCMSLIB00017296141","spectrum_index":40715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of imbricatine (delta mass: 68.0262 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.123,"smiles":null,"spectrum_id":"CCMSLIB00017296144","spectrum_index":40716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aflatoxin M1 (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.061,"smiles":null,"spectrum_id":"CCMSLIB00017296146","spectrum_index":40717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylserotonin (delta mass: 224.1327 Da; putative annotation: N/A; putative formula: C13H21OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.246,"smiles":null,"spectrum_id":"CCMSLIB00017296149","spectrum_index":40718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 299.1621 Da; putative annotation: N/A; putative formula: C17H21N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.248,"smiles":null,"spectrum_id":"CCMSLIB00017296151","spectrum_index":40719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 178.0627 Da; putative annotation: N/A; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.18,"smiles":null,"spectrum_id":"CCMSLIB00017296154","spectrum_index":40720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 478.2935 Da; putative annotation: N/A; putative formula: C30H43N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.391,"smiles":null,"spectrum_id":"CCMSLIB00017296157","spectrum_index":40721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-proline (delta mass: 299.2823 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.369,"smiles":null,"spectrum_id":"CCMSLIB00017296160","spectrum_index":40722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 147.0677 Da; putative annotation: 2-Amino-4'-methoxyacetophenone; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.138,"smiles":null,"spectrum_id":"CCMSLIB00017296162","spectrum_index":40723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 143.0579 Da; putative annotation: 2-Aminoadipic acid; AIF; CE0; MS2Dec; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.129,"smiles":null,"spectrum_id":"CCMSLIB00017296164","spectrum_index":40724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 281.2713 Da; putative annotation: 2S-Amino-4E-octadecene-1,3S-diol; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.448,"smiles":null,"spectrum_id":"CCMSLIB00017296167","spectrum_index":40725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione (delta mass: 154.0745 Da; putative annotation: Gly-Pro; putative formula: C7H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.203,"smiles":null,"spectrum_id":"CCMSLIB00017296170","spectrum_index":40726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 158.0972 Da; putative annotation: 2-(2-Butoxyethoxy)acetic acid; putative formula: C8H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.256,"smiles":null,"spectrum_id":"CCMSLIB00017296173","spectrum_index":40727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 172.048 Da; putative annotation: .alpha.-Asp-Gly; putative formula: C6H8N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.134,"smiles":null,"spectrum_id":"CCMSLIB00017296174","spectrum_index":40728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 162.068 Da; putative annotation: 3,5-Dimethyl-4-methoxybenzoic acid; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.217,"smiles":null,"spectrum_id":"CCMSLIB00017296177","spectrum_index":40729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 340.1886 Da; putative annotation: Farnesylthiosalicylic acid; putative formula: C22H28OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.248,"smiles":null,"spectrum_id":"CCMSLIB00017296180","spectrum_index":40730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Pro-Ile from NIST14 (delta mass: 97.0528 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.292,"smiles":null,"spectrum_id":"CCMSLIB00017296183","spectrum_index":40731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 336.2036 Da; putative annotation: 9.alpha.-Fluoro-17.alpha.-methyl-4-androstene-3.alpha.,6.beta.,11.beta.,17.beta.-tetrol; putative formula: C20H29FO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.306,"smiles":null,"spectrum_id":"CCMSLIB00017296184","spectrum_index":40732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 124.0369 Da; putative annotation: N/A; putative formula: N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.175,"smiles":null,"spectrum_id":"CCMSLIB00017296187","spectrum_index":40733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 74.0478 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.118,"smiles":null,"spectrum_id":"CCMSLIB00017296190","spectrum_index":40734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 144.1088 Da; putative annotation: N/A; putative formula: C7H16N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.189,"smiles":null,"spectrum_id":"CCMSLIB00017296193","spectrum_index":40735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 179.1314 Da; putative annotation: N/A; putative formula: C11H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.207,"smiles":null,"spectrum_id":"CCMSLIB00017296195","spectrum_index":40736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 279.0586 Da; putative annotation: N/A; putative formula: C7HN15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.15,"smiles":null,"spectrum_id":"CCMSLIB00017296197","spectrum_index":40737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 212.1203 Da; putative annotation: N/A; putative formula: C15H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017296200","spectrum_index":40738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 18.0138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.08,"smiles":null,"spectrum_id":"CCMSLIB00017296203","spectrum_index":40739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophol (delta mass: 354.1789 Da; putative annotation: N/A; putative formula: C17H26N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.27,"smiles":null,"spectrum_id":"CCMSLIB00017296205","spectrum_index":40740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1h-indole-3-butanoic acid (delta mass: 40.016 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.118,"smiles":null,"spectrum_id":"CCMSLIB00017296207","spectrum_index":40741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 43.9867 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.11,"smiles":null,"spectrum_id":"CCMSLIB00017296210","spectrum_index":40742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 256.0585 Da; putative annotation: N/A; putative formula: C6H9N8O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.118,"smiles":null,"spectrum_id":"CCMSLIB00017296213","spectrum_index":40743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 86.073 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.164,"smiles":null,"spectrum_id":"CCMSLIB00017296214","spectrum_index":40744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 224.1415 Da; putative annotation: N/A; putative formula: C13H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.254,"smiles":null,"spectrum_id":"CCMSLIB00017296217","spectrum_index":40745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 101.0249 Da; putative annotation: N/A; putative formula: CH4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.133,"smiles":null,"spectrum_id":"CCMSLIB00017296220","spectrum_index":40746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-(4-Chlorophenyl)ethyl](methyl)amine (delta mass: 101.0949 Da; putative annotation: N/A; putative formula: C4H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.168,"smiles":null,"spectrum_id":"CCMSLIB00017296223","spectrum_index":40747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sinoacutine (delta mass: 56.0557 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.21,"smiles":null,"spectrum_id":"CCMSLIB00017296224","spectrum_index":40748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 17.1089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.217,"smiles":null,"spectrum_id":"CCMSLIB00017296227","spectrum_index":40749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 783.4039 Da; putative annotation: N/A; putative formula: C37H49N15O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.49,"smiles":null,"spectrum_id":"CCMSLIB00017296230","spectrum_index":40750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 732.4449 Da; putative annotation: N/A; putative formula: C41H64O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.516,"smiles":null,"spectrum_id":"CCMSLIB00017296233","spectrum_index":40751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-pyrazol-3-amine (delta mass: 36.0303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.108,"smiles":null,"spectrum_id":"CCMSLIB00017296235","spectrum_index":40752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Chloro-9H-carbazole (delta mass: 62.1155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.157,"smiles":null,"spectrum_id":"CCMSLIB00017296237","spectrum_index":40753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 65.0586 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.16,"smiles":null,"spectrum_id":"CCMSLIB00017296240","spectrum_index":40754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 305.1112 Da; putative annotation: N/A; putative formula: C12H19NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.187,"smiles":null,"spectrum_id":"CCMSLIB00017296243","spectrum_index":40755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 27.0472 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.17,"smiles":null,"spectrum_id":"CCMSLIB00017296246","spectrum_index":40756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 8.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017296249","spectrum_index":40757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 100.0696 Da; putative annotation: N/A; putative formula: C6H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.203,"smiles":null,"spectrum_id":"CCMSLIB00017296250","spectrum_index":40758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 126.1049 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.186,"smiles":null,"spectrum_id":"CCMSLIB00017296253","spectrum_index":40759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 117.0788 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.207,"smiles":null,"spectrum_id":"CCMSLIB00017296256","spectrum_index":40760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 194.0176 Da; putative annotation: N/A; putative formula: C4H6N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.083,"smiles":null,"spectrum_id":"CCMSLIB00017296257","spectrum_index":40761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 131.0353 Da; putative annotation: N/A; putative formula: C2H6N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017296260","spectrum_index":40762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 90.0567 Da; putative annotation: N/A; putative formula: C6H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.148,"smiles":null,"spectrum_id":"CCMSLIB00017296263","spectrum_index":40763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 200.1743 Da; putative annotation: N/A; putative formula: C8H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.277,"smiles":null,"spectrum_id":"CCMSLIB00017296264","spectrum_index":40764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 756.233 Da; putative annotation: N/A; putative formula: C54H33N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":919.293,"smiles":null,"spectrum_id":"CCMSLIB00017296267","spectrum_index":40765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Valine, N-[[1-(5-fluoropentyl)-1H-indol-3-yl]carbonyl]-, methyl ester (delta mass: 71.0496 Da; putative annotation: N/A; putative formula: C2H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.257,"smiles":null,"spectrum_id":"CCMSLIB00017296270","spectrum_index":40766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloropurine riboside (delta mass: 278.1007 Da; putative annotation: N/A; putative formula: C14H19N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.155,"smiles":null,"spectrum_id":"CCMSLIB00017296271","spectrum_index":40767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 63.0463 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.164,"smiles":null,"spectrum_id":"CCMSLIB00017296274","spectrum_index":40768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one [IIN-based: Match] (delta mass: 258.0145 Da; putative annotation: N/A; putative formula: C10H6N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.117,"smiles":null,"spectrum_id":"CCMSLIB00017296277","spectrum_index":40769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Creatinine (delta mass: 99.9374 Da; putative annotation: N/A; putative formula: CH-2N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.004,"smiles":null,"spectrum_id":"CCMSLIB00017296280","spectrum_index":40770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 184.0887 Da; putative annotation: N/A; putative formula: C13H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.154,"smiles":null,"spectrum_id":"CCMSLIB00017296282","spectrum_index":40771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 185.0473 Da; putative annotation: N/A; putative formula: C11H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.144,"smiles":null,"spectrum_id":"CCMSLIB00017296284","spectrum_index":40772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 300.156 Da; putative annotation: N/A; putative formula: C12H16N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.268,"smiles":null,"spectrum_id":"CCMSLIB00017296287","spectrum_index":40773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 9.927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.987,"smiles":null,"spectrum_id":"CCMSLIB00017296289","spectrum_index":40774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 559.1352 Da; putative annotation: N/A; putative formula: C28H17N9O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.221,"smiles":null,"spectrum_id":"CCMSLIB00017296292","spectrum_index":40775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 133.0742 Da; putative annotation: N/A; putative formula: C5H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.16,"smiles":null,"spectrum_id":"CCMSLIB00017296294","spectrum_index":40776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxymethylmefenamic acid (delta mass: 63.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017296296","spectrum_index":40777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 992.5003 Da; putative annotation: N/A; putative formula: C53H68N8O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1155.56,"smiles":null,"spectrum_id":"CCMSLIB00017296299","spectrum_index":40778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 64.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.149,"smiles":null,"spectrum_id":"CCMSLIB00017296302","spectrum_index":40779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 353.1743 Da; putative annotation: N/A; putative formula: C20H23N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.297,"smiles":null,"spectrum_id":"CCMSLIB00017296303","spectrum_index":40780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Neplanocin A (delta mass: 117.0378 Da; putative annotation: N/A; putative formula: C3H7N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.147,"smiles":null,"spectrum_id":"CCMSLIB00017296306","spectrum_index":40781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 147.0349 Da; putative annotation: N/A; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.116,"smiles":null,"spectrum_id":"CCMSLIB00017296309","spectrum_index":40782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 284.2136 Da; putative annotation: N/A; putative formula: C20H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.289,"smiles":null,"spectrum_id":"CCMSLIB00017296310","spectrum_index":40783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 29.0508 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.122,"smiles":null,"spectrum_id":"CCMSLIB00017296313","spectrum_index":40784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 253.1046 Da; putative annotation: N/A; putative formula: C13H20NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.258,"smiles":null,"spectrum_id":"CCMSLIB00017296315","spectrum_index":40785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Quinolinone, 3-bromo-8-methoxy-2-methyl- (delta mass: 12.1088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.106,"smiles":null,"spectrum_id":"CCMSLIB00017296318","spectrum_index":40786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.alpha.-L-fucopyranosyl)-D-glucopyranose (delta mass: 680.2643 Da; putative annotation: N/A; putative formula: C42H40N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1048.42,"smiles":null,"spectrum_id":"CCMSLIB00017296320","spectrum_index":40787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 591.3807 Da; putative annotation: N/A; putative formula: C30H57NO8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.441,"smiles":null,"spectrum_id":"CCMSLIB00017296322","spectrum_index":40788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 59.0329 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.166,"smiles":null,"spectrum_id":"CCMSLIB00017296325","spectrum_index":40789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 78.0312 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.164,"smiles":null,"spectrum_id":"CCMSLIB00017296328","spectrum_index":40790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 74.0407 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.149,"smiles":null,"spectrum_id":"CCMSLIB00017296329","spectrum_index":40791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 94.0768 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.163,"smiles":null,"spectrum_id":"CCMSLIB00017296332","spectrum_index":40792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 40.9637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.061,"smiles":null,"spectrum_id":"CCMSLIB00017296335","spectrum_index":40793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 118.0264 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.107,"smiles":null,"spectrum_id":"CCMSLIB00017296336","spectrum_index":40794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 31.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.097,"smiles":null,"spectrum_id":"CCMSLIB00017296339","spectrum_index":40795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 35.0307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.128,"smiles":null,"spectrum_id":"CCMSLIB00017296341","spectrum_index":40796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 54.0604 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.132,"smiles":null,"spectrum_id":"CCMSLIB00017296343","spectrum_index":40797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 121.0499 Da; putative annotation: N/A; putative formula: C3H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.126,"smiles":null,"spectrum_id":"CCMSLIB00017296346","spectrum_index":40798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 39.0127 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.072,"smiles":null,"spectrum_id":"CCMSLIB00017296348","spectrum_index":40799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminophenylboronic acid (delta mass: 23.9948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.067,"smiles":null,"spectrum_id":"CCMSLIB00017296350","spectrum_index":40800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 68.0269 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.134,"smiles":null,"spectrum_id":"CCMSLIB00017296353","spectrum_index":40801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 274.1655 Da; putative annotation: N/A; putative formula: C12H18N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.262,"smiles":null,"spectrum_id":"CCMSLIB00017296355","spectrum_index":40802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 316.1348 Da; putative annotation: N/A; putative formula: C15H24O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.2,"smiles":null,"spectrum_id":"CCMSLIB00017296357","spectrum_index":40803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 495.2527 Da; putative annotation: N/A; putative formula: C24H33N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.323,"smiles":null,"spectrum_id":"CCMSLIB00017296360","spectrum_index":40804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 41.0507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.126,"smiles":null,"spectrum_id":"CCMSLIB00017296362","spectrum_index":40805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 18.9925 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.11,"smiles":null,"spectrum_id":"CCMSLIB00017296364","spectrum_index":40806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 35.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.165,"smiles":null,"spectrum_id":"CCMSLIB00017296367","spectrum_index":40807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 630.3666 Da; putative annotation: N/A; putative formula: C34H58N4O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.462,"smiles":null,"spectrum_id":"CCMSLIB00017296369","spectrum_index":40808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 72.032 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.134,"smiles":null,"spectrum_id":"CCMSLIB00017296371","spectrum_index":40809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 122.0732 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017296374","spectrum_index":40810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelenteramide (delta mass: 43.9888 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.154,"smiles":null,"spectrum_id":"CCMSLIB00017296377","spectrum_index":40811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 521.1957 Da; putative annotation: N/A; putative formula: C24H27N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.319,"smiles":null,"spectrum_id":"CCMSLIB00017296379","spectrum_index":40812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 557.0807 Da; putative annotation: N/A; putative formula: C18H27N3O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.204,"smiles":null,"spectrum_id":"CCMSLIB00017296381","spectrum_index":40813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 52.9327 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.04,"smiles":null,"spectrum_id":"CCMSLIB00017296384","spectrum_index":40814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 184.1213 Da; putative annotation: N/A; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.228,"smiles":null,"spectrum_id":"CCMSLIB00017296387","spectrum_index":40815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 116.036 Da; putative annotation: N/A; putative formula: C7H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.175,"smiles":null,"spectrum_id":"CCMSLIB00017296390","spectrum_index":40816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 54.1196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017296391","spectrum_index":40817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1,9-dihydro-8-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-6H-purin-6-one (delta mass: 120.0357 Da; putative annotation: N/A; putative formula: C3H8N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.117,"smiles":null,"spectrum_id":"CCMSLIB00017296394","spectrum_index":40818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 245.0896 Da; putative annotation: N/A; putative formula: C10H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.17,"smiles":null,"spectrum_id":"CCMSLIB00017296397","spectrum_index":40819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 48.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.076,"smiles":null,"spectrum_id":"CCMSLIB00017296400","spectrum_index":40820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 248.0845 Da; putative annotation: N/A; putative formula: C10H12N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.244,"smiles":null,"spectrum_id":"CCMSLIB00017296401","spectrum_index":40821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 206.0954 Da; putative annotation: N/A; putative formula: C13H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.229,"smiles":null,"spectrum_id":"CCMSLIB00017296404","spectrum_index":40822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-8H-[1,3]dioxolo[4,5-g]indole-7-carboxylic acid (delta mass: 41.9871 Da; putative annotation: N/A; putative formula: H-2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.942,"smiles":null,"spectrum_id":"CCMSLIB00017296407","spectrum_index":40823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 135.0432 Da; putative annotation: N/A; putative formula: C6H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.108,"smiles":null,"spectrum_id":"CCMSLIB00017296409","spectrum_index":40824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Pro (delta mass: 115.0267 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.181,"smiles":null,"spectrum_id":"CCMSLIB00017296412","spectrum_index":40825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 99.0686 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.212,"smiles":null,"spectrum_id":"CCMSLIB00017296414","spectrum_index":40826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 142.0838 Da; putative annotation: N/A; putative formula: CH6N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.166,"smiles":null,"spectrum_id":"CCMSLIB00017296417","spectrum_index":40827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 163.0475 Da; putative annotation: N/A; putative formula: C5H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.134,"smiles":null,"spectrum_id":"CCMSLIB00017296419","spectrum_index":40828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 96.058 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017296422","spectrum_index":40829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 104.0619 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.111,"smiles":null,"spectrum_id":"CCMSLIB00017296424","spectrum_index":40830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 55.9892 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.091,"smiles":null,"spectrum_id":"CCMSLIB00017296427","spectrum_index":40831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 50.0528 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.097,"smiles":null,"spectrum_id":"CCMSLIB00017296429","spectrum_index":40832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 162.0895 Da; putative annotation: N/A; putative formula: C7H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.186,"smiles":null,"spectrum_id":"CCMSLIB00017296432","spectrum_index":40833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 214.749 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.851,"smiles":null,"spectrum_id":"CCMSLIB00017296435","spectrum_index":40834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 109.0499 Da; putative annotation: N/A; putative formula: C2H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.203,"smiles":null,"spectrum_id":"CCMSLIB00017296436","spectrum_index":40835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 520.1223 Da; putative annotation: N/A; putative formula: C27H25N2O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.182,"smiles":null,"spectrum_id":"CCMSLIB00017296439","spectrum_index":40836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:102040 (delta mass: 362.1599 Da; putative annotation: N/A; putative formula: C18H26N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.255,"smiles":null,"spectrum_id":"CCMSLIB00017296441","spectrum_index":40837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 481.3031 Da; putative annotation: N/A; putative formula: C30H45NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.384,"smiles":null,"spectrum_id":"CCMSLIB00017296444","spectrum_index":40838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 291.1544 Da; putative annotation: N/A; putative formula: C10H21N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.309,"smiles":null,"spectrum_id":"CCMSLIB00017296446","spectrum_index":40839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 140.0936 Da; putative annotation: N/A; putative formula: C3H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.18,"smiles":null,"spectrum_id":"CCMSLIB00017296449","spectrum_index":40840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid (delta mass: 97.0597 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.155,"smiles":null,"spectrum_id":"CCMSLIB00017296451","spectrum_index":40841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 98.0006 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.05,"smiles":null,"spectrum_id":"CCMSLIB00017296453","spectrum_index":40842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 16.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.19,"smiles":null,"spectrum_id":"CCMSLIB00017296456","spectrum_index":40843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 434.1212 Da; putative annotation: N/A; putative formula: C21H22O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.218,"smiles":null,"spectrum_id":"CCMSLIB00017296458","spectrum_index":40844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3-Indolylmethylene)barbituric acid (delta mass: 32.9747 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.046,"smiles":null,"spectrum_id":"CCMSLIB00017296460","spectrum_index":40845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00017 Biotin (delta mass: 85.0382 Da; putative annotation: N/A; putative formula: CH3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.134,"smiles":null,"spectrum_id":"CCMSLIB00017296463","spectrum_index":40846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 104.0601 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.131,"smiles":null,"spectrum_id":"CCMSLIB00017296466","spectrum_index":40847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 616.4301 Da; putative annotation: N/A; putative formula: C34H67O3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":753.465,"smiles":null,"spectrum_id":"CCMSLIB00017296468","spectrum_index":40848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 228.1154 Da; putative annotation: N/A; putative formula: C8H16N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017296470","spectrum_index":40849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 34.039 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.136,"smiles":null,"spectrum_id":"CCMSLIB00017296472","spectrum_index":40850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 192.1289 Da; putative annotation: N/A; putative formula: C16H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.231,"smiles":null,"spectrum_id":"CCMSLIB00017296475","spectrum_index":40851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 90.0307 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.117,"smiles":null,"spectrum_id":"CCMSLIB00017296478","spectrum_index":40852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 7.4032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017296479","spectrum_index":40853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 56.0534 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.187,"smiles":null,"spectrum_id":"CCMSLIB00017296482","spectrum_index":40854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dexmedetomidine (delta mass: 27.0572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.196,"smiles":null,"spectrum_id":"CCMSLIB00017296485","spectrum_index":40855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine - 40.0 eV (delta mass: 75.032 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.139,"smiles":null,"spectrum_id":"CCMSLIB00017296486","spectrum_index":40856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 35.0134 Da; putative annotation: N/A; putative formula: C3HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.1,"smiles":null,"spectrum_id":"CCMSLIB00017296489","spectrum_index":40857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyl-DL-serine (delta mass: 24.0045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.07,"smiles":null,"spectrum_id":"CCMSLIB00017296492","spectrum_index":40858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 12.4654 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.5,"smiles":null,"spectrum_id":"CCMSLIB00017296493","spectrum_index":40859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 337.1789 Da; putative annotation: N/A; putative formula: C20H23N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.348,"smiles":null,"spectrum_id":"CCMSLIB00017296496","spectrum_index":40860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 344.1739 Da; putative annotation: N/A; putative formula: C19H24N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.26,"smiles":null,"spectrum_id":"CCMSLIB00017296499","spectrum_index":40861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 187.9872 Da; putative annotation: N/A; putative formula: C6H5O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.063,"smiles":null,"spectrum_id":"CCMSLIB00017296501","spectrum_index":40862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 827.5235 Da; putative annotation: N/A; putative formula: C53H69N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1049.62,"smiles":null,"spectrum_id":"CCMSLIB00017296504","spectrum_index":40863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 275.2684 Da; putative annotation: N/A; putative formula: C18H33N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.544,"smiles":null,"spectrum_id":"CCMSLIB00017296507","spectrum_index":40864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 240.1878 Da; putative annotation: N/A; putative formula: C18H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.259,"smiles":null,"spectrum_id":"CCMSLIB00017296509","spectrum_index":40865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 75.0321 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.108,"smiles":null,"spectrum_id":"CCMSLIB00017296512","spectrum_index":40866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 41.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.159,"smiles":null,"spectrum_id":"CCMSLIB00017296514","spectrum_index":40867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 567.3975 Da; putative annotation: N/A; putative formula: C41H49N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.546,"smiles":null,"spectrum_id":"CCMSLIB00017296517","spectrum_index":40868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 64.0313 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.128,"smiles":null,"spectrum_id":"CCMSLIB00017296520","spectrum_index":40869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 828.2754 Da; putative annotation: N/A; putative formula: C27H56N6O15P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1333.45,"smiles":null,"spectrum_id":"CCMSLIB00017296523","spectrum_index":40870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 175.0627 Da; putative annotation: N/A; putative formula: C4H10N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.17,"smiles":null,"spectrum_id":"CCMSLIB00017296525","spectrum_index":40871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Benzimidazol-2-one, 1-ethyl-1,3-dihydro- (delta mass: 32.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017296527","spectrum_index":40872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNT (delta mass: 96.0195 Da; putative annotation: N/A; putative formula: CN6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.275,"smiles":null,"spectrum_id":"CCMSLIB00017296530","spectrum_index":40873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 231.0892 Da; putative annotation: N/A; putative formula: C13H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.165,"smiles":null,"spectrum_id":"CCMSLIB00017296533","spectrum_index":40874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 584.2153 Da; putative annotation: N/A; putative formula: C25H36N4O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.274,"smiles":null,"spectrum_id":"CCMSLIB00017296536","spectrum_index":40875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 117.9228 Da; putative annotation: N/A; putative formula: CH-1N2O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.072,"smiles":null,"spectrum_id":"CCMSLIB00017296537","spectrum_index":40876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 27.9562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.042,"smiles":null,"spectrum_id":"CCMSLIB00017296540","spectrum_index":40877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 36.036 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.326,"smiles":null,"spectrum_id":"CCMSLIB00017296543","spectrum_index":40878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301257 Ellipticine (delta mass: 31.0664 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.189,"smiles":null,"spectrum_id":"CCMSLIB00017296546","spectrum_index":40879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 4.9965 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.077,"smiles":null,"spectrum_id":"CCMSLIB00017296547","spectrum_index":40880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 34.8841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.955,"smiles":null,"spectrum_id":"CCMSLIB00017296550","spectrum_index":40881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 120.0186 Da; putative annotation: N/A; putative formula: C3N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.115,"smiles":null,"spectrum_id":"CCMSLIB00017296553","spectrum_index":40882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 375.3712 Da; putative annotation: N/A; putative formula: C23H45N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.431,"smiles":null,"spectrum_id":"CCMSLIB00017296556","spectrum_index":40883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 216.9169 Da; putative annotation: N/A; putative formula: C6H3NS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.928,"smiles":null,"spectrum_id":"CCMSLIB00017296557","spectrum_index":40884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 483.9293 Da; putative annotation: N/A; putative formula: C11H16O11S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.0,"smiles":null,"spectrum_id":"CCMSLIB00017296560","spectrum_index":40885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 276.1824 Da; putative annotation: N/A; putative formula: C12H20N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.22,"smiles":null,"spectrum_id":"CCMSLIB00017296563","spectrum_index":40886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazo[4,5-c]pyridin-4-amine (delta mass: 39.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.13,"smiles":null,"spectrum_id":"CCMSLIB00017296566","spectrum_index":40887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 326.2459 Da; putative annotation: N/A; putative formula: C19H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.317,"smiles":null,"spectrum_id":"CCMSLIB00017296567","spectrum_index":40888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of n-methyl-2,4-dihydroxy-3-phenylquinoline (delta mass: 162.0602 Da; putative annotation: N/A; putative formula: C10H11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.162,"smiles":null,"spectrum_id":"CCMSLIB00017296570","spectrum_index":40889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GLUCOSAMINE (delta mass: 264.2452 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.332,"smiles":null,"spectrum_id":"CCMSLIB00017296572","spectrum_index":40890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 118.1148 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.243,"smiles":null,"spectrum_id":"CCMSLIB00017296574","spectrum_index":40891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 96.0197 Da; putative annotation: N/A; putative formula: CN6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.111,"smiles":null,"spectrum_id":"CCMSLIB00017296577","spectrum_index":40892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 99.0321 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017296580","spectrum_index":40893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cephradine (delta mass: 217.1179 Da; putative annotation: N/A; putative formula: C7H15N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.235,"smiles":null,"spectrum_id":"CCMSLIB00017296583","spectrum_index":40894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 110.0455 Da; putative annotation: N/A; putative formula: CH2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.086,"smiles":null,"spectrum_id":"CCMSLIB00017296585","spectrum_index":40895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 88.0597 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.208,"smiles":null,"spectrum_id":"CCMSLIB00017296587","spectrum_index":40896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 180.1112 Da; putative annotation: N/A; putative formula: C7H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.192,"smiles":null,"spectrum_id":"CCMSLIB00017296590","spectrum_index":40897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 98.0365 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017296593","spectrum_index":40898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 71.0737 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.144,"smiles":null,"spectrum_id":"CCMSLIB00017296596","spectrum_index":40899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 39.9004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.977,"smiles":null,"spectrum_id":"CCMSLIB00017296598","spectrum_index":40900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 15.9819 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.058,"smiles":null,"spectrum_id":"CCMSLIB00017296600","spectrum_index":40901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 71.0314 Da; putative annotation: N/A; putative formula: C3H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.091,"smiles":null,"spectrum_id":"CCMSLIB00017296603","spectrum_index":40902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 22.8861 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.972,"smiles":null,"spectrum_id":"CCMSLIB00017296606","spectrum_index":40903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 70.0037 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.038,"smiles":null,"spectrum_id":"CCMSLIB00017296607","spectrum_index":40904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 130.2061 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.297,"smiles":null,"spectrum_id":"CCMSLIB00017296610","spectrum_index":40905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 163.0835 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.159,"smiles":null,"spectrum_id":"CCMSLIB00017296613","spectrum_index":40906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 146.0732 Da; putative annotation: 1-(2-Hydroxy-4,5-dimethylphenyl)ethanone; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.17,"smiles":null,"spectrum_id":"CCMSLIB00017296614","spectrum_index":40907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 129.0405 Da; putative annotation: Massbank:PB000461 Glutamic acid|2-aminopentanedioic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.164,"smiles":null,"spectrum_id":"CCMSLIB00017296617","spectrum_index":40908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 141.1153 Da; putative annotation: Pregabalin; putative formula: C8H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.186,"smiles":null,"spectrum_id":"CCMSLIB00017296620","spectrum_index":40909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 85.0888 Da; putative annotation: 3-Aminopentan-2-ol; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.128,"smiles":null,"spectrum_id":"CCMSLIB00017296623","spectrum_index":40910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 298.1781 Da; putative annotation: NCGC00381270-01!(5E)-4,7,8-trihydroxy-2-(2-hydroxypentyl)-9,9-dimethyl-3,4,7,8-tetrahydro-2H-oxecin-10-one; putative formula: C16H26O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.347,"smiles":null,"spectrum_id":"CCMSLIB00017296625","spectrum_index":40911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of Isosorbide (delta mass: 152.0463 Da; putative annotation: \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\"; putative formula: C8H8O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017296627","spectrum_index":40912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 288.3001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.36,"smiles":null,"spectrum_id":"CCMSLIB00017296630","spectrum_index":40913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 387.2069 Da; putative annotation: N/A; putative formula: C21H30N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.377,"smiles":null,"spectrum_id":"CCMSLIB00017296633","spectrum_index":40914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 176.1026 Da; putative annotation: N/A; putative formula: C12H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.282,"smiles":null,"spectrum_id":"CCMSLIB00017296634","spectrum_index":40915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dioxy-creatinine - 40.0 eV (delta mass: 84.0938 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.144,"smiles":null,"spectrum_id":"CCMSLIB00017296637","spectrum_index":40916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 256.85 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.92,"smiles":null,"spectrum_id":"CCMSLIB00017296640","spectrum_index":40917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 74.0007 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.108,"smiles":null,"spectrum_id":"CCMSLIB00017296643","spectrum_index":40918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 293.1788 Da; putative annotation: N/A; putative formula: C13H23N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.343,"smiles":null,"spectrum_id":"CCMSLIB00017296644","spectrum_index":40919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 41.0139 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.122,"smiles":null,"spectrum_id":"CCMSLIB00017296647","spectrum_index":40920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 283.1236 Da; putative annotation: N/A; putative formula: C16H18N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.215,"smiles":null,"spectrum_id":"CCMSLIB00017296650","spectrum_index":40921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 336.1673 Da; putative annotation: N/A; putative formula: C14H16N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.229,"smiles":null,"spectrum_id":"CCMSLIB00017296652","spectrum_index":40922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 390.1509 Da; putative annotation: N/A; putative formula: C14H26N6O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.246,"smiles":null,"spectrum_id":"CCMSLIB00017296654","spectrum_index":40923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 325.1551 Da; putative annotation: N/A; putative formula: C15H24N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.246,"smiles":null,"spectrum_id":"CCMSLIB00017296657","spectrum_index":40924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 35.0468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.128,"smiles":null,"spectrum_id":"CCMSLIB00017296659","spectrum_index":40925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 276.0996 Da; putative annotation: N/A; putative formula: C15H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.165,"smiles":null,"spectrum_id":"CCMSLIB00017296661","spectrum_index":40926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 120.0425 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.134,"smiles":null,"spectrum_id":"CCMSLIB00017296664","spectrum_index":40927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of haplamine (delta mass: 129.9564 Da; putative annotation: N/A; putative formula: C2H-1N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.069,"smiles":null,"spectrum_id":"CCMSLIB00017296667","spectrum_index":40928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 166.1151 Da; putative annotation: N/A; putative formula: C14H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.186,"smiles":null,"spectrum_id":"CCMSLIB00017296668","spectrum_index":40929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 16.9379 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.025,"smiles":null,"spectrum_id":"CCMSLIB00017296671","spectrum_index":40930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 294.0884 Da; putative annotation: N/A; putative formula: C10H18N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.175,"smiles":null,"spectrum_id":"CCMSLIB00017296673","spectrum_index":40931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 60.0592 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.14,"smiles":null,"spectrum_id":"CCMSLIB00017296676","spectrum_index":40932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 341.0935 Da; putative annotation: N/A; putative formula: C15H19NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.174,"smiles":null,"spectrum_id":"CCMSLIB00017296679","spectrum_index":40933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 35.0375 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017296681","spectrum_index":40934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 137.0904 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.155,"smiles":null,"spectrum_id":"CCMSLIB00017296684","spectrum_index":40935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 282.1239 Da; putative annotation: N/A; putative formula: C12H19N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.194,"smiles":null,"spectrum_id":"CCMSLIB00017296686","spectrum_index":40936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:205060 (delta mass: 185.1777 Da; putative annotation: N/A; putative formula: C11H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.237,"smiles":null,"spectrum_id":"CCMSLIB00017296689","spectrum_index":40937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 21.9911 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.078,"smiles":null,"spectrum_id":"CCMSLIB00017296692","spectrum_index":40938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 67.0784 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.144,"smiles":null,"spectrum_id":"CCMSLIB00017296695","spectrum_index":40939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00005 Foliosidine|8-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-1-methylhydroquinolin-2-one (delta mass: 170.1305 Da; putative annotation: N/A; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.28,"smiles":null,"spectrum_id":"CCMSLIB00017296697","spectrum_index":40940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 234.1538 Da; putative annotation: N/A; putative formula: C15H23P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.323,"smiles":null,"spectrum_id":"CCMSLIB00017296699","spectrum_index":40941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 218.2037 Da; putative annotation: N/A; putative formula: C16H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.29,"smiles":null,"spectrum_id":"CCMSLIB00017296702","spectrum_index":40942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 192.1141 Da; putative annotation: N/A; putative formula: C6H17N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.169,"smiles":null,"spectrum_id":"CCMSLIB00017296705","spectrum_index":40943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 87.0418 Da; putative annotation: N/A; putative formula: C2H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.165,"smiles":null,"spectrum_id":"CCMSLIB00017296707","spectrum_index":40944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 186.1249 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017296709","spectrum_index":40945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Dihydroxy-1,3-dimethylimidazolidin-2-one (delta mass: 57.0208 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.097,"smiles":null,"spectrum_id":"CCMSLIB00017296712","spectrum_index":40946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 60.0689 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.129,"smiles":null,"spectrum_id":"CCMSLIB00017296715","spectrum_index":40947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 205.1109 Da; putative annotation: N/A; putative formula: C12H15NO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.181,"smiles":null,"spectrum_id":"CCMSLIB00017296716","spectrum_index":40948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 312.1568 Da; putative annotation: N/A; putative formula: C16H24O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.216,"smiles":null,"spectrum_id":"CCMSLIB00017296719","spectrum_index":40949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of histamine-C4:0 (delta mass: 19.9973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.126,"smiles":null,"spectrum_id":"CCMSLIB00017296721","spectrum_index":40950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 352.1948 Da; putative annotation: N/A; putative formula: C23H29OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.26,"smiles":null,"spectrum_id":"CCMSLIB00017296724","spectrum_index":40951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 162.0751 Da; putative annotation: N/A; putative formula: C4H10N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.173,"smiles":null,"spectrum_id":"CCMSLIB00017296726","spectrum_index":40952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 421.2723 Da; putative annotation: N/A; putative formula: C26H35N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.368,"smiles":null,"spectrum_id":"CCMSLIB00017296729","spectrum_index":40953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 36.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.143,"smiles":null,"spectrum_id":"CCMSLIB00017296731","spectrum_index":40954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 141.0786 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.17,"smiles":null,"spectrum_id":"CCMSLIB00017296733","spectrum_index":40955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 65.0651 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.24,"smiles":null,"spectrum_id":"CCMSLIB00017296736","spectrum_index":40956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 340.0214 Da; putative annotation: N/A; putative formula: C12H21OPS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.108,"smiles":null,"spectrum_id":"CCMSLIB00017296739","spectrum_index":40957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 158.9957 Da; putative annotation: N/A; putative formula: C8HNO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.098,"smiles":null,"spectrum_id":"CCMSLIB00017296741","spectrum_index":40958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 421.1738 Da; putative annotation: N/A; putative formula: C21H27NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.307,"smiles":null,"spectrum_id":"CCMSLIB00017296744","spectrum_index":40959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,10,11-Trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-1-ol (delta mass: 287.1396 Da; putative annotation: N/A; putative formula: C12H22N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.31,"smiles":null,"spectrum_id":"CCMSLIB00017296746","spectrum_index":40960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2,2,2-trifluoroethanamine (delta mass: 16.9738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.058,"smiles":null,"spectrum_id":"CCMSLIB00017296749","spectrum_index":40961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 142.1447 Da; putative annotation: N/A; putative formula: C8H18N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017296752","spectrum_index":40962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 117.0424 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017296754","spectrum_index":40963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrindole (delta mass: 61.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.27,"smiles":null,"spectrum_id":"CCMSLIB00017296757","spectrum_index":40964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 73.0898 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.254,"smiles":null,"spectrum_id":"CCMSLIB00017296759","spectrum_index":40965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [3-(Acetylamino)phenoxy]acetic acid (delta mass: 60.0216 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.098,"smiles":null,"spectrum_id":"CCMSLIB00017296762","spectrum_index":40966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 71.0729 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.159,"smiles":null,"spectrum_id":"CCMSLIB00017296764","spectrum_index":40967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 225.1111 Da; putative annotation: N/A; putative formula: C10H15N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.197,"smiles":null,"spectrum_id":"CCMSLIB00017296767","spectrum_index":40968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 55.0294 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.231,"smiles":null,"spectrum_id":"CCMSLIB00017296769","spectrum_index":40969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 45.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.227,"smiles":null,"spectrum_id":"CCMSLIB00017296772","spectrum_index":40970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 90.0471 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.133,"smiles":null,"spectrum_id":"CCMSLIB00017296775","spectrum_index":40971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 93.0579 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017296777","spectrum_index":40972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 27.0112 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.201,"smiles":null,"spectrum_id":"CCMSLIB00017296780","spectrum_index":40973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 128.0625 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017296782","spectrum_index":40974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 217.0588 Da; putative annotation: N/A; putative formula: C8H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.093,"smiles":null,"spectrum_id":"CCMSLIB00017296784","spectrum_index":40975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 62.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.128,"smiles":null,"spectrum_id":"CCMSLIB00017296787","spectrum_index":40976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 70.0529 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.139,"smiles":null,"spectrum_id":"CCMSLIB00017296790","spectrum_index":40977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrindole (delta mass: 35.0316 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.233,"smiles":null,"spectrum_id":"CCMSLIB00017296791","spectrum_index":40978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 90.0354 Da; putative annotation: N/A; putative formula: C2H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.087,"smiles":null,"spectrum_id":"CCMSLIB00017296794","spectrum_index":40979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 81.0579 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.145,"smiles":null,"spectrum_id":"CCMSLIB00017296797","spectrum_index":40980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 74.0379 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.15,"smiles":null,"spectrum_id":"CCMSLIB00017296800","spectrum_index":40981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin (delta mass: 7.0042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.085,"smiles":null,"spectrum_id":"CCMSLIB00017296802","spectrum_index":40982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-{[3-(Dimethylamino)propyl]amino}propanenitrile (delta mass: 46.0413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.191,"smiles":null,"spectrum_id":"CCMSLIB00017296804","spectrum_index":40983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Imidazol-1-yl)aniline (delta mass: 1.9704 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.057,"smiles":null,"spectrum_id":"CCMSLIB00017296807","spectrum_index":40984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Fructosyl isoleucine (delta mass: 132.0424 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.197,"smiles":null,"spectrum_id":"CCMSLIB00017296810","spectrum_index":40985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS001049055-01!1-methylindole-3-carboxamide (delta mass: 25.9986 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.085,"smiles":null,"spectrum_id":"CCMSLIB00017296813","spectrum_index":40986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 89.0113 Da; putative annotation: N/A; putative formula: C2H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.071,"smiles":null,"spectrum_id":"CCMSLIB00017296815","spectrum_index":40987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 85.0316 Da; putative annotation: N/A; putative formula: C7H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017296818","spectrum_index":40988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 474.1647 Da; putative annotation: N/A; putative formula: C24H30N2O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.351,"smiles":null,"spectrum_id":"CCMSLIB00017296821","spectrum_index":40989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deuteroporphyrin IX (delta mass: 98.0485 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.282,"smiles":null,"spectrum_id":"CCMSLIB00017296824","spectrum_index":40990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 519.3234 Da; putative annotation: N/A; putative formula: C26H49NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.378,"smiles":null,"spectrum_id":"CCMSLIB00017296827","spectrum_index":40991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 367.3207 Da; putative annotation: N/A; putative formula: C21H41N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.444,"smiles":null,"spectrum_id":"CCMSLIB00017296830","spectrum_index":40992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 515.1801 Da; putative annotation: N/A; putative formula: C27H33NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.282,"smiles":null,"spectrum_id":"CCMSLIB00017296832","spectrum_index":40993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 42.083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.18,"smiles":null,"spectrum_id":"CCMSLIB00017296835","spectrum_index":40994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 116.1307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.3,"smiles":null,"spectrum_id":"CCMSLIB00017296838","spectrum_index":40995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 111.1055 Da; putative annotation: N/A; putative formula: C7H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.396,"smiles":null,"spectrum_id":"CCMSLIB00017296841","spectrum_index":40996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 168.0773 Da; putative annotation: N/A; putative formula: C9H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.132,"smiles":null,"spectrum_id":"CCMSLIB00017296842","spectrum_index":40997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 59.061 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.107,"smiles":null,"spectrum_id":"CCMSLIB00017296845","spectrum_index":40998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 244.178 Da; putative annotation: N/A; putative formula: C14H29O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.322,"smiles":null,"spectrum_id":"CCMSLIB00017296848","spectrum_index":40999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 199.1348 Da; putative annotation: N/A; putative formula: C8H18N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.237,"smiles":null,"spectrum_id":"CCMSLIB00017296851","spectrum_index":41000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 266.136 Da; putative annotation: N/A; putative formula: C11H22O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.313,"smiles":null,"spectrum_id":"CCMSLIB00017296854","spectrum_index":41001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 182.1098 Da; putative annotation: N/A; putative formula: C14H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017296856","spectrum_index":41002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 220.1086 Da; putative annotation: N/A; putative formula: C7H17N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.2,"smiles":null,"spectrum_id":"CCMSLIB00017296859","spectrum_index":41003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 27.0724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.164,"smiles":null,"spectrum_id":"CCMSLIB00017296861","spectrum_index":41004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 26.9634 Da; putative annotation: N/A; putative formula: C9H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.06,"smiles":null,"spectrum_id":"CCMSLIB00017296864","spectrum_index":41005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 383.2324 Da; putative annotation: N/A; putative formula: C21H29N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.292,"smiles":null,"spectrum_id":"CCMSLIB00017296867","spectrum_index":41006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (delta mass: 55.0023 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.135,"smiles":null,"spectrum_id":"CCMSLIB00017296868","spectrum_index":41007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 193.0593 Da; putative annotation: N/A; putative formula: C7H15NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.224,"smiles":null,"spectrum_id":"CCMSLIB00017296871","spectrum_index":41008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 90.0384 Da; putative annotation: N/A; putative formula: CH6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.14,"smiles":null,"spectrum_id":"CCMSLIB00017296874","spectrum_index":41009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 155.0948 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017296877","spectrum_index":41010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 96.0481 Da; putative annotation: N/A; putative formula: C6H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.091,"smiles":null,"spectrum_id":"CCMSLIB00017296878","spectrum_index":41011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 109.1018 Da; putative annotation: N/A; putative formula: C6H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.277,"smiles":null,"spectrum_id":"CCMSLIB00017296881","spectrum_index":41012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 140.1961 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.282,"smiles":null,"spectrum_id":"CCMSLIB00017296884","spectrum_index":41013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 9.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.091,"smiles":null,"spectrum_id":"CCMSLIB00017296885","spectrum_index":41014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 19.006 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.066,"smiles":null,"spectrum_id":"CCMSLIB00017296888","spectrum_index":41015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S,3R)-1-Aminocyclopentane-1,3-dicarboxylic acid (delta mass: 45.9973 Da; putative annotation: N/A; putative formula: CH3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.073,"smiles":null,"spectrum_id":"CCMSLIB00017296891","spectrum_index":41016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 217.3024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.368,"smiles":null,"spectrum_id":"CCMSLIB00017296894","spectrum_index":41017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2,3',4,5',6-pentol (delta mass: 430.1257 Da; putative annotation: N/A; putative formula: C14H26N2O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.186,"smiles":null,"spectrum_id":"CCMSLIB00017296896","spectrum_index":41018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 64.0673 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.242,"smiles":null,"spectrum_id":"CCMSLIB00017296898","spectrum_index":41019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 432.2094 Da; putative annotation: N/A; putative formula: C16H24N12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.311,"smiles":null,"spectrum_id":"CCMSLIB00017296901","spectrum_index":41020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 38.0523 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.154,"smiles":null,"spectrum_id":"CCMSLIB00017296904","spectrum_index":41021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 342.1268 Da; putative annotation: N/A; putative formula: C24H14N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.25,"smiles":null,"spectrum_id":"CCMSLIB00017296906","spectrum_index":41022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 16.0891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.222,"smiles":null,"spectrum_id":"CCMSLIB00017296908","spectrum_index":41023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 355.1477 Da; putative annotation: N/A; putative formula: C13H25NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.218,"smiles":null,"spectrum_id":"CCMSLIB00017296911","spectrum_index":41024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 103.0081 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.089,"smiles":null,"spectrum_id":"CCMSLIB00017296914","spectrum_index":41025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-propanoic acid (delta mass: 86.037 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.123,"smiles":null,"spectrum_id":"CCMSLIB00017296916","spectrum_index":41026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethoxy-2(1H)-quinolinone (delta mass: 146.0694 Da; putative annotation: N/A; putative formula: C5H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.151,"smiles":null,"spectrum_id":"CCMSLIB00017296919","spectrum_index":41027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 218.1092 Da; putative annotation: N/A; putative formula: C9H18N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.211,"smiles":null,"spectrum_id":"CCMSLIB00017296922","spectrum_index":41028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 213.0844 Da; putative annotation: N/A; putative formula: C10H17NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.123,"smiles":null,"spectrum_id":"CCMSLIB00017296925","spectrum_index":41029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenyl-1-(2,4,6-trihydroxyphenyl)nonan-1-one (delta mass: 18.0839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.274,"smiles":null,"spectrum_id":"CCMSLIB00017296927","spectrum_index":41030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 402.2975 Da; putative annotation: N/A; putative formula: C22H42O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.336,"smiles":null,"spectrum_id":"CCMSLIB00017296930","spectrum_index":41031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 40.0787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.149,"smiles":null,"spectrum_id":"CCMSLIB00017296933","spectrum_index":41032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 65.0271 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.114,"smiles":null,"spectrum_id":"CCMSLIB00017296935","spectrum_index":41033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074902 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 94.0413 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.122,"smiles":null,"spectrum_id":"CCMSLIB00017296938","spectrum_index":41034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 950.4866 Da; putative annotation: N/A; putative formula: C54H70N4O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1143.56,"smiles":null,"spectrum_id":"CCMSLIB00017296941","spectrum_index":41035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 420.2198 Da; putative annotation: N/A; putative formula: C21H32N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.285,"smiles":null,"spectrum_id":"CCMSLIB00017296942","spectrum_index":41036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-L-phenylalanine (delta mass: 116.0196 Da; putative annotation: N/A; putative formula: C8H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.096,"smiles":null,"spectrum_id":"CCMSLIB00017296945","spectrum_index":41037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 569.1171 Da; putative annotation: N/A; putative formula: C27H23NO13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.224,"smiles":null,"spectrum_id":"CCMSLIB00017296948","spectrum_index":41038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dexmedetomidine (delta mass: 52.041 Da; putative annotation: N/A; putative formula: C3H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.18,"smiles":null,"spectrum_id":"CCMSLIB00017296951","spectrum_index":41039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 187.0788 Da; putative annotation: N/A; putative formula: C15H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.192,"smiles":null,"spectrum_id":"CCMSLIB00017296954","spectrum_index":41040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 285.2055 Da; putative annotation: N/A; putative formula: C14H27N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.318,"smiles":null,"spectrum_id":"CCMSLIB00017296957","spectrum_index":41041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Amino-4-hydroxy-1-(4-methoxybenzyl)-2(1H)-pyrimidinone (delta mass: 120.0618 Da; putative annotation: N/A; putative formula: C2H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.165,"smiles":null,"spectrum_id":"CCMSLIB00017296959","spectrum_index":41042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 282.0472 Da; putative annotation: N/A; putative formula: C8H2N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.18,"smiles":null,"spectrum_id":"CCMSLIB00017296962","spectrum_index":41043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 168.0781 Da; putative annotation: N/A; putative formula: C9H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.154,"smiles":null,"spectrum_id":"CCMSLIB00017296965","spectrum_index":41044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 176.0634 Da; putative annotation: N/A; putative formula: C6H14N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.15,"smiles":null,"spectrum_id":"CCMSLIB00017296967","spectrum_index":41045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 32.0049 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.128,"smiles":null,"spectrum_id":"CCMSLIB00017296969","spectrum_index":41046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 100.0546 Da; putative annotation: N/A; putative formula: C4H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.135,"smiles":null,"spectrum_id":"CCMSLIB00017296972","spectrum_index":41047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 301.1957 Da; putative annotation: N/A; putative formula: C19H28NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.318,"smiles":null,"spectrum_id":"CCMSLIB00017296975","spectrum_index":41048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 245.1649 Da; putative annotation: N/A; putative formula: C11H24N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.244,"smiles":null,"spectrum_id":"CCMSLIB00017296976","spectrum_index":41049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 441.272 Da; putative annotation: N/A; putative formula: C23H39NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.42,"smiles":null,"spectrum_id":"CCMSLIB00017296979","spectrum_index":41050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 217.2046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.27,"smiles":null,"spectrum_id":"CCMSLIB00017296982","spectrum_index":41051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 185.0718 Da; putative annotation: N/A; putative formula: C7H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.169,"smiles":null,"spectrum_id":"CCMSLIB00017296983","spectrum_index":41052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 59.0817 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.142,"smiles":null,"spectrum_id":"CCMSLIB00017296986","spectrum_index":41053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 261.1783 Da; putative annotation: N/A; putative formula: C13H29NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.276,"smiles":null,"spectrum_id":"CCMSLIB00017296989","spectrum_index":41054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 199.0859 Da; putative annotation: N/A; putative formula: C10H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.204,"smiles":null,"spectrum_id":"CCMSLIB00017296991","spectrum_index":41055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 64.0851 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.096,"smiles":null,"spectrum_id":"CCMSLIB00017296993","spectrum_index":41056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 207.1111 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.223,"smiles":null,"spectrum_id":"CCMSLIB00017296996","spectrum_index":41057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 224.0317 Da; putative annotation: N/A; putative formula: C10H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.092,"smiles":null,"spectrum_id":"CCMSLIB00017296998","spectrum_index":41058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 260.2134 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.267,"smiles":null,"spectrum_id":"CCMSLIB00017297000","spectrum_index":41059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Imidazol-1-ylacetic acid (delta mass: 30.0092 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.059,"smiles":null,"spectrum_id":"CCMSLIB00017297003","spectrum_index":41060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 186.0153 Da; putative annotation: N/A; putative formula: C11H8O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.057,"smiles":null,"spectrum_id":"CCMSLIB00017297006","spectrum_index":41061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 254.1905 Da; putative annotation: N/A; putative formula: C14H27N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.231,"smiles":null,"spectrum_id":"CCMSLIB00017297007","spectrum_index":41062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 145.0748 Da; putative annotation: N/A; putative formula: C7H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.172,"smiles":null,"spectrum_id":"CCMSLIB00017297010","spectrum_index":41063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 88.0315 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017297013","spectrum_index":41064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylthio]quinazolin-4-ol CollisionEnergy:102040\"\" (delta mass: 361.0921 Da; putative annotation: N/A; putative formula: C17H19N3O2S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.203,"smiles":null,"spectrum_id":"CCMSLIB00017297015","spectrum_index":41065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 46.0158 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.124,"smiles":null,"spectrum_id":"CCMSLIB00017297017","spectrum_index":41066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 222.0881 Da; putative annotation: N/A; putative formula: C6H15N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.206,"smiles":null,"spectrum_id":"CCMSLIB00017297020","spectrum_index":41067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 377.146 Da; putative annotation: N/A; putative formula: C16H15N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.208,"smiles":null,"spectrum_id":"CCMSLIB00017297023","spectrum_index":41068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 50.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.143,"smiles":null,"spectrum_id":"CCMSLIB00017297025","spectrum_index":41069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 48.0064 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.087,"smiles":null,"spectrum_id":"CCMSLIB00017297028","spectrum_index":41070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 9.0468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.144,"smiles":null,"spectrum_id":"CCMSLIB00017297031","spectrum_index":41071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 194.0935 Da; putative annotation: N/A; putative formula: C5H15N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.133,"smiles":null,"spectrum_id":"CCMSLIB00017297033","spectrum_index":41072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 86.0265 Da; putative annotation: N/A; putative formula: C6H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.123,"smiles":null,"spectrum_id":"CCMSLIB00017297036","spectrum_index":41073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 326.1526 Da; putative annotation: N/A; putative formula: C20H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.213,"smiles":null,"spectrum_id":"CCMSLIB00017297038","spectrum_index":41074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1'-Biphenyl]-2-ylacetic acid (delta mass: 87.031 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.122,"smiles":null,"spectrum_id":"CCMSLIB00017297041","spectrum_index":41075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 168.0676 Da; putative annotation: N/A; putative formula: C5H9N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.207,"smiles":null,"spectrum_id":"CCMSLIB00017297044","spectrum_index":41076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Amino-4,4-dimethylpentanoic acid (delta mass: 113.0844 Da; putative annotation: NORLEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.202,"smiles":null,"spectrum_id":"CCMSLIB00017297046","spectrum_index":41077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 113.0842 Da; putative annotation: LEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017297048","spectrum_index":41078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Bisdemethoxycurcumin from NIST14 (delta mass: 146.0367 Da; putative annotation: 3-Coumaric acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.149,"smiles":null,"spectrum_id":"CCMSLIB00017297051","spectrum_index":41079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100215 alpha-Methyl-DL-serine|DL-2-Methylserine|2-Amino-3-hydroxy-2-methylpropanoic Acid|DL-2-Amino-3-hydroxy-2-methylpropionic Acid|DL-alpha-(Hydroxymethyl)alanine|alpha-Methylserine (delta mass: 129.0425 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.108,"smiles":null,"spectrum_id":"CCMSLIB00017297054","spectrum_index":41080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucrose (delta mass: 161.069 Da; putative annotation: D-Mannosamine; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.193,"smiles":null,"spectrum_id":"CCMSLIB00017297056","spectrum_index":41081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 162.0526 Da; putative annotation: 2-(Hydroxymethyl)-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one; putative formula: C7H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.103,"smiles":null,"spectrum_id":"CCMSLIB00017297059","spectrum_index":41082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 732.4341 Da; putative annotation: Massbank:PR301882 alpha-Hederin; putative formula: C41H64O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1059.56,"smiles":null,"spectrum_id":"CCMSLIB00017297061","spectrum_index":41083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lactulose from NIST14 (delta mass: 316.2392 Da; putative annotation: 3-Hexadec-15-en-7-ynyl-4-hydroxy-5-methyloxolan-2-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.363,"smiles":null,"spectrum_id":"CCMSLIB00017297064","spectrum_index":41084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 108.0205 Da; putative annotation: 4-Hydroxy-6-methyl-2-pyrone; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.091,"smiles":null,"spectrum_id":"CCMSLIB00017297066","spectrum_index":41085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00332267-02!N-(2-phenylethyl)acetamide (delta mass: 146.0474 Da; putative annotation: (4aR,5aR)-4,4a,5,5a-Tetrahydro-1H-cyclopropa[4,5]cyclopenta[1,2-c]pyrazole-3-carboxylic acid; putative formula: C8H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.154,"smiles":null,"spectrum_id":"CCMSLIB00017297069","spectrum_index":41086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 244.1135 Da; putative annotation: (3S,4S,9bR)-4-Hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione; putative formula: C15H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.179,"smiles":null,"spectrum_id":"CCMSLIB00017297072","spectrum_index":41087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 110.0513 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.175,"smiles":null,"spectrum_id":"CCMSLIB00017297075","spectrum_index":41088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 136.1259 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.363,"smiles":null,"spectrum_id":"CCMSLIB00017297077","spectrum_index":41089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 288.1589 Da; putative annotation: N/A; putative formula: C15H20N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.245,"smiles":null,"spectrum_id":"CCMSLIB00017297080","spectrum_index":41090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benserazide (delta mass: 84.0267 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.135,"smiles":null,"spectrum_id":"CCMSLIB00017297083","spectrum_index":41091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 119.0576 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.117,"smiles":null,"spectrum_id":"CCMSLIB00017297086","spectrum_index":41092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 33.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.149,"smiles":null,"spectrum_id":"CCMSLIB00017297088","spectrum_index":41093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 333.1998 Da; putative annotation: N/A; putative formula: C15H32N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.27,"smiles":null,"spectrum_id":"CCMSLIB00017297091","spectrum_index":41094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 25.0274 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.13,"smiles":null,"spectrum_id":"CCMSLIB00017297094","spectrum_index":41095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 123.0557 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.351,"smiles":null,"spectrum_id":"CCMSLIB00017297096","spectrum_index":41096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 46.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017297099","spectrum_index":41097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 242.043 Da; putative annotation: N/A; putative formula: C12H7FN4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.082,"smiles":null,"spectrum_id":"CCMSLIB00017297102","spectrum_index":41098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dereplicator+ Identification - Serratiochelin (delta mass: 276.1106 Da; putative annotation: N/A; putative formula: C14H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.271,"smiles":null,"spectrum_id":"CCMSLIB00017297105","spectrum_index":41099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 122.0574 Da; putative annotation: N/A; putative formula: C5H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.18,"smiles":null,"spectrum_id":"CCMSLIB00017297107","spectrum_index":41100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 535.2058 Da; putative annotation: N/A; putative formula: C27H37NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.37,"smiles":null,"spectrum_id":"CCMSLIB00017297109","spectrum_index":41101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 718.3563 Da; putative annotation: N/A; putative formula: C44H54N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":925.443,"smiles":null,"spectrum_id":"CCMSLIB00017297112","spectrum_index":41102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 7-fluoro-3-methyl-1H-indole-2-carboxylate (delta mass: 197.0816 Da; putative annotation: N/A; putative formula: C9H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.158,"smiles":null,"spectrum_id":"CCMSLIB00017297114","spectrum_index":41103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 148.016 Da; putative annotation: N/A; putative formula: C8H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.05,"smiles":null,"spectrum_id":"CCMSLIB00017297117","spectrum_index":41104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 84.0573 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017297120","spectrum_index":41105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indazole-3-carboxamide, N-[(1S)-1-(aminocarbonyl)-2,2-dimethylpropyl]-1-(5-fluoropentyl)- (delta mass: 18.0197 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.239,"smiles":null,"spectrum_id":"CCMSLIB00017297122","spectrum_index":41106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 381.2874 Da; putative annotation: N/A; putative formula: C22H39NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.436,"smiles":null,"spectrum_id":"CCMSLIB00017297124","spectrum_index":41107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 204.1879 Da; putative annotation: N/A; putative formula: C15H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.28,"smiles":null,"spectrum_id":"CCMSLIB00017297127","spectrum_index":41108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 137.9979 Da; putative annotation: N/A; putative formula: C5H3N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.079,"smiles":null,"spectrum_id":"CCMSLIB00017297130","spectrum_index":41109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 73.1045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.254,"smiles":null,"spectrum_id":"CCMSLIB00017297133","spectrum_index":41110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 41.9991 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017297135","spectrum_index":41111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 294.2537 Da; putative annotation: N/A; putative formula: C15H30N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.319,"smiles":null,"spectrum_id":"CCMSLIB00017297137","spectrum_index":41112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 114.0824 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.206,"smiles":null,"spectrum_id":"CCMSLIB00017297140","spectrum_index":41113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acaranoic acid (delta mass: 40.0671 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.289,"smiles":null,"spectrum_id":"CCMSLIB00017297143","spectrum_index":41114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 31.8487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.913,"smiles":null,"spectrum_id":"CCMSLIB00017297146","spectrum_index":41115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 8.0002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.039,"smiles":null,"spectrum_id":"CCMSLIB00017297148","spectrum_index":41116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 272.1922 Da; putative annotation: N/A; putative formula: C14H28N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.27,"smiles":null,"spectrum_id":"CCMSLIB00017297150","spectrum_index":41117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 16.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.128,"smiles":null,"spectrum_id":"CCMSLIB00017297153","spectrum_index":41118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 216.1366 Da; putative annotation: N/A; putative formula: C12H24O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.244,"smiles":null,"spectrum_id":"CCMSLIB00017297156","spectrum_index":41119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 163.0839 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.149,"smiles":null,"spectrum_id":"CCMSLIB00017297159","spectrum_index":41120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 139.1757 Da; putative annotation: N/A; putative formula: C10H21NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.355,"smiles":null,"spectrum_id":"CCMSLIB00017297162","spectrum_index":41121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 50.0 eV (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.086,"smiles":null,"spectrum_id":"CCMSLIB00017297163","spectrum_index":41122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic Acid CollisionEnergy:102040 (delta mass: 3.0068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.12,"smiles":null,"spectrum_id":"CCMSLIB00017297166","spectrum_index":41123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 23.9997 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017297169","spectrum_index":41124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 737.4052 Da; putative annotation: N/A; putative formula: C45H51N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":892.439,"smiles":null,"spectrum_id":"CCMSLIB00017297171","spectrum_index":41125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 372.1048 Da; putative annotation: N/A; putative formula: C10H21N4O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.211,"smiles":null,"spectrum_id":"CCMSLIB00017297173","spectrum_index":41126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 850.3864 Da; putative annotation: N/A; putative formula: C49H58N2O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":977.425,"smiles":null,"spectrum_id":"CCMSLIB00017297176","spectrum_index":41127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 94.0776 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.32,"smiles":null,"spectrum_id":"CCMSLIB00017297179","spectrum_index":41128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 490.1655 Da; putative annotation: N/A; putative formula: C30H18N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.226,"smiles":null,"spectrum_id":"CCMSLIB00017297180","spectrum_index":41129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 136.031 Da; putative annotation: N/A; putative formula: C11H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.091,"smiles":null,"spectrum_id":"CCMSLIB00017297183","spectrum_index":41130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 109.054 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.156,"smiles":null,"spectrum_id":"CCMSLIB00017297186","spectrum_index":41131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 56.0623 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.138,"smiles":null,"spectrum_id":"CCMSLIB00017297188","spectrum_index":41132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 434.2887 Da; putative annotation: N/A; putative formula: C23H46O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.437,"smiles":null,"spectrum_id":"CCMSLIB00017297190","spectrum_index":41133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Cinchonidine - 30.0 eV (delta mass: 77.0895 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.27,"smiles":null,"spectrum_id":"CCMSLIB00017297193","spectrum_index":41134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 649.45 Da; putative annotation: N/A; putative formula: C44H59NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.51,"smiles":null,"spectrum_id":"CCMSLIB00017297196","spectrum_index":41135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-pyrimidinamine (delta mass: 223.1041 Da; putative annotation: N/A; putative formula: C12H19NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.202,"smiles":null,"spectrum_id":"CCMSLIB00017297198","spectrum_index":41136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 592.2878 Da; putative annotation: N/A; putative formula: C44H36N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.38,"smiles":null,"spectrum_id":"CCMSLIB00017297200","spectrum_index":41137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 151.0306 Da; putative annotation: N/A; putative formula: C4H9NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.095,"smiles":null,"spectrum_id":"CCMSLIB00017297203","spectrum_index":41138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N6-Phenyl-7H-purine-2,6-diamine (delta mass: 105.028 Da; putative annotation: N/A; putative formula: H3N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.132,"smiles":null,"spectrum_id":"CCMSLIB00017297206","spectrum_index":41139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 24.0242 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.127,"smiles":null,"spectrum_id":"CCMSLIB00017297208","spectrum_index":41140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.Phaeophorbide a (delta mass: 250.2296 Da; putative annotation: N/A; putative formula: C17H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.505,"smiles":null,"spectrum_id":"CCMSLIB00017297211","spectrum_index":41141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 34.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.113,"smiles":null,"spectrum_id":"CCMSLIB00017297213","spectrum_index":41142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 225.0846 Da; putative annotation: N/A; putative formula: C7H15NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.165,"smiles":null,"spectrum_id":"CCMSLIB00017297215","spectrum_index":41143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 110.0428 Da; putative annotation: N/A; putative formula: CH2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.122,"smiles":null,"spectrum_id":"CCMSLIB00017297218","spectrum_index":41144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 20.0 eV (delta mass: 71.0621 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.201,"smiles":null,"spectrum_id":"CCMSLIB00017297221","spectrum_index":41145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 53.0624 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.154,"smiles":null,"spectrum_id":"CCMSLIB00017297222","spectrum_index":41146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 106.0626 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.159,"smiles":null,"spectrum_id":"CCMSLIB00017297225","spectrum_index":41147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 42.0072 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.161,"smiles":null,"spectrum_id":"CCMSLIB00017297228","spectrum_index":41148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Pro (delta mass: 224.1163 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.282,"smiles":null,"spectrum_id":"CCMSLIB00017297229","spectrum_index":41149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 158.1667 Da; putative annotation: N/A; putative formula: C6H18N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.227,"smiles":null,"spectrum_id":"CCMSLIB00017297232","spectrum_index":41150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydrazinobenzoic acid (delta mass: 14.0163 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.082,"smiles":null,"spectrum_id":"CCMSLIB00017297235","spectrum_index":41151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (2E)-2-[(3S,12bR)-3-ethyl-4-oxo-1H,2H,3H,4H,6H,7H,12H,12bH-indolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate (delta mass: 79.9561 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.153,"smiles":null,"spectrum_id":"CCMSLIB00017297238","spectrum_index":41152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 154.1344 Da; putative annotation: N/A; putative formula: C6H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.18,"smiles":null,"spectrum_id":"CCMSLIB00017297240","spectrum_index":41153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 109.0741 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017297243","spectrum_index":41154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethanone, 1-[1-(4-hydroxypentyl)-1H-indol-3-yl]-2-(2-methoxyphenyl)- (delta mass: 116.1223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.313,"smiles":null,"spectrum_id":"CCMSLIB00017297245","spectrum_index":41155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-Gln (delta mass: 113.0849 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.225,"smiles":null,"spectrum_id":"CCMSLIB00017297248","spectrum_index":41156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 2.05 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.141,"smiles":null,"spectrum_id":"CCMSLIB00017297251","spectrum_index":41157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300815 Isocorydine (delta mass: 2.0588 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.229,"smiles":null,"spectrum_id":"CCMSLIB00017297253","spectrum_index":41158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 237.2547 Da; putative annotation: N/A; putative formula: C15H31N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.341,"smiles":null,"spectrum_id":"CCMSLIB00017297256","spectrum_index":41159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroacetophenone (delta mass: 26.0375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.087,"smiles":null,"spectrum_id":"CCMSLIB00017297259","spectrum_index":41160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 278.163 Da; putative annotation: N/A; putative formula: C15H22N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.307,"smiles":null,"spectrum_id":"CCMSLIB00017297261","spectrum_index":41161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.165,"smiles":null,"spectrum_id":"CCMSLIB00017297263","spectrum_index":41162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 16.129 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.226,"smiles":null,"spectrum_id":"CCMSLIB00017297266","spectrum_index":41163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 53.0252 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.101,"smiles":null,"spectrum_id":"CCMSLIB00017297269","spectrum_index":41164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-1-yl)propanamide (delta mass: 35.0983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.201,"smiles":null,"spectrum_id":"CCMSLIB00017297272","spectrum_index":41165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 359.3039 Da; putative annotation: N/A; putative formula: C20H41NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.39,"smiles":null,"spectrum_id":"CCMSLIB00017297274","spectrum_index":41166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-hydroxy-1H-pyrimidin-4-one (delta mass: 70.0165 Da; putative annotation: N/A; putative formula: C2H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.062,"smiles":null,"spectrum_id":"CCMSLIB00017297276","spectrum_index":41167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(4-Ethyl-1-piperazinyl)carbonyl]-1H-indole (delta mass: 72.0491 Da; putative annotation: N/A; putative formula: C4H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.209,"smiles":null,"spectrum_id":"CCMSLIB00017297279","spectrum_index":41168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 257.2055 Da; putative annotation: N/A; putative formula: C12H27N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.301,"smiles":null,"spectrum_id":"CCMSLIB00017297282","spectrum_index":41169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 17.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.197,"smiles":null,"spectrum_id":"CCMSLIB00017297285","spectrum_index":41170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole (delta mass: 4.3665 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.5,"smiles":null,"spectrum_id":"CCMSLIB00017297286","spectrum_index":41171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 228.1174 Da; putative annotation: N/A; putative formula: C14H17N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.392,"smiles":null,"spectrum_id":"CCMSLIB00017297289","spectrum_index":41172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 63.9924 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.084,"smiles":null,"spectrum_id":"CCMSLIB00017297292","spectrum_index":41173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 239.1519 Da; putative annotation: N/A; putative formula: C13H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.29,"smiles":null,"spectrum_id":"CCMSLIB00017297295","spectrum_index":41174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 146.0365 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.201,"smiles":null,"spectrum_id":"CCMSLIB00017297297","spectrum_index":41175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 129.1096 Da; putative annotation: N/A; putative formula: C7H16NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.211,"smiles":null,"spectrum_id":"CCMSLIB00017297299","spectrum_index":41176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 69.058 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.181,"smiles":null,"spectrum_id":"CCMSLIB00017297302","spectrum_index":41177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-4-methylpentanoic acid (delta mass: 60.0072 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.109,"smiles":null,"spectrum_id":"CCMSLIB00017297305","spectrum_index":41178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 84.0583 Da; putative annotation: N/A; putative formula: C5H8O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.145,"smiles":null,"spectrum_id":"CCMSLIB00017297306","spectrum_index":41179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 270.0354 Da; putative annotation: N/A; putative formula: C7H16N2O3P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.106,"smiles":null,"spectrum_id":"CCMSLIB00017297309","spectrum_index":41180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (2E)-3-(5-(2,3-dihydroxy-3-methylbutyl)-1-methyl-1H-imidazol-4-yl)prop-2-enoate (delta mass: 185.0726 Da; putative annotation: N/A; putative formula: C7H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.222,"smiles":null,"spectrum_id":"CCMSLIB00017297312","spectrum_index":41181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 112.0593 Da; putative annotation: N/A; putative formula: CH4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.354,"smiles":null,"spectrum_id":"CCMSLIB00017297314","spectrum_index":41182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 45.0656 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017297317","spectrum_index":41183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 177.1001 Da; putative annotation: N/A; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.176,"smiles":null,"spectrum_id":"CCMSLIB00017297319","spectrum_index":41184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-1,3-Benzodiazole-5-carbaldehyde (delta mass: 87.0398 Da; putative annotation: N/A; putative formula: C2H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.095,"smiles":null,"spectrum_id":"CCMSLIB00017297322","spectrum_index":41185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 66.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.165,"smiles":null,"spectrum_id":"CCMSLIB00017297325","spectrum_index":41186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ureidopropionic acid (delta mass: 27.9989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.06,"smiles":null,"spectrum_id":"CCMSLIB00017297328","spectrum_index":41187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 145.0722 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.174,"smiles":null,"spectrum_id":"CCMSLIB00017297330","spectrum_index":41188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 5.0073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.067,"smiles":null,"spectrum_id":"CCMSLIB00017297333","spectrum_index":41189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 48.0369 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.108,"smiles":null,"spectrum_id":"CCMSLIB00017297335","spectrum_index":41190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 563.3161 Da; putative annotation: N/A; putative formula: C37H37N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.386,"smiles":null,"spectrum_id":"CCMSLIB00017297338","spectrum_index":41191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 215.1734 Da; putative annotation: N/A; putative formula: C9H21N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.244,"smiles":null,"spectrum_id":"CCMSLIB00017297341","spectrum_index":41192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 296.1778 Da; putative annotation: N/A; putative formula: C20H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.217,"smiles":null,"spectrum_id":"CCMSLIB00017297343","spectrum_index":41193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 102.0537 Da; putative annotation: N/A; putative formula: C2H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.14,"smiles":null,"spectrum_id":"CCMSLIB00017297345","spectrum_index":41194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 84.0265 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.076,"smiles":null,"spectrum_id":"CCMSLIB00017297348","spectrum_index":41195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 361.1377 Da; putative annotation: N/A; putative formula: C18H24N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.25,"smiles":null,"spectrum_id":"CCMSLIB00017297351","spectrum_index":41196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 50.0543 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.13,"smiles":null,"spectrum_id":"CCMSLIB00017297352","spectrum_index":41197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 78.0129 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.061,"smiles":null,"spectrum_id":"CCMSLIB00017297355","spectrum_index":41198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 302.0866 Da; putative annotation: N/A; putative formula: C12H21N2OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.183,"smiles":null,"spectrum_id":"CCMSLIB00017297358","spectrum_index":41199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 487.4959 Da; putative annotation: N/A; putative formula: C31H61N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.556,"smiles":null,"spectrum_id":"CCMSLIB00017297361","spectrum_index":41200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 488.1634 Da; putative annotation: N/A; putative formula: C22H33O8PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.224,"smiles":null,"spectrum_id":"CCMSLIB00017297362","spectrum_index":41201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 487.7632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.823,"smiles":null,"spectrum_id":"CCMSLIB00017297365","spectrum_index":41202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 78.0582 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.118,"smiles":null,"spectrum_id":"CCMSLIB00017297368","spectrum_index":41203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 109.0286 Da; putative annotation: N/A; putative formula: C4H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.146,"smiles":null,"spectrum_id":"CCMSLIB00017297369","spectrum_index":41204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 202.1722 Da; putative annotation: N/A; putative formula: C15H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.243,"smiles":null,"spectrum_id":"CCMSLIB00017297372","spectrum_index":41205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 247.1025 Da; putative annotation: N/A; putative formula: C17H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.153,"smiles":null,"spectrum_id":"CCMSLIB00017297375","spectrum_index":41206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 110.0766 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.211,"smiles":null,"spectrum_id":"CCMSLIB00017297376","spectrum_index":41207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Formyl-1H-indole-5-carbonitrile (delta mass: 27.9346 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.99,"smiles":null,"spectrum_id":"CCMSLIB00017297379","spectrum_index":41208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 584.261 Da; putative annotation: N/A; putative formula: C37H36N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.3,"smiles":null,"spectrum_id":"CCMSLIB00017297382","spectrum_index":41209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 570.2537 Da; putative annotation: N/A; putative formula: C25H38N4O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.324,"smiles":null,"spectrum_id":"CCMSLIB00017297383","spectrum_index":41210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 62.0155 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017297386","spectrum_index":41211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 260.1486 Da; putative annotation: N/A; putative formula: C15H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.303,"smiles":null,"spectrum_id":"CCMSLIB00017297388","spectrum_index":41212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 33.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017297391","spectrum_index":41213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 126.0736 Da; putative annotation: N/A; putative formula: C6H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.369,"smiles":null,"spectrum_id":"CCMSLIB00017297394","spectrum_index":41214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyphenylmaraviroc (delta mass: 114.0648 Da; putative annotation: N/A; putative formula: C2H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.395,"smiles":null,"spectrum_id":"CCMSLIB00017297396","spectrum_index":41215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 161.1263 Da; putative annotation: N/A; putative formula: C5H15N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.169,"smiles":null,"spectrum_id":"CCMSLIB00017297398","spectrum_index":41216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-N,N-dimethyltryptamine (delta mass: 59.0624 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.212,"smiles":null,"spectrum_id":"CCMSLIB00017297401","spectrum_index":41217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 82.0809 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.24,"smiles":null,"spectrum_id":"CCMSLIB00017297404","spectrum_index":41218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dimethyl (R)-(+)-malate (delta mass: 88.0293 Da; putative annotation: N/A; putative formula: CH5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.089,"smiles":null,"spectrum_id":"CCMSLIB00017297406","spectrum_index":41219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 56.061 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.111,"smiles":null,"spectrum_id":"CCMSLIB00017297408","spectrum_index":41220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 281.0408 Da; putative annotation: N/A; putative formula: C13H7N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.101,"smiles":null,"spectrum_id":"CCMSLIB00017297411","spectrum_index":41221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 38.026 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.091,"smiles":null,"spectrum_id":"CCMSLIB00017297412","spectrum_index":41222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 125.5505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.637,"smiles":null,"spectrum_id":"CCMSLIB00017297415","spectrum_index":41223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 55.0841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.264,"smiles":null,"spectrum_id":"CCMSLIB00017297418","spectrum_index":41224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucitol (delta mass: 130.0631 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.155,"smiles":null,"spectrum_id":"CCMSLIB00017297419","spectrum_index":41225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyltryptamine (delta mass: 46.0342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.173,"smiles":null,"spectrum_id":"CCMSLIB00017297422","spectrum_index":41226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 193.0505 Da; putative annotation: N/A; putative formula: C6H12NO4P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.137,"smiles":null,"spectrum_id":"CCMSLIB00017297424","spectrum_index":41227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 28.9271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.004,"smiles":null,"spectrum_id":"CCMSLIB00017297426","spectrum_index":41228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 52.0341 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.178,"smiles":null,"spectrum_id":"CCMSLIB00017297429","spectrum_index":41229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 57.0903 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.155,"smiles":null,"spectrum_id":"CCMSLIB00017297432","spectrum_index":41230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 73.0876 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.189,"smiles":null,"spectrum_id":"CCMSLIB00017297433","spectrum_index":41231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 402.0944 Da; putative annotation: N/A; putative formula: C15H31O2PS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.28,"smiles":null,"spectrum_id":"CCMSLIB00017297436","spectrum_index":41232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 6.4134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017297439","spectrum_index":41233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 30.0471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.248,"smiles":null,"spectrum_id":"CCMSLIB00017297441","spectrum_index":41234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 42.0692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.218,"smiles":null,"spectrum_id":"CCMSLIB00017297443","spectrum_index":41235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 270.1324 Da; putative annotation: N/A; putative formula: C13H23N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.259,"smiles":null,"spectrum_id":"CCMSLIB00017297446","spectrum_index":41236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 79.0418 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.154,"smiles":null,"spectrum_id":"CCMSLIB00017297448","spectrum_index":41237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MMV675993 (delta mass: 43.0449 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.206,"smiles":null,"spectrum_id":"CCMSLIB00017297450","spectrum_index":41238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 120.0424 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.092,"smiles":null,"spectrum_id":"CCMSLIB00017297453","spectrum_index":41239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 38.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017297455","spectrum_index":41240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 101.0001 Da; putative annotation: N/A; putative formula: C5H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017297458","spectrum_index":41241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 52.001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.08,"smiles":null,"spectrum_id":"CCMSLIB00017297460","spectrum_index":41242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 142.0786 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.134,"smiles":null,"spectrum_id":"CCMSLIB00017297463","spectrum_index":41243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 92.0838 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017297464","spectrum_index":41244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Cystine (delta mass: 238.229 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.26,"smiles":null,"spectrum_id":"CCMSLIB00017297467","spectrum_index":41245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of R-(-)-Phenyl-1,2-ethanediol (delta mass: 70.0246 Da; putative annotation: N/A; putative formula: C4H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017297470","spectrum_index":41246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML01822 3,4-Dihydroxy-L-phenylalanine (delta mass: 120.0566 Da; putative annotation: N/A; putative formula: C2H9N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.133,"smiles":null,"spectrum_id":"CCMSLIB00017297471","spectrum_index":41247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 70.0895 Da; putative annotation: N/A; putative formula: C4H10N2O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.16,"smiles":null,"spectrum_id":"CCMSLIB00017297474","spectrum_index":41248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380682-01_C13H18O8_ (delta mass: 148.0489 Da; putative annotation: N/A; putative formula: C5H12N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.156,"smiles":null,"spectrum_id":"CCMSLIB00017297477","spectrum_index":41249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 123.0893 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.15,"smiles":null,"spectrum_id":"CCMSLIB00017297478","spectrum_index":41250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 156.0658 Da; putative annotation: 2-(1H-Indol-1-yl)acetamide; putative formula: C10H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.142,"smiles":null,"spectrum_id":"CCMSLIB00017297481","spectrum_index":41251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 113.0845 Da; putative annotation: L-Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.208,"smiles":null,"spectrum_id":"CCMSLIB00017297484","spectrum_index":41252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 324.102 Da; putative annotation: 3.alpha.-Mannobiose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.173,"smiles":null,"spectrum_id":"CCMSLIB00017297485","spectrum_index":41253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 81.0579 Da; putative annotation: 4-Piperidone; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017297488","spectrum_index":41254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 192.1869 Da; putative annotation: (Z,E)-Tetradeca-9,12-dienol; putative formula: C14H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.456,"smiles":null,"spectrum_id":"CCMSLIB00017297489","spectrum_index":41255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 176.0668 Da; putative annotation: Methyl .alpha.-D-mannopyranoside; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.138,"smiles":null,"spectrum_id":"CCMSLIB00017297492","spectrum_index":41256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 324.0907 Da; putative annotation: Caffeic acid 4-O-beta-D-glucopyranoside; putative formula: C15H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.144,"smiles":null,"spectrum_id":"CCMSLIB00017297495","spectrum_index":41257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 286.2151 Da; putative annotation: Aleuritic acid; putative formula: C16H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.405,"smiles":null,"spectrum_id":"CCMSLIB00017297497","spectrum_index":41258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 163.0382 Da; putative annotation: N'-(4-Nitrophenyl)formic hydrazide; putative formula: C7H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.109,"smiles":null,"spectrum_id":"CCMSLIB00017297499","spectrum_index":41259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 177.0971 Da; putative annotation: 1-Deoxy-1-(methylamino)-D-galactitol; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.157,"smiles":null,"spectrum_id":"CCMSLIB00017297502","spectrum_index":41260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 133.074 Da; putative annotation: N/A; putative formula: C5H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.129,"smiles":null,"spectrum_id":"CCMSLIB00017297505","spectrum_index":41261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 381.2529 Da; putative annotation: N/A; putative formula: C22H31N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.423,"smiles":null,"spectrum_id":"CCMSLIB00017297508","spectrum_index":41262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine E (delta mass: 113.0773 Da; putative annotation: N/A; putative formula: C6H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.258,"smiles":null,"spectrum_id":"CCMSLIB00017297510","spectrum_index":41263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 677.4195 Da; putative annotation: N/A; putative formula: C43H55N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.568,"smiles":null,"spectrum_id":"CCMSLIB00017297513","spectrum_index":41264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 195.174 Da; putative annotation: N/A; putative formula: C11H21N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.286,"smiles":null,"spectrum_id":"CCMSLIB00017297515","spectrum_index":41265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 74.0584 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.212,"smiles":null,"spectrum_id":"CCMSLIB00017297518","spectrum_index":41266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hypaphorine (delta mass: 247.1406 Da; putative annotation: N/A; putative formula: C8H13N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.285,"smiles":null,"spectrum_id":"CCMSLIB00017297521","spectrum_index":41267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 83.0008 Da; putative annotation: N/A; putative formula: C3HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.087,"smiles":null,"spectrum_id":"CCMSLIB00017297523","spectrum_index":41268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 45.0715 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.153,"smiles":null,"spectrum_id":"CCMSLIB00017297525","spectrum_index":41269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-(3-methyl-2-butenyl)benzaldehyde (delta mass: 86.0712 Da; putative annotation: N/A; putative formula: CH6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.178,"smiles":null,"spectrum_id":"CCMSLIB00017297528","spectrum_index":41270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100215 alpha-Methyl-DL-serine|DL-2-Methylserine|2-Amino-3-hydroxy-2-methylpropanoic Acid|DL-2-Amino-3-hydroxy-2-methylpropionic Acid|DL-alpha-(Hydroxymethyl)alanine|alpha-Methylserine (delta mass: 69.0367 Da; putative annotation: N/A; putative formula: C2H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.102,"smiles":null,"spectrum_id":"CCMSLIB00017297531","spectrum_index":41271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbamazepine-10,11-epoxide (delta mass: 209.0847 Da; putative annotation: N/A; putative formula: C7H11N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.182,"smiles":null,"spectrum_id":"CCMSLIB00017297534","spectrum_index":41272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 40.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.207,"smiles":null,"spectrum_id":"CCMSLIB00017297535","spectrum_index":41273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 989.5559 Da; putative annotation: N/A; putative formula: C55H75N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1182.63,"smiles":null,"spectrum_id":"CCMSLIB00017297538","spectrum_index":41274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 178.9812 Da; putative annotation: N/A; putative formula: C2HN3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.041,"smiles":null,"spectrum_id":"CCMSLIB00017297541","spectrum_index":41275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 149.0819 Da; putative annotation: N/A; putative formula: C5H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.189,"smiles":null,"spectrum_id":"CCMSLIB00017297544","spectrum_index":41276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 216.0638 Da; putative annotation: N/A; putative formula: C9H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.155,"smiles":null,"spectrum_id":"CCMSLIB00017297547","spectrum_index":41277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169471-02!1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone (delta mass: 316.1149 Da; putative annotation: N/A; putative formula: C19H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.175,"smiles":null,"spectrum_id":"CCMSLIB00017297549","spectrum_index":41278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 127.063 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.191,"smiles":null,"spectrum_id":"CCMSLIB00017297551","spectrum_index":41279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 86.0527 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017297554","spectrum_index":41280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 519.2893 Da; putative annotation: N/A; putative formula: C27H37N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.36,"smiles":null,"spectrum_id":"CCMSLIB00017297557","spectrum_index":41281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 29.0404 Da; putative annotation: N/A; putative formula: H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.112,"smiles":null,"spectrum_id":"CCMSLIB00017297560","spectrum_index":41282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 441.2229 Da; putative annotation: N/A; putative formula: C20H35N5O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.289,"smiles":null,"spectrum_id":"CCMSLIB00017297562","spectrum_index":41283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 85.0789 Da; putative annotation: N/A; putative formula: C2H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.186,"smiles":null,"spectrum_id":"CCMSLIB00017297565","spectrum_index":41284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOSE (delta mass: 268.0365 Da; putative annotation: N/A; putative formula: C7H12N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.16,"smiles":null,"spectrum_id":"CCMSLIB00017297567","spectrum_index":41285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 75.0323 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.097,"smiles":null,"spectrum_id":"CCMSLIB00017297570","spectrum_index":41286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 136.1271 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.232,"smiles":null,"spectrum_id":"CCMSLIB00017297573","spectrum_index":41287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 69.0574 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.154,"smiles":null,"spectrum_id":"CCMSLIB00017297576","spectrum_index":41288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 123.1207 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.29,"smiles":null,"spectrum_id":"CCMSLIB00017297578","spectrum_index":41289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 113.0881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.263,"smiles":null,"spectrum_id":"CCMSLIB00017297580","spectrum_index":41290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 248.6303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.717,"smiles":null,"spectrum_id":"CCMSLIB00017297583","spectrum_index":41291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Benzyl-1H-imidazol-2-yl)-1H-1,2,3,4-tetrazole (delta mass: 34.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.131,"smiles":null,"spectrum_id":"CCMSLIB00017297586","spectrum_index":41292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 275.1482 Da; putative annotation: N/A; putative formula: C11H21N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.235,"smiles":null,"spectrum_id":"CCMSLIB00017297589","spectrum_index":41293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS001048919-01!(E)-N-[2-(1H-imidazol-5-yl)ethyl]-3-phenylprop-2-enamide (delta mass: 55.0244 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.153,"smiles":null,"spectrum_id":"CCMSLIB00017297591","spectrum_index":41294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 218.1296 Da; putative annotation: N/A; putative formula: C8H19N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.195,"smiles":null,"spectrum_id":"CCMSLIB00017297593","spectrum_index":41295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 231.1831 Da; putative annotation: N/A; putative formula: C12H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.243,"smiles":null,"spectrum_id":"CCMSLIB00017297596","spectrum_index":41296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU074901 2',4',5'-Trihydroxybutyrophenone|2,4,5-Trihydroxybutyrophenone|1-(2,4,5-trihydroxyphenyl)butan-1-one (delta mass: 138.1034 Da; putative annotation: N/A; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.184,"smiles":null,"spectrum_id":"CCMSLIB00017297598","spectrum_index":41297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 186.1982 Da; putative annotation: N/A; putative formula: C8H22N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.279,"smiles":null,"spectrum_id":"CCMSLIB00017297600","spectrum_index":41298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Allyl-2,6-dimethoxyphenol (delta mass: 181.1097 Da; putative annotation: N/A; putative formula: C10H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.211,"smiles":null,"spectrum_id":"CCMSLIB00017297603","spectrum_index":41299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 178.0587 Da; putative annotation: N/A; putative formula: C5H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.156,"smiles":null,"spectrum_id":"CCMSLIB00017297605","spectrum_index":41300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 176.1099 Da; putative annotation: N/A; putative formula: C6H16N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.258,"smiles":null,"spectrum_id":"CCMSLIB00017297607","spectrum_index":41301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 206.2022 Da; putative annotation: N/A; putative formula: C15H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.273,"smiles":null,"spectrum_id":"CCMSLIB00017297610","spectrum_index":41302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 374.137 Da; putative annotation: N/A; putative formula: C23H23N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":743.27,"smiles":null,"spectrum_id":"CCMSLIB00017297613","spectrum_index":41303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 479.2596 Da; putative annotation: N/A; putative formula: C20H41N5O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.33,"smiles":null,"spectrum_id":"CCMSLIB00017297614","spectrum_index":41304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 82.0487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.12,"smiles":null,"spectrum_id":"CCMSLIB00017297617","spectrum_index":41305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 39.9951 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.05,"smiles":null,"spectrum_id":"CCMSLIB00017297620","spectrum_index":41306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 110.0516 Da; putative annotation: N/A; putative formula: C10H6O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.112,"smiles":null,"spectrum_id":"CCMSLIB00017297622","spectrum_index":41307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 73.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.186,"smiles":null,"spectrum_id":"CCMSLIB00017297625","spectrum_index":41308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 30.0469 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017297627","spectrum_index":41309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 457.754 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.903,"smiles":null,"spectrum_id":"CCMSLIB00017297630","spectrum_index":41310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eglumegad (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.092,"smiles":null,"spectrum_id":"CCMSLIB00017297633","spectrum_index":41311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 24.9112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.013,"smiles":null,"spectrum_id":"CCMSLIB00017297635","spectrum_index":41312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 244.0711 Da; putative annotation: N/A; putative formula: C18H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.168,"smiles":null,"spectrum_id":"CCMSLIB00017297637","spectrum_index":41313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 336.0849 Da; putative annotation: N/A; putative formula: C16H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.145,"smiles":null,"spectrum_id":"CCMSLIB00017297640","spectrum_index":41314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxybenzyl)-5-methyl-2,4-imidazolidinedione (delta mass: 61.0176 Da; putative annotation: N/A; putative formula: CH3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.136,"smiles":null,"spectrum_id":"CCMSLIB00017297643","spectrum_index":41315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 818.7846 Da; putative annotation: N/A; putative formula: C52H102N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1486.01,"smiles":null,"spectrum_id":"CCMSLIB00017297645","spectrum_index":41316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 174.1098 Da; putative annotation: N/A; putative formula: C9H20O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.222,"smiles":null,"spectrum_id":"CCMSLIB00017297647","spectrum_index":41317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 58.0669 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.148,"smiles":null,"spectrum_id":"CCMSLIB00017297650","spectrum_index":41318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 245.8593 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.919,"smiles":null,"spectrum_id":"CCMSLIB00017297653","spectrum_index":41319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myristoyl-L-carnitine (delta mass: 122.0379 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.349,"smiles":null,"spectrum_id":"CCMSLIB00017297655","spectrum_index":41320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 728.6037 Da; putative annotation: N/A; putative formula: C41H76N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":950.701,"smiles":null,"spectrum_id":"CCMSLIB00017297657","spectrum_index":41321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltotriose from NIST14 (delta mass: 66.0104 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.187,"smiles":null,"spectrum_id":"CCMSLIB00017297661","spectrum_index":41322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 271.1873 Da; putative annotation: N/A; putative formula: C9H21N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.409,"smiles":null,"spectrum_id":"CCMSLIB00017297663","spectrum_index":41323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl (E)-3-[5-[(E)-4-hydroxy-3-methylbut-2-enyl]-1-methylimidazol-4-yl]prop-2-enoate (delta mass: 110.062 Da; putative annotation: N/A; putative formula: C4H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.201,"smiles":null,"spectrum_id":"CCMSLIB00017297666","spectrum_index":41324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 178.0614 Da; putative annotation: N/A; putative formula: C4H11N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.158,"smiles":null,"spectrum_id":"CCMSLIB00017297669","spectrum_index":41325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 91.0451 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.204,"smiles":null,"spectrum_id":"CCMSLIB00017297672","spectrum_index":41326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 287.1734 Da; putative annotation: N/A; putative formula: C14H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.265,"smiles":null,"spectrum_id":"CCMSLIB00017297674","spectrum_index":41327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 63.0331 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.161,"smiles":null,"spectrum_id":"CCMSLIB00017297677","spectrum_index":41328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 18.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.268,"smiles":null,"spectrum_id":"CCMSLIB00017297680","spectrum_index":41329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 91.9957 Da; putative annotation: N/A; putative formula: CH5N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.073,"smiles":null,"spectrum_id":"CCMSLIB00017297682","spectrum_index":41330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 186.4403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.5,"smiles":null,"spectrum_id":"CCMSLIB00017297685","spectrum_index":41331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxybiphenyl (delta mass: 51.0182 Da; putative annotation: N/A; putative formula: C2HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.099,"smiles":null,"spectrum_id":"CCMSLIB00017297688","spectrum_index":41332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 238.1078 Da; putative annotation: N/A; putative formula: C11H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.147,"smiles":null,"spectrum_id":"CCMSLIB00017297690","spectrum_index":41333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 384.298 Da; putative annotation: N/A; putative formula: C21H40N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.457,"smiles":null,"spectrum_id":"CCMSLIB00017297692","spectrum_index":41334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 54.0713 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.174,"smiles":null,"spectrum_id":"CCMSLIB00017297695","spectrum_index":41335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 124.0896 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.266,"smiles":null,"spectrum_id":"CCMSLIB00017297697","spectrum_index":41336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 153.0495 Da; putative annotation: N/A; putative formula: C2H3N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.161,"smiles":null,"spectrum_id":"CCMSLIB00017297700","spectrum_index":41337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ310301 Warfarin|2-hydroxy-3-(3-oxo-1-phenylbutyl)chromen-4-one|Coumafen (delta mass: 308.1123 Da; putative annotation: N/A; putative formula: C13H16N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.224,"smiles":null,"spectrum_id":"CCMSLIB00017297703","spectrum_index":41338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 34.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.102,"smiles":null,"spectrum_id":"CCMSLIB00017297705","spectrum_index":41339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2,3-dione (delta mass: 74.0025 Da; putative annotation: N/A; putative formula: C3H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.032,"smiles":null,"spectrum_id":"CCMSLIB00017297707","spectrum_index":41340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 65.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.238,"smiles":null,"spectrum_id":"CCMSLIB00017297710","spectrum_index":41341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 206.5991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.67,"smiles":null,"spectrum_id":"CCMSLIB00017297711","spectrum_index":41342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-9H-pyrido[2,3-b]indole (AalphaC) (delta mass: 27.0824 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.169,"smiles":null,"spectrum_id":"CCMSLIB00017297714","spectrum_index":41343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 32.0625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.143,"smiles":null,"spectrum_id":"CCMSLIB00017297717","spectrum_index":41344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 258.064 Da; putative annotation: N/A; putative formula: C13H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.218,"smiles":null,"spectrum_id":"CCMSLIB00017297719","spectrum_index":41345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 133.5079 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.568,"smiles":null,"spectrum_id":"CCMSLIB00017297721","spectrum_index":41346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 418.0668 Da; putative annotation: N/A; putative formula: C20H22N2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.153,"smiles":null,"spectrum_id":"CCMSLIB00017297724","spectrum_index":41347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 395.028 Da; putative annotation: N/A; putative formula: C12H17N3O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.204,"smiles":null,"spectrum_id":"CCMSLIB00017297727","spectrum_index":41348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 88.0678 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.112,"smiles":null,"spectrum_id":"CCMSLIB00017297728","spectrum_index":41349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 41.1209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.201,"smiles":null,"spectrum_id":"CCMSLIB00017297731","spectrum_index":41350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 123.079 Da; putative annotation: N/A; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.15,"smiles":null,"spectrum_id":"CCMSLIB00017297734","spectrum_index":41351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Iminobiotin (delta mass: 58.0289 Da; putative annotation: N/A; putative formula: H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.14,"smiles":null,"spectrum_id":"CCMSLIB00017297736","spectrum_index":41352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 35.0405 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.137,"smiles":null,"spectrum_id":"CCMSLIB00017297738","spectrum_index":41353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-hydroxybenzo(a)pyrene (delta mass: 41.0691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.165,"smiles":null,"spectrum_id":"CCMSLIB00017297741","spectrum_index":41354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017297743","spectrum_index":41355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 43.0424 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.092,"smiles":null,"spectrum_id":"CCMSLIB00017297745","spectrum_index":41356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000574982-01! (delta mass: 90.0464 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.175,"smiles":null,"spectrum_id":"CCMSLIB00017297748","spectrum_index":41357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 72.0356 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.127,"smiles":null,"spectrum_id":"CCMSLIB00017297751","spectrum_index":41358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 192.0668 Da; putative annotation: N/A; putative formula: C6H13N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.115,"smiles":null,"spectrum_id":"CCMSLIB00017297754","spectrum_index":41359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chloridazon-methyl-desphenyl (delta mass: 11.0896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.117,"smiles":null,"spectrum_id":"CCMSLIB00017297755","spectrum_index":41360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 109.0531 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017297758","spectrum_index":41361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 591.3409 Da; putative annotation: N/A; putative formula: C32H49NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.427,"smiles":null,"spectrum_id":"CCMSLIB00017297761","spectrum_index":41362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 286.1782 Da; putative annotation: N/A; putative formula: C15H26O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.347,"smiles":null,"spectrum_id":"CCMSLIB00017297764","spectrum_index":41363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethidium cation (delta mass: 15.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017297765","spectrum_index":41364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 157.0385 Da; putative annotation: N/A; putative formula: C7H11NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.135,"smiles":null,"spectrum_id":"CCMSLIB00017297768","spectrum_index":41365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 42.0484 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.234,"smiles":null,"spectrum_id":"CCMSLIB00017297771","spectrum_index":41366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 171.0682 Da; putative annotation: N/A; putative formula: C11H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.144,"smiles":null,"spectrum_id":"CCMSLIB00017297774","spectrum_index":41367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole (delta mass: 32.0128 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.081,"smiles":null,"spectrum_id":"CCMSLIB00017297777","spectrum_index":41368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 54.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.347,"smiles":null,"spectrum_id":"CCMSLIB00017297779","spectrum_index":41369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 876.3468 Da; putative annotation: N/A; putative formula: C47H40N16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1041.42,"smiles":null,"spectrum_id":"CCMSLIB00017297781","spectrum_index":41370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl indole-4-carboxylate (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.097,"smiles":null,"spectrum_id":"CCMSLIB00017297784","spectrum_index":41371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MMV026313 (delta mass: 458.3387 Da; putative annotation: N/A; putative formula: C29H46O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.436,"smiles":null,"spectrum_id":"CCMSLIB00017297787","spectrum_index":41372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 226.1641 Da; putative annotation: N/A; putative formula: C8H18N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.318,"smiles":null,"spectrum_id":"CCMSLIB00017297789","spectrum_index":41373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cephalotaxine (delta mass: 17.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017297792","spectrum_index":41374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Ethynyl-1H-indole (delta mass: 8.9736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.039,"smiles":null,"spectrum_id":"CCMSLIB00017297794","spectrum_index":41375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385000-01_C15H18O8_beta-D-Glucopyranose, 1-O-[(2E)-3-(2-hydroxyphenyl)-1-oxo-2-propen-1-yl]- (delta mass: 141.1162 Da; putative annotation: N/A; putative formula: C8H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.224,"smiles":null,"spectrum_id":"CCMSLIB00017297796","spectrum_index":41376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 114.0837 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.326,"smiles":null,"spectrum_id":"CCMSLIB00017297799","spectrum_index":41377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 31.0058 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.196,"smiles":null,"spectrum_id":"CCMSLIB00017297802","spectrum_index":41378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Thr (delta mass: 27.9938 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.107,"smiles":null,"spectrum_id":"CCMSLIB00017297805","spectrum_index":41379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine hydrochloride (delta mass: 197.0995 Da; putative annotation: N/A; putative formula: C9H15N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.178,"smiles":null,"spectrum_id":"CCMSLIB00017297807","spectrum_index":41380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(9H-Carbazol-9-yl)propanoic acid (delta mass: 71.0352 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.137,"smiles":null,"spectrum_id":"CCMSLIB00017297809","spectrum_index":41381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 202.7995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.897,"smiles":null,"spectrum_id":"CCMSLIB00017297812","spectrum_index":41382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 487.3653 Da; putative annotation: N/A; putative formula: C24H50N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.425,"smiles":null,"spectrum_id":"CCMSLIB00017297815","spectrum_index":41383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 488.3631 Da; putative annotation: N/A; putative formula: C27H53O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.423,"smiles":null,"spectrum_id":"CCMSLIB00017297818","spectrum_index":41384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15-Ethenyl-2-hydroxy-9,11,12a,13-tetramethyl-2,3,8b,9,10,11,12,12a,12b,15,15a,15b-dodecahydro-1aH-2,16a-(epiminomethano)-4,7-ethenofluoreno[9,1-bc]oxireno[f]oxacyclotridecine-16,17(8aH)-dione (delta mass: 118.0856 Da; putative annotation: N/A; putative formula: C3H10N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.36,"smiles":null,"spectrum_id":"CCMSLIB00017297820","spectrum_index":41385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 194.2031 Da; putative annotation: N/A; putative formula: C14H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.274,"smiles":null,"spectrum_id":"CCMSLIB00017297823","spectrum_index":41386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 100.0314 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.18,"smiles":null,"spectrum_id":"CCMSLIB00017297825","spectrum_index":41387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 55.0421 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.15,"smiles":null,"spectrum_id":"CCMSLIB00017297828","spectrum_index":41388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 63.9931 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.1,"smiles":null,"spectrum_id":"CCMSLIB00017297831","spectrum_index":41389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 59.0961 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.177,"smiles":null,"spectrum_id":"CCMSLIB00017297834","spectrum_index":41390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 210.1371 Da; putative annotation: N/A; putative formula: C11H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.261,"smiles":null,"spectrum_id":"CCMSLIB00017297836","spectrum_index":41391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CloxacillinNa (delta mass: 238.1423 Da; putative annotation: N/A; putative formula: C11H18N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.215,"smiles":null,"spectrum_id":"CCMSLIB00017297838","spectrum_index":41392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 63.0461 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.138,"smiles":null,"spectrum_id":"CCMSLIB00017297841","spectrum_index":41393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SODIUM D-GLUCONATE (delta mass: 83.0736 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017297844","spectrum_index":41394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 309.1326 Da; putative annotation: N/A; putative formula: C14H19N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.219,"smiles":null,"spectrum_id":"CCMSLIB00017297845","spectrum_index":41395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 76.0318 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.155,"smiles":null,"spectrum_id":"CCMSLIB00017297848","spectrum_index":41396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid (delta mass: 344.155 Da; putative annotation: N/A; putative formula: C21H21N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.213,"smiles":null,"spectrum_id":"CCMSLIB00017297851","spectrum_index":41397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 31.0942 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.269,"smiles":null,"spectrum_id":"CCMSLIB00017297853","spectrum_index":41398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 112.0024 Da; putative annotation: N/A; putative formula: C2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.173,"smiles":null,"spectrum_id":"CCMSLIB00017297856","spectrum_index":41399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 453.1504 Da; putative annotation: N/A; putative formula: C19H27N5O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.222,"smiles":null,"spectrum_id":"CCMSLIB00017297858","spectrum_index":41400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 93.104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.201,"smiles":null,"spectrum_id":"CCMSLIB00017297860","spectrum_index":41401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 79.0532 Da; putative annotation: N/A; putative formula: C4H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.124,"smiles":null,"spectrum_id":"CCMSLIB00017297863","spectrum_index":41402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 226.1737 Da; putative annotation: N/A; putative formula: C17H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.35,"smiles":null,"spectrum_id":"CCMSLIB00017297866","spectrum_index":41403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 43.0028 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.118,"smiles":null,"spectrum_id":"CCMSLIB00017297868","spectrum_index":41404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 112.0717 Da; putative annotation: N/A; putative formula: C7H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.152,"smiles":null,"spectrum_id":"CCMSLIB00017297870","spectrum_index":41405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 70.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.207,"smiles":null,"spectrum_id":"CCMSLIB00017297873","spectrum_index":41406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 129.0327 Da; putative annotation: N/A; putative formula: C7H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.124,"smiles":null,"spectrum_id":"CCMSLIB00017297875","spectrum_index":41407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acridine-9-carboxylic acid (delta mass: 55.0302 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.101,"smiles":null,"spectrum_id":"CCMSLIB00017297877","spectrum_index":41408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 136.1248 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.346,"smiles":null,"spectrum_id":"CCMSLIB00017297880","spectrum_index":41409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 39.4087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017297882","spectrum_index":41410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 261.1018 Da; putative annotation: N/A; putative formula: C15H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.182,"smiles":null,"spectrum_id":"CCMSLIB00017297885","spectrum_index":41411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 258.088 Da; putative annotation: N/A; putative formula: C9H15N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.159,"smiles":null,"spectrum_id":"CCMSLIB00017297887","spectrum_index":41412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 38.1483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.154,"smiles":null,"spectrum_id":"CCMSLIB00017297889","spectrum_index":41413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 14.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.144,"smiles":null,"spectrum_id":"CCMSLIB00017297892","spectrum_index":41414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Tris(4-hydroxyphenyl)benzene (delta mass: 135.0526 Da; putative annotation: N/A; putative formula: C4H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.185,"smiles":null,"spectrum_id":"CCMSLIB00017297895","spectrum_index":41415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-tert-Butyl-2,4-dihydroxybenzophenone (delta mass: 60.0183 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.151,"smiles":null,"spectrum_id":"CCMSLIB00017297897","spectrum_index":41416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 101.1269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.248,"smiles":null,"spectrum_id":"CCMSLIB00017297899","spectrum_index":41417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 158.0944 Da; putative annotation: N/A; putative formula: C8H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017297902","spectrum_index":41418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 208.1568 Da; putative annotation: N/A; putative formula: C12H20N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.31,"smiles":null,"spectrum_id":"CCMSLIB00017297905","spectrum_index":41419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 43.042 Da; putative annotation: N/A; putative formula: C2H5N)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017297907","spectrum_index":41420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 186.0522 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.112,"smiles":null,"spectrum_id":"CCMSLIB00017297909","spectrum_index":41421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylic acid (delta mass: 245.08 Da; putative annotation: N/A; putative formula: C12H11N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.193,"smiles":null,"spectrum_id":"CCMSLIB00017297912","spectrum_index":41422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 344.1317 Da; putative annotation: N/A; putative formula: C10H12N14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.198,"smiles":null,"spectrum_id":"CCMSLIB00017297915","spectrum_index":41423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 106.0784 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.175,"smiles":null,"spectrum_id":"CCMSLIB00017297918","spectrum_index":41424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 141.988 Da; putative annotation: N/A; putative formula: CH-2N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.053,"smiles":null,"spectrum_id":"CCMSLIB00017297921","spectrum_index":41425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-tetrahydro-6-methoxy-1-oxo-beta-carboline (delta mass: 277.095 Da; putative annotation: N/A; putative formula: C14H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.192,"smiles":null,"spectrum_id":"CCMSLIB00017297923","spectrum_index":41426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 243.2173 Da; putative annotation: N/A; putative formula: C10H25N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.34,"smiles":null,"spectrum_id":"CCMSLIB00017297926","spectrum_index":41427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,1-Dimethyl-4-nitro-1H-imidazol-5-amine (delta mass: 97.0415 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.113,"smiles":null,"spectrum_id":"CCMSLIB00017297929","spectrum_index":41428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of .alpha.-D-(+)-Talose (delta mass: 252.0428 Da; putative annotation: \"\"3,3',4'-Trihydroxyflavone CollisionEnergy:102040\"\"; putative formula: C15H8O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.113,"smiles":null,"spectrum_id":"CCMSLIB00017297932","spectrum_index":41429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 258.0863 Da; putative annotation: L-.gamma.-Glutamyl-L-glutamic acid; putative formula: C10H14N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.189,"smiles":null,"spectrum_id":"CCMSLIB00017297934","spectrum_index":41430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 330.2196 Da; putative annotation: (1S,4aR,5S)-5-[(E)-5-Methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid; putative formula: C21H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.343,"smiles":null,"spectrum_id":"CCMSLIB00017297937","spectrum_index":41431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 250.1352 Da; putative annotation: 3,6-Diphenylcyclohexane-1,2-diol; putative formula: C18H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.2,"smiles":null,"spectrum_id":"CCMSLIB00017297939","spectrum_index":41432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3S_2349_Tetrahydro_1h_pyrido_34b_indole_carboxylic_acid (delta mass: 143.0727 Da; putative annotation: Tryptophol - 40.0 eV; putative formula: C10H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.17,"smiles":null,"spectrum_id":"CCMSLIB00017297942","spectrum_index":41433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 270.0994 Da; putative annotation: N/A; putative formula: C17H19O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.165,"smiles":null,"spectrum_id":"CCMSLIB00017297945","spectrum_index":41434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 148.1084 Da; putative annotation: N/A; putative formula: C3H12N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.189,"smiles":null,"spectrum_id":"CCMSLIB00017297948","spectrum_index":41435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 200.2028 Da; putative annotation: N/A; putative formula: C10H24N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.372,"smiles":null,"spectrum_id":"CCMSLIB00017297950","spectrum_index":41436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 21.9892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.086,"smiles":null,"spectrum_id":"CCMSLIB00017297952","spectrum_index":41437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 327.1685 Da; putative annotation: N/A; putative formula: C16H25NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.281,"smiles":null,"spectrum_id":"CCMSLIB00017297955","spectrum_index":41438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxy-2-methylindole-3-carboxylic acid CollisionEnergy:205060 (delta mass: 41.0273 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.093,"smiles":null,"spectrum_id":"CCMSLIB00017297958","spectrum_index":41439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 1075.7055 Da; putative annotation: N/A; putative formula: C74H93NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1241.83,"smiles":null,"spectrum_id":"CCMSLIB00017297961","spectrum_index":41440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 94.0782 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017297963","spectrum_index":41441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 181.0285 Da; putative annotation: N/A; putative formula: C3H3N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.205,"smiles":null,"spectrum_id":"CCMSLIB00017297965","spectrum_index":41442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Dihydroxybiphenyl (delta mass: 19.0179 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.093,"smiles":null,"spectrum_id":"CCMSLIB00017297968","spectrum_index":41443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norharmane (delta mass: 72.0581 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.134,"smiles":null,"spectrum_id":"CCMSLIB00017297971","spectrum_index":41444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-5,6-dimethyl-2-pyrazinecarboxylic acid (delta mass: 96.0102 Da; putative annotation: N/A; putative formula: C7N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.087,"smiles":null,"spectrum_id":"CCMSLIB00017297974","spectrum_index":41445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 78.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.191,"smiles":null,"spectrum_id":"CCMSLIB00017297975","spectrum_index":41446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 181.2081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.268,"smiles":null,"spectrum_id":"CCMSLIB00017297978","spectrum_index":41447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 78.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.154,"smiles":null,"spectrum_id":"CCMSLIB00017297981","spectrum_index":41448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 504.2624 Da; putative annotation: N/A; putative formula: C30H36N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.401,"smiles":null,"spectrum_id":"CCMSLIB00017297984","spectrum_index":41449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 269.2364 Da; putative annotation: N/A; putative formula: C16H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.312,"smiles":null,"spectrum_id":"CCMSLIB00017297986","spectrum_index":41450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 209.1861 Da; putative annotation: N/A; putative formula: C12H23N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.283,"smiles":null,"spectrum_id":"CCMSLIB00017297989","spectrum_index":41451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine methyl ester (delta mass: 238.2291 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.303,"smiles":null,"spectrum_id":"CCMSLIB00017297991","spectrum_index":41452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloropropyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 47.2155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.279,"smiles":null,"spectrum_id":"CCMSLIB00017297994","spectrum_index":41453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 212.1542 Da; putative annotation: N/A; putative formula: C10H21N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.224,"smiles":null,"spectrum_id":"CCMSLIB00017297997","spectrum_index":41454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-[4-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triaz ol-3-ylthio]acetamide CollisionEnergy:102040\"\" (delta mass: 18.0127 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.13,"smiles":null,"spectrum_id":"CCMSLIB00017298000","spectrum_index":41455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 62.0364 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.216,"smiles":null,"spectrum_id":"CCMSLIB00017298002","spectrum_index":41456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Asp (delta mass: 438.2163 Da; putative annotation: N/A; putative formula: C26H34N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.32,"smiles":null,"spectrum_id":"CCMSLIB00017298004","spectrum_index":41457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169735-02!(5S)-5-hydroxy-1,7-diphenylheptan-3-one (delta mass: 124.0737 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.243,"smiles":null,"spectrum_id":"CCMSLIB00017298007","spectrum_index":41458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 62.044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.183,"smiles":null,"spectrum_id":"CCMSLIB00017298010","spectrum_index":41459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 272.1048 Da; putative annotation: N/A; putative formula: C16H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.176,"smiles":null,"spectrum_id":"CCMSLIB00017298013","spectrum_index":41460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GKK 1032B (delta mass: 158.115 Da; putative annotation: N/A; putative formula: C2H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.41,"smiles":null,"spectrum_id":"CCMSLIB00017298016","spectrum_index":41461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 30.1716 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.236,"smiles":null,"spectrum_id":"CCMSLIB00017298017","spectrum_index":41462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 159.0391 Da; putative annotation: N/A; putative formula: C8H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.084,"smiles":null,"spectrum_id":"CCMSLIB00017298020","spectrum_index":41463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of guaiacol CollisionEnergy:102040 (delta mass: 38.1266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.186,"smiles":null,"spectrum_id":"CCMSLIB00017298023","spectrum_index":41464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 103.0634 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.123,"smiles":null,"spectrum_id":"CCMSLIB00017298026","spectrum_index":41465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methoxycinnamic acid (delta mass: 9.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.107,"smiles":null,"spectrum_id":"CCMSLIB00017298029","spectrum_index":41466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 285.0343 Da; putative annotation: N/A; putative formula: C8H15NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.11,"smiles":null,"spectrum_id":"CCMSLIB00017298030","spectrum_index":41467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1125.399 Da; putative annotation: N/A; putative formula: C45H79NO23P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1288.46,"smiles":null,"spectrum_id":"CCMSLIB00017298033","spectrum_index":41468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Guanidinoglutaric acid (delta mass: 128.0488 Da; putative annotation: N/A; putative formula: C7H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.131,"smiles":null,"spectrum_id":"CCMSLIB00017298036","spectrum_index":41469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 244.1732 Da; putative annotation: N/A; putative formula: C11H24N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.348,"smiles":null,"spectrum_id":"CCMSLIB00017298037","spectrum_index":41470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 50.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.185,"smiles":null,"spectrum_id":"CCMSLIB00017298040","spectrum_index":41471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 219.0573 Da; putative annotation: N/A; putative formula: C9H17NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.207,"smiles":null,"spectrum_id":"CCMSLIB00017298043","spectrum_index":41472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 221.1343 Da; putative annotation: N/A; putative formula: C4H15N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.283,"smiles":null,"spectrum_id":"CCMSLIB00017298046","spectrum_index":41473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 147.1041 Da; putative annotation: N/A; putative formula: C10H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.164,"smiles":null,"spectrum_id":"CCMSLIB00017298047","spectrum_index":41474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 283.1146 Da; putative annotation: N/A; putative formula: C16H17N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.18,"smiles":null,"spectrum_id":"CCMSLIB00017298050","spectrum_index":41475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 191.1239 Da; putative annotation: N/A; putative formula: C12H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.205,"smiles":null,"spectrum_id":"CCMSLIB00017298053","spectrum_index":41476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 36.023 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.162,"smiles":null,"spectrum_id":"CCMSLIB00017298056","spectrum_index":41477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxybutorphanol (delta mass: 128.1196 Da; putative annotation: N/A; putative formula: C8H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.342,"smiles":null,"spectrum_id":"CCMSLIB00017298058","spectrum_index":41478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 288.084 Da; putative annotation: N/A; putative formula: C12H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017298060","spectrum_index":41479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 241.0838 Da; putative annotation: N/A; putative formula: C6H16N3O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.159,"smiles":null,"spectrum_id":"CCMSLIB00017298063","spectrum_index":41480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 97.9779 Da; putative annotation: N/A; putative formula: CH-1N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.043,"smiles":null,"spectrum_id":"CCMSLIB00017298066","spectrum_index":41481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-2-(1H-imidazol-1-yl)phenylamine (delta mass: 42.9943 Da; putative annotation: N/A; putative formula: CH2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.072,"smiles":null,"spectrum_id":"CCMSLIB00017298068","spectrum_index":41482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-3-phenylbutanoic acid (delta mass: 52.0312 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.133,"smiles":null,"spectrum_id":"CCMSLIB00017298071","spectrum_index":41483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Difluoromethoxy)-1H-indole-2-carboxylic acid (delta mass: 118.0337 Da; putative annotation: N/A; putative formula: C8H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.08,"smiles":null,"spectrum_id":"CCMSLIB00017298074","spectrum_index":41484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 51.0108 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.087,"smiles":null,"spectrum_id":"CCMSLIB00017298076","spectrum_index":41485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)pyrazine (delta mass: 155.5776 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.649,"smiles":null,"spectrum_id":"CCMSLIB00017298078","spectrum_index":41486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 111.0683 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.16,"smiles":null,"spectrum_id":"CCMSLIB00017298081","spectrum_index":41487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 74.0366 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.17,"smiles":null,"spectrum_id":"CCMSLIB00017298084","spectrum_index":41488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNnT (delta mass: 89.0271 Da; putative annotation: N/A; putative formula: C6H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":797.283,"smiles":null,"spectrum_id":"CCMSLIB00017298086","spectrum_index":41489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 359.2044 Da; putative annotation: N/A; putative formula: C18H34NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.239,"smiles":null,"spectrum_id":"CCMSLIB00017298088","spectrum_index":41490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 402.2197 Da; putative annotation: N/A; putative formula: C27H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.374,"smiles":null,"spectrum_id":"CCMSLIB00017298091","spectrum_index":41491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 52.8048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.902,"smiles":null,"spectrum_id":"CCMSLIB00017298094","spectrum_index":41492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 14.8986 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.979,"smiles":null,"spectrum_id":"CCMSLIB00017298096","spectrum_index":41493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Sialylgalactose (delta mass: 84.0517 Da; putative annotation: N/A; putative formula: C5H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.218,"smiles":null,"spectrum_id":"CCMSLIB00017298098","spectrum_index":41494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 177.0424 Da; putative annotation: N/A; putative formula: C9H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.108,"smiles":null,"spectrum_id":"CCMSLIB00017298101","spectrum_index":41495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 12.036 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.201,"smiles":null,"spectrum_id":"CCMSLIB00017298104","spectrum_index":41496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 1108.5518 Da; putative annotation: N/A; putative formula: C76H68N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1271.61,"smiles":null,"spectrum_id":"CCMSLIB00017298107","spectrum_index":41497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 74.0354 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.153,"smiles":null,"spectrum_id":"CCMSLIB00017298109","spectrum_index":41498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 60.0208 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.123,"smiles":null,"spectrum_id":"CCMSLIB00017298111","spectrum_index":41499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380084-01_C21H30O4_Benzo[b]cyclopenta[e]pyran-8(3H)-one, 3a,5,6,7,9,9a-hexahydro-7-hydroxy-1-[(4E)-6-hydroxy-1,5-dimethyl-4-hexen-1-yl]-3a-methyl- (delta mass: 18.0097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.231,"smiles":null,"spectrum_id":"CCMSLIB00017298114","spectrum_index":41500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 14.0129 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.141,"smiles":null,"spectrum_id":"CCMSLIB00017298117","spectrum_index":41501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-2-ol (delta mass: 104.0256 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.086,"smiles":null,"spectrum_id":"CCMSLIB00017298120","spectrum_index":41502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 60.0366 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.196,"smiles":null,"spectrum_id":"CCMSLIB00017298121","spectrum_index":41503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 110.0473 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.196,"smiles":null,"spectrum_id":"CCMSLIB00017298124","spectrum_index":41504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 166.1115 Da; putative annotation: N/A; putative formula: C9H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.224,"smiles":null,"spectrum_id":"CCMSLIB00017298127","spectrum_index":41505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Ethyl-2,4-dihydroxy-6-methoxyphenyl)-1-butanone (delta mass: 76.0676 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.195,"smiles":null,"spectrum_id":"CCMSLIB00017298129","spectrum_index":41506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.155,"smiles":null,"spectrum_id":"CCMSLIB00017298131","spectrum_index":41507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 225.2447 Da; putative annotation: N/A; putative formula: C15H31N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.315,"smiles":null,"spectrum_id":"CCMSLIB00017298134","spectrum_index":41508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 113.0825 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.216,"smiles":null,"spectrum_id":"CCMSLIB00017298137","spectrum_index":41509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 6.0542 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.157,"smiles":null,"spectrum_id":"CCMSLIB00017298138","spectrum_index":41510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C8:0 (delta mass: 146.0735 Da; putative annotation: N/A; putative formula: C3H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.285,"smiles":null,"spectrum_id":"CCMSLIB00017298141","spectrum_index":41511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histamine - 40.0 eV (delta mass: 120.0313 Da; putative annotation: N/A; putative formula: C6H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017298144","spectrum_index":41512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hypaphorine (delta mass: 41.0711 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.215,"smiles":null,"spectrum_id":"CCMSLIB00017298146","spectrum_index":41513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 73.0044 Da; putative annotation: N/A; putative formula: C4H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.091,"smiles":null,"spectrum_id":"CCMSLIB00017298149","spectrum_index":41514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 684.233 Da; putative annotation: N/A; putative formula: C48H33N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1027.36,"smiles":null,"spectrum_id":"CCMSLIB00017298152","spectrum_index":41515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-hydroxy-1H-pyrimidin-4-one (delta mass: 59.0389 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.084,"smiles":null,"spectrum_id":"CCMSLIB00017298155","spectrum_index":41516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 251.1004 Da; putative annotation: N/A; putative formula: C9H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.224,"smiles":null,"spectrum_id":"CCMSLIB00017298158","spectrum_index":41517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 295.2737 Da; putative annotation: N/A; putative formula: C16H33N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.308,"smiles":null,"spectrum_id":"CCMSLIB00017298160","spectrum_index":41518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 14.985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.061,"smiles":null,"spectrum_id":"CCMSLIB00017298163","spectrum_index":41519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-6-hydroxy-1H-pyrimidin-4-one (delta mass: 60.0346 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.08,"smiles":null,"spectrum_id":"CCMSLIB00017298166","spectrum_index":41520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 319.9325 Da; putative annotation: N/A; putative formula: C6H8O9S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.019,"smiles":null,"spectrum_id":"CCMSLIB00017298169","spectrum_index":41521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 323.1737 Da; putative annotation: N/A; putative formula: C10H25N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.26,"smiles":null,"spectrum_id":"CCMSLIB00017298170","spectrum_index":41522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 83.0259 Da; putative annotation: N/A; putative formula: CHN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017298173","spectrum_index":41523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetyl-5-hydroxy-3-methylphenyl .beta.-D-glucopyranoside (delta mass: 80.0624 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.185,"smiles":null,"spectrum_id":"CCMSLIB00017298176","spectrum_index":41524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN - 40.0 eV (delta mass: 31.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017298179","spectrum_index":41525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 154.0229 Da; putative annotation: N/A; putative formula: C2H6N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.114,"smiles":null,"spectrum_id":"CCMSLIB00017298180","spectrum_index":41526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 67.0783 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.165,"smiles":null,"spectrum_id":"CCMSLIB00017298183","spectrum_index":41527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 197.1069 Da; putative annotation: N/A; putative formula: C11H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.183,"smiles":null,"spectrum_id":"CCMSLIB00017298186","spectrum_index":41528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 101.0465 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.175,"smiles":null,"spectrum_id":"CCMSLIB00017298188","spectrum_index":41529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-isopropylthiophenethylamine (delta mass: 17.0221 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.159,"smiles":null,"spectrum_id":"CCMSLIB00017298190","spectrum_index":41530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 27.9932 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.257,"smiles":null,"spectrum_id":"CCMSLIB00017298193","spectrum_index":41531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 366.2112 Da; putative annotation: N/A; putative formula: C24H31OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.335,"smiles":null,"spectrum_id":"CCMSLIB00017298196","spectrum_index":41532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 517.3407 Da; putative annotation: N/A; putative formula: C23H47N7O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.464,"smiles":null,"spectrum_id":"CCMSLIB00017298199","spectrum_index":41533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 382.2209 Da; putative annotation: N/A; putative formula: C20H35N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.344,"smiles":null,"spectrum_id":"CCMSLIB00017298200","spectrum_index":41534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 76.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.122,"smiles":null,"spectrum_id":"CCMSLIB00017298203","spectrum_index":41535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 91.0309 Da; putative annotation: N/A; putative formula: CH6N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.089,"smiles":null,"spectrum_id":"CCMSLIB00017298206","spectrum_index":41536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrindole (delta mass: 18.0176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.219,"smiles":null,"spectrum_id":"CCMSLIB00017298209","spectrum_index":41537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00918 Demethoxycurcumin (delta mass: 46.0766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.199,"smiles":null,"spectrum_id":"CCMSLIB00017298210","spectrum_index":41538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 94.0631 Da; putative annotation: N/A; putative formula: C4H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.191,"smiles":null,"spectrum_id":"CCMSLIB00017298213","spectrum_index":41539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 48.0361 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.279,"smiles":null,"spectrum_id":"CCMSLIB00017298216","spectrum_index":41540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 17.9564 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.121,"smiles":null,"spectrum_id":"CCMSLIB00017298218","spectrum_index":41541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one (delta mass: 161.0324 Da; putative annotation: N/A; putative formula: C5H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.114,"smiles":null,"spectrum_id":"CCMSLIB00017298220","spectrum_index":41542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Ala (delta mass: 210.0991 Da; putative annotation: N/A; putative formula: C12H19O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.228,"smiles":null,"spectrum_id":"CCMSLIB00017298223","spectrum_index":41543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noratropine (delta mass: 84.0369 Da; putative annotation: N/A; putative formula: C8H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.196,"smiles":null,"spectrum_id":"CCMSLIB00017298226","spectrum_index":41544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-(1H-Imidazol-1-yl)propyl]-2-(4-methylphenyl)acetamide (delta mass: 66.0567 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.217,"smiles":null,"spectrum_id":"CCMSLIB00017298229","spectrum_index":41545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 86.0116 Da; putative annotation: N/A; putative formula: C2H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.082,"smiles":null,"spectrum_id":"CCMSLIB00017298230","spectrum_index":41546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 294.0935 Da; putative annotation: N/A; putative formula: C16H22O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.18,"smiles":null,"spectrum_id":"CCMSLIB00017298233","spectrum_index":41547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 394.1975 Da; putative annotation: N/A; putative formula: C18H30N6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.253,"smiles":null,"spectrum_id":"CCMSLIB00017298236","spectrum_index":41548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Ethynylcyclododecanol (delta mass: 313.1739 Da; putative annotation: N/A; putative formula: C13H23N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.364,"smiles":null,"spectrum_id":"CCMSLIB00017298239","spectrum_index":41549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 60.0281 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.193,"smiles":null,"spectrum_id":"CCMSLIB00017298240","spectrum_index":41550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xanthoxylin CollisionEnergy:205060 (delta mass: 96.0283 Da; putative annotation: N/A; putative formula: N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.109,"smiles":null,"spectrum_id":"CCMSLIB00017298243","spectrum_index":41551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 464.235 Da; putative annotation: N/A; putative formula: C32H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.337,"smiles":null,"spectrum_id":"CCMSLIB00017298246","spectrum_index":41552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 28.2073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.315,"smiles":null,"spectrum_id":"CCMSLIB00017298249","spectrum_index":41553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 146.0687 Da; putative annotation: N/A; putative formula: C7H15O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.202,"smiles":null,"spectrum_id":"CCMSLIB00017298250","spectrum_index":41554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 102.8448 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.91,"smiles":null,"spectrum_id":"CCMSLIB00017298253","spectrum_index":41555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanohydrazide (delta mass: 28.0012 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.124,"smiles":null,"spectrum_id":"CCMSLIB00017298256","spectrum_index":41556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 42.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017298259","spectrum_index":41557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 134.044 Da; putative annotation: N/A; putative formula: C2H6N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.085,"smiles":null,"spectrum_id":"CCMSLIB00017298260","spectrum_index":41558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ellipticine CollisionEnergy:205060 (delta mass: 308.1235 Da; putative annotation: N/A; putative formula: C20H20OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.247,"smiles":null,"spectrum_id":"CCMSLIB00017298263","spectrum_index":41559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 89.0485 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.07,"smiles":null,"spectrum_id":"CCMSLIB00017298266","spectrum_index":41560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 461.2491 Da; putative annotation: N/A; putative formula: C20H39N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.319,"smiles":null,"spectrum_id":"CCMSLIB00017298268","spectrum_index":41561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 132.0575 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017298271","spectrum_index":41562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4(1H)-Pyrimidinone, 6-(1-methylethyl)- (delta mass: 94.0459 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.133,"smiles":null,"spectrum_id":"CCMSLIB00017298274","spectrum_index":41563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 606.2721 Da; putative annotation: N/A; putative formula: C31H39N6O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.358,"smiles":null,"spectrum_id":"CCMSLIB00017298276","spectrum_index":41564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 128.0589 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.124,"smiles":null,"spectrum_id":"CCMSLIB00017298279","spectrum_index":41565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYLHISTAMINE (delta mass: 329.2706 Da; putative annotation: N/A; putative formula: C22H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.373,"smiles":null,"spectrum_id":"CCMSLIB00017298282","spectrum_index":41566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of FENOLDOPAM MESYLATE (delta mass: 109.0617 Da; putative annotation: N/A; putative formula: C5H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.151,"smiles":null,"spectrum_id":"CCMSLIB00017298284","spectrum_index":41567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 854.7229 Da; putative annotation: N/A; putative formula: C53H106O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1076.82,"smiles":null,"spectrum_id":"CCMSLIB00017298286","spectrum_index":41568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 583.3571 Da; putative annotation: N/A; putative formula: C27H53NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.412,"smiles":null,"spectrum_id":"CCMSLIB00017298289","spectrum_index":41569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin (delta mass: 384.2206 Da; putative annotation: N/A; putative formula: C19H28N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.316,"smiles":null,"spectrum_id":"CCMSLIB00017298292","spectrum_index":41570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 205.1728 Da; putative annotation: N/A; putative formula: C11H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.332,"smiles":null,"spectrum_id":"CCMSLIB00017298295","spectrum_index":41571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 446.2063 Da; putative annotation: N/A; putative formula: C24H34N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":775.392,"smiles":null,"spectrum_id":"CCMSLIB00017298297","spectrum_index":41572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 215.0695 Da; putative annotation: N/A; putative formula: C11H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.14,"smiles":null,"spectrum_id":"CCMSLIB00017298300","spectrum_index":41573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 36.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.165,"smiles":null,"spectrum_id":"CCMSLIB00017298302","spectrum_index":41574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 115.0996 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.228,"smiles":null,"spectrum_id":"CCMSLIB00017298304","spectrum_index":41575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 58.0442 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.152,"smiles":null,"spectrum_id":"CCMSLIB00017298307","spectrum_index":41576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Imidazol-1-ylmethyl)benzoic acid (delta mass: 134.0254 Da; putative annotation: N/A; putative formula: C2H6N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.107,"smiles":null,"spectrum_id":"CCMSLIB00017298309","spectrum_index":41577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 104.0581 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.14,"smiles":null,"spectrum_id":"CCMSLIB00017298312","spectrum_index":41578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 59.0463 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.139,"smiles":null,"spectrum_id":"CCMSLIB00017298314","spectrum_index":41579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 220.0307 Da; putative annotation: N/A; putative formula: C10H8N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.086,"smiles":null,"spectrum_id":"CCMSLIB00017298318","spectrum_index":41580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 18.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.113,"smiles":null,"spectrum_id":"CCMSLIB00017298320","spectrum_index":41581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phomalone (delta mass: 92.0625 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017298323","spectrum_index":41582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-hydroxy-1,7-diphenylhept-1-en-3-one (delta mass: 159.8346 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.988,"smiles":null,"spectrum_id":"CCMSLIB00017298326","spectrum_index":41583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine (delta mass: 150.1004 Da; putative annotation: N/A; putative formula: C6H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.208,"smiles":null,"spectrum_id":"CCMSLIB00017298329","spectrum_index":41584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 235.1409 Da; putative annotation: N/A; putative formula: C7H13N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.242,"smiles":null,"spectrum_id":"CCMSLIB00017298330","spectrum_index":41585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 288.2449 Da; putative annotation: N/A; putative formula: C20H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.516,"smiles":null,"spectrum_id":"CCMSLIB00017298333","spectrum_index":41586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 152.0235 Da; putative annotation: N/A; putative formula: C7N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.131,"smiles":null,"spectrum_id":"CCMSLIB00017298336","spectrum_index":41587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 41.0507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.153,"smiles":null,"spectrum_id":"CCMSLIB00017298338","spectrum_index":41588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 409.147 Da; putative annotation: N/A; putative formula: C22H25N3OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.234,"smiles":null,"spectrum_id":"CCMSLIB00017298340","spectrum_index":41589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 58.0636 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.16,"smiles":null,"spectrum_id":"CCMSLIB00017298343","spectrum_index":41590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 219.1433 Da; putative annotation: N/A; putative formula: C6H17N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.245,"smiles":null,"spectrum_id":"CCMSLIB00017298345","spectrum_index":41591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylcytosine (delta mass: 75.0021 Da; putative annotation: N/A; putative formula: H2N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.068,"smiles":null,"spectrum_id":"CCMSLIB00017298348","spectrum_index":41592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-(2-fluorophenyl)-1H-pyrazole-4-carbonitrile (delta mass: 150.0656 Da; putative annotation: N/A; putative formula: C5H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.138,"smiles":null,"spectrum_id":"CCMSLIB00017298351","spectrum_index":41593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4',6'-Dimethoxy-2'-hydroxyacetophenone (delta mass: 11.0286 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.109,"smiles":null,"spectrum_id":"CCMSLIB00017298353","spectrum_index":41594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 324.3152 Da; putative annotation: N/A; putative formula: C20H40N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.428,"smiles":null,"spectrum_id":"CCMSLIB00017298356","spectrum_index":41595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 60.037 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.264,"smiles":null,"spectrum_id":"CCMSLIB00017298359","spectrum_index":41596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 92.051 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.153,"smiles":null,"spectrum_id":"CCMSLIB00017298361","spectrum_index":41597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 56.026 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.123,"smiles":null,"spectrum_id":"CCMSLIB00017298364","spectrum_index":41598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 48.0403 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017298367","spectrum_index":41599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 162.0507 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.121,"smiles":null,"spectrum_id":"CCMSLIB00017298370","spectrum_index":41600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 81.043 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.197,"smiles":null,"spectrum_id":"CCMSLIB00017298372","spectrum_index":41601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 653.2634 Da; putative annotation: N/A; putative formula: C39H43NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.361,"smiles":null,"spectrum_id":"CCMSLIB00017298375","spectrum_index":41602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 382.2182 Da; putative annotation: N/A; putative formula: C21H34O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.315,"smiles":null,"spectrum_id":"CCMSLIB00017298378","spectrum_index":41603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 268.0373 Da; putative annotation: Fisetin; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.097,"smiles":null,"spectrum_id":"CCMSLIB00017298381","spectrum_index":41604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 158.0215 Da; putative annotation: D(+)-Glucuronic acid .gamma.-lactone; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.092,"smiles":null,"spectrum_id":"CCMSLIB00017298382","spectrum_index":41605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 161.0692 Da; putative annotation: D-Mannosamine; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.193,"smiles":null,"spectrum_id":"CCMSLIB00017298385","spectrum_index":41606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 92.0375 Da; putative annotation: 6-Methyl-3-pyridazinol; putative formula: C5H4N2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.103,"smiles":null,"spectrum_id":"CCMSLIB00017298388","spectrum_index":41607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 108.0201 Da; putative annotation: 5-(Hydroxymethyl)-2-furaldehyde; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.091,"smiles":null,"spectrum_id":"CCMSLIB00017298389","spectrum_index":41608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 58.0401 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.137,"smiles":null,"spectrum_id":"CCMSLIB00017298392","spectrum_index":41609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 140.1197 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.2,"smiles":null,"spectrum_id":"CCMSLIB00017298395","spectrum_index":41610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl glycolate (delta mass: 60.0381 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.093,"smiles":null,"spectrum_id":"CCMSLIB00017298398","spectrum_index":41611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl 2-(aminomethyl)phenylcarbamate (delta mass: 210.9685 Da; putative annotation: N/A; putative formula: C6HN3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.113,"smiles":null,"spectrum_id":"CCMSLIB00017298399","spectrum_index":41612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 64.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017298402","spectrum_index":41613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 90.0833 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.31,"smiles":null,"spectrum_id":"CCMSLIB00017298405","spectrum_index":41614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385408-01_C17H17N5O2_3-(1H-Imidazol-4-ylmethyl)-6-(1H-indol-3-ylmethyl)-2,5-piperazinedione (delta mass: 194.1308 Da; putative annotation: N/A; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.276,"smiles":null,"spectrum_id":"CCMSLIB00017298408","spectrum_index":41615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 42.0099 Da; putative annotation: N/A; putative formula: C2H2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.091,"smiles":null,"spectrum_id":"CCMSLIB00017298409","spectrum_index":41616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 326.259 Da; putative annotation: N/A; putative formula: C19H30N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.356,"smiles":null,"spectrum_id":"CCMSLIB00017298412","spectrum_index":41617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 181.0195 Da; putative annotation: N/A; putative formula: C8H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.158,"smiles":null,"spectrum_id":"CCMSLIB00017298415","spectrum_index":41618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 160.0678 Da; putative annotation: N/A; putative formula: C14H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.165,"smiles":null,"spectrum_id":"CCMSLIB00017298418","spectrum_index":41619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tolbutamide (delta mass: 86.0586 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.17,"smiles":null,"spectrum_id":"CCMSLIB00017298420","spectrum_index":41620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 132.0886 Da; putative annotation: N/A; putative formula: C5H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.275,"smiles":null,"spectrum_id":"CCMSLIB00017298422","spectrum_index":41621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 840.4885 Da; putative annotation: N/A; putative formula: C45H68N4O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1033.56,"smiles":null,"spectrum_id":"CCMSLIB00017298425","spectrum_index":41622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 35.0352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.106,"smiles":null,"spectrum_id":"CCMSLIB00017298428","spectrum_index":41623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 155.0667 Da; putative annotation: N/A; putative formula: C2H5N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.203,"smiles":null,"spectrum_id":"CCMSLIB00017298430","spectrum_index":41624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GALACTOSAMINE (delta mass: 23.0041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.091,"smiles":null,"spectrum_id":"CCMSLIB00017298432","spectrum_index":41625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 563.2379 Da; putative annotation: N/A; putative formula: C39H34NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.314,"smiles":null,"spectrum_id":"CCMSLIB00017298435","spectrum_index":41626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 179.0893 Da; putative annotation: N/A; putative formula: C9H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.16,"smiles":null,"spectrum_id":"CCMSLIB00017298438","spectrum_index":41627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 164.553 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.58,"smiles":null,"spectrum_id":"CCMSLIB00017298441","spectrum_index":41628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 151.0638 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.161,"smiles":null,"spectrum_id":"CCMSLIB00017298442","spectrum_index":41629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 179.0667 Da; putative annotation: N/A; putative formula: C4H5N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.142,"smiles":null,"spectrum_id":"CCMSLIB00017298445","spectrum_index":41630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 151.0844 Da; putative annotation: N/A; putative formula: H10N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.149,"smiles":null,"spectrum_id":"CCMSLIB00017298448","spectrum_index":41631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-, (3Z)- (delta mass: 30.0097 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.102,"smiles":null,"spectrum_id":"CCMSLIB00017298451","spectrum_index":41632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 219.0929 Da; putative annotation: N/A; putative formula: C9H17NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.153,"smiles":null,"spectrum_id":"CCMSLIB00017298453","spectrum_index":41633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ozagrel (delta mass: 66.0047 Da; putative annotation: N/A; putative formula: C4H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.102,"smiles":null,"spectrum_id":"CCMSLIB00017298455","spectrum_index":41634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 76.0674 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017298458","spectrum_index":41635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 72.0572 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.133,"smiles":null,"spectrum_id":"CCMSLIB00017298461","spectrum_index":41636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 69.0464 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017298463","spectrum_index":41637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 53.975 Da; putative annotation: N/A; putative formula: C2H-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.036,"smiles":null,"spectrum_id":"CCMSLIB00017298466","spectrum_index":41638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-tert-Butyl-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.175,"smiles":null,"spectrum_id":"CCMSLIB00017298469","spectrum_index":41639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 319.1241 Da; putative annotation: N/A; putative formula: C9H17N7O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.184,"smiles":null,"spectrum_id":"CCMSLIB00017298472","spectrum_index":41640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 27.9946 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.113,"smiles":null,"spectrum_id":"CCMSLIB00017298475","spectrum_index":41641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 409.1547 Da; putative annotation: N/A; putative formula: C22H24N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.256,"smiles":null,"spectrum_id":"CCMSLIB00017298477","spectrum_index":41642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.066,"smiles":null,"spectrum_id":"CCMSLIB00017298479","spectrum_index":41643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 300.1288 Da; putative annotation: N/A; putative formula: C9H16N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.282,"smiles":null,"spectrum_id":"CCMSLIB00017298482","spectrum_index":41644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methoxytyramine (delta mass: 116.0586 Da; putative annotation: N/A; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.16,"smiles":null,"spectrum_id":"CCMSLIB00017298485","spectrum_index":41645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 382.1181 Da; putative annotation: N/A; putative formula: C18H23O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.204,"smiles":null,"spectrum_id":"CCMSLIB00017298488","spectrum_index":41646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 25.0048 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.122,"smiles":null,"spectrum_id":"CCMSLIB00017298490","spectrum_index":41647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 92.0468 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.112,"smiles":null,"spectrum_id":"CCMSLIB00017298492","spectrum_index":41648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CYTOSINE (delta mass: 143.0834 Da; putative annotation: N/A; putative formula: C9H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.134,"smiles":null,"spectrum_id":"CCMSLIB00017298495","spectrum_index":41649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 288.2605 Da; putative annotation: N/A; putative formula: C13H32N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.331,"smiles":null,"spectrum_id":"CCMSLIB00017298498","spectrum_index":41650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 210.1041 Da; putative annotation: N/A; putative formula: C15H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.169,"smiles":null,"spectrum_id":"CCMSLIB00017298499","spectrum_index":41651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 11.0005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.097,"smiles":null,"spectrum_id":"CCMSLIB00017298502","spectrum_index":41652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 395.1133 Da; putative annotation: N/A; putative formula: C14H21N9O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.23,"smiles":null,"spectrum_id":"CCMSLIB00017298505","spectrum_index":41653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 971.3311 Da; putative annotation: N/A; putative formula: C46H53N9O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1314.45,"smiles":null,"spectrum_id":"CCMSLIB00017298508","spectrum_index":41654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methylhydantoin (delta mass: 148.0296 Da; putative annotation: N/A; putative formula: C5H9O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.08,"smiles":null,"spectrum_id":"CCMSLIB00017298510","spectrum_index":41655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 62.0548 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.121,"smiles":null,"spectrum_id":"CCMSLIB00017298512","spectrum_index":41656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 284.316 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.378,"smiles":null,"spectrum_id":"CCMSLIB00017298515","spectrum_index":41657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 262.0328 Da; putative annotation: N/A; putative formula: C12H11N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.13,"smiles":null,"spectrum_id":"CCMSLIB00017298518","spectrum_index":41658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 296.2138 Da; putative annotation: N/A; putative formula: C21H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.295,"smiles":null,"spectrum_id":"CCMSLIB00017298520","spectrum_index":41659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4,5-Trimethoxyphenyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol (delta mass: 98.0459 Da; putative annotation: N/A; putative formula: H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.195,"smiles":null,"spectrum_id":"CCMSLIB00017298523","spectrum_index":41660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 133.1067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.233,"smiles":null,"spectrum_id":"CCMSLIB00017298526","spectrum_index":41661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Aminobutyl)urea (delta mass: 174.5569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.67,"smiles":null,"spectrum_id":"CCMSLIB00017298528","spectrum_index":41662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 222.137 Da; putative annotation: N/A; putative formula: C12H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.208,"smiles":null,"spectrum_id":"CCMSLIB00017298531","spectrum_index":41663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 241.0652 Da; putative annotation: N/A; putative formula: C6H16N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.13,"smiles":null,"spectrum_id":"CCMSLIB00017298534","spectrum_index":41664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 95.0138 Da; putative annotation: N/A; putative formula: C3HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.111,"smiles":null,"spectrum_id":"CCMSLIB00017298535","spectrum_index":41665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 89.0831 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.154,"smiles":null,"spectrum_id":"CCMSLIB00017298538","spectrum_index":41666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00332267-02!N-(2-phenylethyl)acetamide (delta mass: 124.0521 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.159,"smiles":null,"spectrum_id":"CCMSLIB00017298541","spectrum_index":41667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 81.9855 Da; putative annotation: N/A; putative formula: C4H2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.051,"smiles":null,"spectrum_id":"CCMSLIB00017298544","spectrum_index":41668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 13.0504 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.142,"smiles":null,"spectrum_id":"CCMSLIB00017298545","spectrum_index":41669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 50.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.196,"smiles":null,"spectrum_id":"CCMSLIB00017298548","spectrum_index":41670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 451.197 Da; putative annotation: N/A; putative formula: C30H29NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.294,"smiles":null,"spectrum_id":"CCMSLIB00017298551","spectrum_index":41671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 354.1678 Da; putative annotation: N/A; putative formula: C18H26O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.254,"smiles":null,"spectrum_id":"CCMSLIB00017298554","spectrum_index":41672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitan stearate (delta mass: 92.9842 Da; putative annotation: N/A; putative formula: C4H-1NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.321,"smiles":null,"spectrum_id":"CCMSLIB00017298555","spectrum_index":41673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 41.0728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.165,"smiles":null,"spectrum_id":"CCMSLIB00017298558","spectrum_index":41674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301852 Norharman (delta mass: 52.0021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.078,"smiles":null,"spectrum_id":"CCMSLIB00017298561","spectrum_index":41675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 40.0464 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.106,"smiles":null,"spectrum_id":"CCMSLIB00017298564","spectrum_index":41676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 161.1055 Da; putative annotation: N/A; putative formula: C7H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.222,"smiles":null,"spectrum_id":"CCMSLIB00017298567","spectrum_index":41677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 99.9797 Da; putative annotation: N/A; putative formula: C3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.149,"smiles":null,"spectrum_id":"CCMSLIB00017298568","spectrum_index":41678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytosine (delta mass: 89.0654 Da; putative annotation: N/A; putative formula: C7H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.116,"smiles":null,"spectrum_id":"CCMSLIB00017298571","spectrum_index":41679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 358.118 Da; putative annotation: N/A; putative formula: C12H22N8O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.204,"smiles":null,"spectrum_id":"CCMSLIB00017298574","spectrum_index":41680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 198.113 Da; putative annotation: N/A; putative formula: C8H14N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.178,"smiles":null,"spectrum_id":"CCMSLIB00017298577","spectrum_index":41681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one (delta mass: 2.948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.044,"smiles":null,"spectrum_id":"CCMSLIB00017298578","spectrum_index":41682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 124.0888 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.186,"smiles":null,"spectrum_id":"CCMSLIB00017298581","spectrum_index":41683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 485.1052 Da; putative annotation: N/A; putative formula: C19H19N9O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.229,"smiles":null,"spectrum_id":"CCMSLIB00017298584","spectrum_index":41684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 53.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.144,"smiles":null,"spectrum_id":"CCMSLIB00017298587","spectrum_index":41685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 220.1696 Da; putative annotation: N/A; putative formula: C12H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.293,"smiles":null,"spectrum_id":"CCMSLIB00017298588","spectrum_index":41686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 367.2161 Da; putative annotation: N/A; putative formula: C24H25N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.34,"smiles":null,"spectrum_id":"CCMSLIB00017298591","spectrum_index":41687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 146.0583 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.26,"smiles":null,"spectrum_id":"CCMSLIB00017298594","spectrum_index":41688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 112.0713 Da; putative annotation: N/A; putative formula: C7H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.158,"smiles":null,"spectrum_id":"CCMSLIB00017298596","spectrum_index":41689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 24.0002 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.086,"smiles":null,"spectrum_id":"CCMSLIB00017298598","spectrum_index":41690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 79.9836 Da; putative annotation: N/A; putative formula: C3N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.989,"smiles":null,"spectrum_id":"CCMSLIB00017298601","spectrum_index":41691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.107,"smiles":null,"spectrum_id":"CCMSLIB00017298604","spectrum_index":41692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 203.1528 Da; putative annotation: N/A; putative formula: C11H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.224,"smiles":null,"spectrum_id":"CCMSLIB00017298605","spectrum_index":41693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PAR_146.0966_8.3 (delta mass: 146.8141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.91,"smiles":null,"spectrum_id":"CCMSLIB00017298608","spectrum_index":41694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 40.0288 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.178,"smiles":null,"spectrum_id":"CCMSLIB00017298611","spectrum_index":41695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 82.1502 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.21,"smiles":null,"spectrum_id":"CCMSLIB00017298613","spectrum_index":41696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380224-01!1,7-bis(3,4-dihydroxyphenyl)-6-methoxyheptan-3-one (delta mass: 112.0309 Da; putative annotation: N/A; putative formula: C9H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.195,"smiles":null,"spectrum_id":"CCMSLIB00017298616","spectrum_index":41697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 312.0632 Da; putative annotation: N/A; putative formula: C17H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.113,"smiles":null,"spectrum_id":"CCMSLIB00017298619","spectrum_index":41698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 147.035 Da; putative annotation: N/A; putative formula: C7H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.095,"smiles":null,"spectrum_id":"CCMSLIB00017298622","spectrum_index":41699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 67.9294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.099,"smiles":null,"spectrum_id":"CCMSLIB00017298623","spectrum_index":41700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 78.0786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.265,"smiles":null,"spectrum_id":"CCMSLIB00017298626","spectrum_index":41701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 64.0157 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.243,"smiles":null,"spectrum_id":"CCMSLIB00017298629","spectrum_index":41702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of n-methyl-2,4-dihydroxy-3-phenylquinoline (delta mass: 41.0228 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.125,"smiles":null,"spectrum_id":"CCMSLIB00017298630","spectrum_index":41703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 516.1983 Da; putative annotation: N/A; putative formula: C32H28N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.327,"smiles":null,"spectrum_id":"CCMSLIB00017298633","spectrum_index":41704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 97.9776 Da; putative annotation: N/A; putative formula: CH-1N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.027,"smiles":null,"spectrum_id":"CCMSLIB00017298636","spectrum_index":41705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 332.2363 Da; putative annotation: N/A; putative formula: C22H28N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":837.413,"smiles":null,"spectrum_id":"CCMSLIB00017298639","spectrum_index":41706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 61.9837 Da; putative annotation: N/A; putative formula: CH4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.07,"smiles":null,"spectrum_id":"CCMSLIB00017298640","spectrum_index":41707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethirimol (delta mass: 43.0803 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.24,"smiles":null,"spectrum_id":"CCMSLIB00017298643","spectrum_index":41708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 196.0891 Da; putative annotation: N/A; putative formula: C14H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.155,"smiles":null,"spectrum_id":"CCMSLIB00017298646","spectrum_index":41709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 129.0599 Da; putative annotation: N/A; putative formula: C6H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.163,"smiles":null,"spectrum_id":"CCMSLIB00017298649","spectrum_index":41710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 662.423 Da; putative annotation: N/A; putative formula: C39H58N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":789.462,"smiles":null,"spectrum_id":"CCMSLIB00017298650","spectrum_index":41711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 264.1044 Da; putative annotation: N/A; putative formula: C11H22O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.238,"smiles":null,"spectrum_id":"CCMSLIB00017298653","spectrum_index":41712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 73.845 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.905,"smiles":null,"spectrum_id":"CCMSLIB00017298656","spectrum_index":41713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 94.0058 Da; putative annotation: N/A; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.155,"smiles":null,"spectrum_id":"CCMSLIB00017298658","spectrum_index":41714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Benzyloxy)-1H-indol-3-yl]acetonitrile (delta mass: 125.4031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.521,"smiles":null,"spectrum_id":"CCMSLIB00017298660","spectrum_index":41715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2-hydroxy-4,6-dimethoxyphenyl)-2-methoxyethan-1-one CollisionEnergy:102040\"\" (delta mass: 440.1846 Da; putative annotation: N/A; putative formula: C26H32O2S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.276,"smiles":null,"spectrum_id":"CCMSLIB00017298663","spectrum_index":41716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 46.0609 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.132,"smiles":null,"spectrum_id":"CCMSLIB00017298666","spectrum_index":41717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 124.2189 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.3,"smiles":null,"spectrum_id":"CCMSLIB00017298667","spectrum_index":41718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 98.0738 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.181,"smiles":null,"spectrum_id":"CCMSLIB00017298670","spectrum_index":41719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylhistamine (delta mass: 142.0752 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.173,"smiles":null,"spectrum_id":"CCMSLIB00017298673","spectrum_index":41720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.315,"smiles":null,"spectrum_id":"CCMSLIB00017298674","spectrum_index":41721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 41.0223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.13,"smiles":null,"spectrum_id":"CCMSLIB00017298677","spectrum_index":41722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 255.1401 Da; putative annotation: N/A; putative formula: C12H21N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.237,"smiles":null,"spectrum_id":"CCMSLIB00017298680","spectrum_index":41723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 343.2152 Da; putative annotation: N/A; putative formula: C14H29N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.306,"smiles":null,"spectrum_id":"CCMSLIB00017298683","spectrum_index":41724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 118.0275 Da; putative annotation: N/A; putative formula: C5H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.114,"smiles":null,"spectrum_id":"CCMSLIB00017298685","spectrum_index":41725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 67.0422 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017298687","spectrum_index":41726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 27.8917 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.994,"smiles":null,"spectrum_id":"CCMSLIB00017298690","spectrum_index":41727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 262.985 Da; putative annotation: N/A; putative formula: C6H5N3O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.056,"smiles":null,"spectrum_id":"CCMSLIB00017298693","spectrum_index":41728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine methyl ester (delta mass: 126.1028 Da; putative annotation: N/A; putative formula: C4H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.177,"smiles":null,"spectrum_id":"CCMSLIB00017298695","spectrum_index":41729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 162.0541 Da; putative annotation: N/A; putative formula: C7H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.161,"smiles":null,"spectrum_id":"CCMSLIB00017298698","spectrum_index":41730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 41.0275 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.145,"smiles":null,"spectrum_id":"CCMSLIB00017298701","spectrum_index":41731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 41.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.185,"smiles":null,"spectrum_id":"CCMSLIB00017298703","spectrum_index":41732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palythazine (delta mass: 154.0518 Da; putative annotation: N/A; putative formula: C4H7N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017298706","spectrum_index":41733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 17.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.149,"smiles":null,"spectrum_id":"CCMSLIB00017298709","spectrum_index":41734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Glucosyliriflophenone (delta mass: 45.0562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.169,"smiles":null,"spectrum_id":"CCMSLIB00017298712","spectrum_index":41735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1054.5357 Da; putative annotation: N/A; putative formula: C67H70N6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1247.61,"smiles":null,"spectrum_id":"CCMSLIB00017298714","spectrum_index":41736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 150.0898 Da; putative annotation: N/A; putative formula: C7H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.197,"smiles":null,"spectrum_id":"CCMSLIB00017298717","spectrum_index":41737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 396.2688 Da; putative annotation: N/A; putative formula: C19H38N6O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.407,"smiles":null,"spectrum_id":"CCMSLIB00017298720","spectrum_index":41738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 116.0105 Da; putative annotation: N/A; putative formula: C4H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.07,"smiles":null,"spectrum_id":"CCMSLIB00017298723","spectrum_index":41739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luminol (delta mass: 49.0299 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017298725","spectrum_index":41740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lofemizole (delta mass: 129.0372 Da; putative annotation: N/A; putative formula: C4H7N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.09,"smiles":null,"spectrum_id":"CCMSLIB00017298728","spectrum_index":41741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 488.6637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.724,"smiles":null,"spectrum_id":"CCMSLIB00017298731","spectrum_index":41742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 38.1096 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.206,"smiles":null,"spectrum_id":"CCMSLIB00017298733","spectrum_index":41743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 155.0948 Da; putative annotation: N/A; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.181,"smiles":null,"spectrum_id":"CCMSLIB00017298736","spectrum_index":41744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BIOTIN (delta mass: 410.1807 Da; putative annotation: N/A; putative formula: C21H27N6O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.276,"smiles":null,"spectrum_id":"CCMSLIB00017298738","spectrum_index":41745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-alpha-methylhistamine (delta mass: 70.0532 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.156,"smiles":null,"spectrum_id":"CCMSLIB00017298741","spectrum_index":41746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 186.0588 Da; putative annotation: N/A; putative formula: C8H11ClN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.14,"smiles":null,"spectrum_id":"CCMSLIB00017298744","spectrum_index":41747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1,1':4',1''-Terphenyl]-3,4'',5-triol (delta mass: 134.0704 Da; putative annotation: N/A; putative formula: C5H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.172,"smiles":null,"spectrum_id":"CCMSLIB00017298747","spectrum_index":41748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 189.0789 Da; putative annotation: N/A; putative formula: C11H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017298750","spectrum_index":41749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TEGASEROD MALEATE (delta mass: 29.0265 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.224,"smiles":null,"spectrum_id":"CCMSLIB00017298752","spectrum_index":41750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 122.0732 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.191,"smiles":null,"spectrum_id":"CCMSLIB00017298755","spectrum_index":41751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 137.0685 Da; putative annotation: N/A; putative formula: C5H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.186,"smiles":null,"spectrum_id":"CCMSLIB00017298758","spectrum_index":41752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 104.0243 Da; putative annotation: N/A; putative formula: C3N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.173,"smiles":null,"spectrum_id":"CCMSLIB00017298761","spectrum_index":41753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1-Methyl-1H-imidazol-2-yl)(2-thienyl)methanol (delta mass: 174.0701 Da; putative annotation: N/A; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.129,"smiles":null,"spectrum_id":"CCMSLIB00017298764","spectrum_index":41754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-BUTYRIC ACID (delta mass: 33.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.128,"smiles":null,"spectrum_id":"CCMSLIB00017298766","spectrum_index":41755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of biotin CollisionEnergy:205060 (delta mass: 230.231 Da; putative annotation: N/A; putative formula: C9H26N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.326,"smiles":null,"spectrum_id":"CCMSLIB00017298769","spectrum_index":41756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-acetyl-4-hydroxy-1-(2-imidazol-4-ylethyl)-2-(3-methoxyphenyl)-5-oxo-3-pyrrol ine CollisionEnergy:102040 (delta mass: 78.0288 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.174,"smiles":null,"spectrum_id":"CCMSLIB00017298772","spectrum_index":41757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 47.0461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.113,"smiles":null,"spectrum_id":"CCMSLIB00017298774","spectrum_index":41758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 154.1201 Da; putative annotation: N/A; putative formula: C7H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.291,"smiles":null,"spectrum_id":"CCMSLIB00017298777","spectrum_index":41759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 136.087 Da; putative annotation: N/A; putative formula: C5H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.262,"smiles":null,"spectrum_id":"CCMSLIB00017298780","spectrum_index":41760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 65.0629 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.134,"smiles":null,"spectrum_id":"CCMSLIB00017298782","spectrum_index":41761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 107.0667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.121,"smiles":null,"spectrum_id":"CCMSLIB00017298784","spectrum_index":41762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 113.0902 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.224,"smiles":null,"spectrum_id":"CCMSLIB00017298787","spectrum_index":41763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 257.0437 Da; putative annotation: N/A; putative formula: C12H7N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.091,"smiles":null,"spectrum_id":"CCMSLIB00017298790","spectrum_index":41764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 45.0096 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017298793","spectrum_index":41765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 74.0725 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.154,"smiles":null,"spectrum_id":"CCMSLIB00017298794","spectrum_index":41766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3R)-2-(((S)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(5-chloropyridin-2-yl)-3-methylpentanamide (delta mass: 17.0171 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.265,"smiles":null,"spectrum_id":"CCMSLIB00017298797","spectrum_index":41767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 342.1156 Da; putative annotation: N/A; putative formula: C25H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.219,"smiles":null,"spectrum_id":"CCMSLIB00017298800","spectrum_index":41768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 16.0617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.142,"smiles":null,"spectrum_id":"CCMSLIB00017298803","spectrum_index":41769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 274.1225 Da; putative annotation: N/A; putative formula: C17H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.19,"smiles":null,"spectrum_id":"CCMSLIB00017298805","spectrum_index":41770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 272.1041 Da; putative annotation: N/A; putative formula: C10H17N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.172,"smiles":null,"spectrum_id":"CCMSLIB00017298808","spectrum_index":41771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 123.0317 Da; putative annotation: N/A; putative formula: C6H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.134,"smiles":null,"spectrum_id":"CCMSLIB00017298811","spectrum_index":41772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.18,"smiles":null,"spectrum_id":"CCMSLIB00017298814","spectrum_index":41773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 36.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017298816","spectrum_index":41774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(4-Methoxyphenyl)ethyl]-3-methyl-2-butenamide (delta mass: 94.0421 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.191,"smiles":null,"spectrum_id":"CCMSLIB00017298818","spectrum_index":41775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 352.3475 Da; putative annotation: N/A; putative formula: C27H44O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.46,"smiles":null,"spectrum_id":"CCMSLIB00017298821","spectrum_index":41776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 48.0362 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.195,"smiles":null,"spectrum_id":"CCMSLIB00017298824","spectrum_index":41777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hexanoic acid, 5-(acetylamino)-4-oxo- (delta mass: 99.068 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.16,"smiles":null,"spectrum_id":"CCMSLIB00017298827","spectrum_index":41778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 170.1057 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.255,"smiles":null,"spectrum_id":"CCMSLIB00017298828","spectrum_index":41779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 358.0715 Da; putative annotation: N/A; putative formula: C20H14N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.158,"smiles":null,"spectrum_id":"CCMSLIB00017298831","spectrum_index":41780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_prop_2_en_1_yl__1H_indole_3_carboxylic_acid (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017298834","spectrum_index":41781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DETHIOBIOTIN (delta mass: 79.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.207,"smiles":null,"spectrum_id":"CCMSLIB00017298837","spectrum_index":41782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phloroglucinocarboxaldehyde (delta mass: 231.1318 Da; putative annotation: N/A; putative formula: C10H22N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.166,"smiles":null,"spectrum_id":"CCMSLIB00017298838","spectrum_index":41783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 336.3477 Da; putative annotation: N/A; putative formula: C22H44N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":929.623,"smiles":null,"spectrum_id":"CCMSLIB00017298841","spectrum_index":41784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 296.2338 Da; putative annotation: 2-Oxiraneoctanoic acid, .eta.-hydroxy-3-octyl-; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.275,"smiles":null,"spectrum_id":"CCMSLIB00017298844","spectrum_index":41785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 306.1027 Da; putative annotation: (8-ethoxy-2-oxochromen-3-yl)-N-(2-pyridylmethyl)carboxamide CollisionEnergy:102040; putative formula: C18H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.214,"smiles":null,"spectrum_id":"CCMSLIB00017298847","spectrum_index":41786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 111.0315 Da; putative annotation: 3-Amino-1,1,1-trifluoro-2-propanol; putative formula: C3H4F3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.113,"smiles":null,"spectrum_id":"CCMSLIB00017298850","spectrum_index":41787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 288.2088 Da; putative annotation: h_61_17_epioxandrolone; putative formula: C19H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.28,"smiles":null,"spectrum_id":"CCMSLIB00017298851","spectrum_index":41788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2,2,6,6-tetramethyl-4-[3-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]butyl]cyclohex-4-ene-1,3-dione (delta mass: 218.1338 Da; putative annotation: 3-(2-Methyl-3-oxo-2,5,6,7,8,8a-hexahydro-1H-naphthalen-1-yl)propanoic acid; putative formula: C14H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.372,"smiles":null,"spectrum_id":"CCMSLIB00017298854","spectrum_index":41789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,5-Benzenetriol (delta mass: 154.0626 Da; putative annotation: 5-Hydroxy-4-methoxy-5-propan-2-ylfuran-2-one; putative formula: C8H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017298857","spectrum_index":41790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-.beta.-alanine (delta mass: 14.0157 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.081,"smiles":null,"spectrum_id":"CCMSLIB00017298860","spectrum_index":41791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 18.0551 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.181,"smiles":null,"spectrum_id":"CCMSLIB00017298861","spectrum_index":41792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 118.0992 Da; putative annotation: N/A; putative formula: C2H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017298864","spectrum_index":41793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 133.0333 Da; putative annotation: N/A; putative formula: C3H9N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.187,"smiles":null,"spectrum_id":"CCMSLIB00017298867","spectrum_index":41794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 50.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017298870","spectrum_index":41795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 26.0174 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.109,"smiles":null,"spectrum_id":"CCMSLIB00017298873","spectrum_index":41796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methylfuran-2(5H)-one (delta mass: 32.0646 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.167,"smiles":null,"spectrum_id":"CCMSLIB00017298875","spectrum_index":41797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 68.0627 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.128,"smiles":null,"spectrum_id":"CCMSLIB00017298877","spectrum_index":41798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 161.1092 Da; putative annotation: N/A; putative formula: C5H15N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.19,"smiles":null,"spectrum_id":"CCMSLIB00017298880","spectrum_index":41799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 95.0694 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.161,"smiles":null,"spectrum_id":"CCMSLIB00017298883","spectrum_index":41800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 145.0128 Da; putative annotation: N/A; putative formula: C4H7N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.056,"smiles":null,"spectrum_id":"CCMSLIB00017298886","spectrum_index":41801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 475.3073 Da; putative annotation: N/A; putative formula: C25H50NOPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.409,"smiles":null,"spectrum_id":"CCMSLIB00017298888","spectrum_index":41802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 275.2102 Da; putative annotation: N/A; putative formula: C14H29NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.281,"smiles":null,"spectrum_id":"CCMSLIB00017298891","spectrum_index":41803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 688.3458 Da; putative annotation: N/A; putative formula: C37H52O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.432,"smiles":null,"spectrum_id":"CCMSLIB00017298894","spectrum_index":41804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 823.4343 Da; putative annotation: N/A; putative formula: C47H61N5O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1016.51,"smiles":null,"spectrum_id":"CCMSLIB00017298896","spectrum_index":41805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 784.3337 Da; putative annotation: N/A; putative formula: C51H48N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":991.42,"smiles":null,"spectrum_id":"CCMSLIB00017298898","spectrum_index":41806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 104.062 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.289,"smiles":null,"spectrum_id":"CCMSLIB00017298901","spectrum_index":41807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 200.1405 Da; putative annotation: N/A; putative formula: C11H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.284,"smiles":null,"spectrum_id":"CCMSLIB00017298904","spectrum_index":41808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1190.7711 Da; putative annotation: N/A; putative formula: C68H102N8O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1412.87,"smiles":null,"spectrum_id":"CCMSLIB00017298907","spectrum_index":41809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 141.0787 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.207,"smiles":null,"spectrum_id":"CCMSLIB00017298909","spectrum_index":41810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 426.2582 Da; putative annotation: N/A; putative formula: C18H38N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.349,"smiles":null,"spectrum_id":"CCMSLIB00017298912","spectrum_index":41811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 24.9981 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017298915","spectrum_index":41812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:102040\"\" (delta mass: 168.0883 Da; putative annotation: N/A; putative formula: C8H12N2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.148,"smiles":null,"spectrum_id":"CCMSLIB00017298917","spectrum_index":41813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 265.1528 Da; putative annotation: N/A; putative formula: C11H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.207,"smiles":null,"spectrum_id":"CCMSLIB00017298920","spectrum_index":41814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dimethyl-1H-benzimidazole-2-thiol (delta mass: 103.0266 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.09,"smiles":null,"spectrum_id":"CCMSLIB00017298923","spectrum_index":41815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 352.246 Da; putative annotation: N/A; putative formula: C20H37N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.312,"smiles":null,"spectrum_id":"CCMSLIB00017298926","spectrum_index":41816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 286.2724 Da; putative annotation: N/A; putative formula: C15H34N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.332,"smiles":null,"spectrum_id":"CCMSLIB00017298928","spectrum_index":41817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyanoamino-4,6-dihydroxypyrimidine (delta mass: 117.0923 Da; putative annotation: N/A; putative formula: C9H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.133,"smiles":null,"spectrum_id":"CCMSLIB00017298930","spectrum_index":41818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 213.1091 Da; putative annotation: N/A; putative formula: C5H11N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.171,"smiles":null,"spectrum_id":"CCMSLIB00017298933","spectrum_index":41819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 115.0442 Da; putative annotation: N/A; putative formula: C5H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.084,"smiles":null,"spectrum_id":"CCMSLIB00017298936","spectrum_index":41820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 78.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.16,"smiles":null,"spectrum_id":"CCMSLIB00017298939","spectrum_index":41821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 232.0946 Da; putative annotation: N/A; putative formula: C10H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.243,"smiles":null,"spectrum_id":"CCMSLIB00017298942","spectrum_index":41822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 98.0834 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.155,"smiles":null,"spectrum_id":"CCMSLIB00017298943","spectrum_index":41823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 11.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.118,"smiles":null,"spectrum_id":"CCMSLIB00017298946","spectrum_index":41824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 88.0379 Da; putative annotation: N/A; putative formula: CH4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.129,"smiles":null,"spectrum_id":"CCMSLIB00017298949","spectrum_index":41825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cephradine (delta mass: 46.0497 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.167,"smiles":null,"spectrum_id":"CCMSLIB00017298952","spectrum_index":41826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 385.1221 Da; putative annotation: N/A; putative formula: C19H15N9O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.192,"smiles":null,"spectrum_id":"CCMSLIB00017298953","spectrum_index":41827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 315.2407 Da; putative annotation: N/A; putative formula: C17H33NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.364,"smiles":null,"spectrum_id":"CCMSLIB00017298956","spectrum_index":41828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM815506 Pyrrol (delta mass: 43.973 Da; putative annotation: N/A; putative formula: CS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":112.022,"smiles":null,"spectrum_id":"CCMSLIB00017298959","spectrum_index":41829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Glu from NIST14 (delta mass: 129.0422 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.187,"smiles":null,"spectrum_id":"CCMSLIB00017298962","spectrum_index":41830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 308.0681 Da; putative annotation: N/A; putative formula: C13H17N4O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.154,"smiles":null,"spectrum_id":"CCMSLIB00017298964","spectrum_index":41831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 182.1308 Da; putative annotation: N/A; putative formula: C11H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.211,"smiles":null,"spectrum_id":"CCMSLIB00017298967","spectrum_index":41832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 168.0897 Da; putative annotation: N/A; putative formula: C8H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.176,"smiles":null,"spectrum_id":"CCMSLIB00017298970","spectrum_index":41833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301020 Aristolochic acid B (delta mass: 27.988 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.038,"smiles":null,"spectrum_id":"CCMSLIB00017298973","spectrum_index":41834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 464.1157 Da; putative annotation: N/A; putative formula: C16H28N6O2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.186,"smiles":null,"spectrum_id":"CCMSLIB00017298975","spectrum_index":41835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00017 Biotin (delta mass: 307.1371 Da; putative annotation: N/A; putative formula: C13H26NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.232,"smiles":null,"spectrum_id":"CCMSLIB00017298978","spectrum_index":41836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 273.1066 Da; putative annotation: N/A; putative formula: C11H20N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.193,"smiles":null,"spectrum_id":"CCMSLIB00017298981","spectrum_index":41837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 327.1893 Da; putative annotation: N/A; putative formula: C18H25N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.244,"smiles":null,"spectrum_id":"CCMSLIB00017298983","spectrum_index":41838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 198.0228 Da; putative annotation: N/A; putative formula: C4H11N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.073,"smiles":null,"spectrum_id":"CCMSLIB00017298986","spectrum_index":41839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 193.5287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.631,"smiles":null,"spectrum_id":"CCMSLIB00017298989","spectrum_index":41840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 132.0145 Da; putative annotation: N/A; putative formula: C7H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.111,"smiles":null,"spectrum_id":"CCMSLIB00017298992","spectrum_index":41841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 87.0295 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.095,"smiles":null,"spectrum_id":"CCMSLIB00017298994","spectrum_index":41842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 53.9292 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.016,"smiles":null,"spectrum_id":"CCMSLIB00017298997","spectrum_index":41843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 96.0424 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017299000","spectrum_index":41844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,5-DIMETHOXYPHENOL\"\" (delta mass: 360.1217 Da; putative annotation: N/A; putative formula: C20H24O2S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.192,"smiles":null,"spectrum_id":"CCMSLIB00017299003","spectrum_index":41845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 55.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.171,"smiles":null,"spectrum_id":"CCMSLIB00017299005","spectrum_index":41846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 328.1734 Da; putative annotation: N/A; putative formula: C24H25O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.26,"smiles":null,"spectrum_id":"CCMSLIB00017299008","spectrum_index":41847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 66.0477 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.316,"smiles":null,"spectrum_id":"CCMSLIB00017299011","spectrum_index":41848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyrosine methyl ester (delta mass: 87.0321 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.129,"smiles":null,"spectrum_id":"CCMSLIB00017299013","spectrum_index":41849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-2-piperidin-4-ylacetamide (delta mass: 42.0004 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.134,"smiles":null,"spectrum_id":"CCMSLIB00017299016","spectrum_index":41850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Cyclopropylmethyl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide (delta mass: 114.0733 Da; putative annotation: N/A; putative formula: C5H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.26,"smiles":null,"spectrum_id":"CCMSLIB00017299019","spectrum_index":41851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYLTYRAMINE (delta mass: 428.3663 Da; putative annotation: N/A; putative formula: C29H48O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.473,"smiles":null,"spectrum_id":"CCMSLIB00017299021","spectrum_index":41852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 85.0999 Da; putative annotation: N/A; putative formula: C4H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.167,"smiles":null,"spectrum_id":"CCMSLIB00017299024","spectrum_index":41853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 182.1289 Da; putative annotation: N/A; putative formula: C7H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.21,"smiles":null,"spectrum_id":"CCMSLIB00017299027","spectrum_index":41854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 124.9981 Da; putative annotation: N/A; putative formula: C2H-1N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.095,"smiles":null,"spectrum_id":"CCMSLIB00017299029","spectrum_index":41855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ergothioneine; AIF; CE10; CorrDec (delta mass: 137.8961 Da; putative annotation: N/A; putative formula: CH-1O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.992,"smiles":null,"spectrum_id":"CCMSLIB00017299032","spectrum_index":41856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.17,"smiles":null,"spectrum_id":"CCMSLIB00017299034","spectrum_index":41857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 149.068 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017299037","spectrum_index":41858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 186.0923 Da; putative annotation: N/A; putative formula: C8H15N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.267,"smiles":null,"spectrum_id":"CCMSLIB00017299040","spectrum_index":41859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (delta mass: 18.0081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.097,"smiles":null,"spectrum_id":"CCMSLIB00017299042","spectrum_index":41860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 167.1148 Da; putative annotation: N/A; putative formula: C10H17NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.196,"smiles":null,"spectrum_id":"CCMSLIB00017299045","spectrum_index":41861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Aminobutyl)urea (delta mass: 231.0669 Da; putative annotation: N/A; putative formula: C10H18NO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017299047","spectrum_index":41862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (delta mass: 332.199 Da; putative annotation: N/A; putative formula: C20H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.303,"smiles":null,"spectrum_id":"CCMSLIB00017299050","spectrum_index":41863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 86.0364 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.133,"smiles":null,"spectrum_id":"CCMSLIB00017299053","spectrum_index":41864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 66.0464 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.32,"smiles":null,"spectrum_id":"CCMSLIB00017299055","spectrum_index":41865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 475.1958 Da; putative annotation: N/A; putative formula: C26H30N5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.293,"smiles":null,"spectrum_id":"CCMSLIB00017299058","spectrum_index":41866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 287.149 Da; putative annotation: N/A; putative formula: C13H25N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.246,"smiles":null,"spectrum_id":"CCMSLIB00017299061","spectrum_index":41867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrocidine B (delta mass: 66.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.348,"smiles":null,"spectrum_id":"CCMSLIB00017299063","spectrum_index":41868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 217.1314 Da; putative annotation: N/A; putative formula: C10H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.186,"smiles":null,"spectrum_id":"CCMSLIB00017299065","spectrum_index":41869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 14.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.227,"smiles":null,"spectrum_id":"CCMSLIB00017299068","spectrum_index":41870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 181.1423 Da; putative annotation: N/A; putative formula: C7H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.218,"smiles":null,"spectrum_id":"CCMSLIB00017299071","spectrum_index":41871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304055 p-Coumaraldehyde (delta mass: 43.9899 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.05,"smiles":null,"spectrum_id":"CCMSLIB00017299074","spectrum_index":41872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 56.0722 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.134,"smiles":null,"spectrum_id":"CCMSLIB00017299075","spectrum_index":41873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-Gln (delta mass: 147.0695 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.209,"smiles":null,"spectrum_id":"CCMSLIB00017299078","spectrum_index":41874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 304.0193 Da; putative annotation: N/A; putative formula: C18H8O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.09,"smiles":null,"spectrum_id":"CCMSLIB00017299081","spectrum_index":41875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 578.3292 Da; putative annotation: N/A; putative formula: C33H46N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.452,"smiles":null,"spectrum_id":"CCMSLIB00017299084","spectrum_index":41876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 475.2423 Da; putative annotation: N/A; putative formula: C17H34N9O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.313,"smiles":null,"spectrum_id":"CCMSLIB00017299086","spectrum_index":41877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 451.2283 Da; putative annotation: N/A; putative formula: C17H33N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.299,"smiles":null,"spectrum_id":"CCMSLIB00017299088","spectrum_index":41878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 70.0048 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.127,"smiles":null,"spectrum_id":"CCMSLIB00017299091","spectrum_index":41879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-3,4,5-Trimethoxycinnamic acid - 40.0 eV (delta mass: 134.061 Da; putative annotation: N/A; putative formula: C4H11N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.152,"smiles":null,"spectrum_id":"CCMSLIB00017299094","spectrum_index":41880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 160.0731 Da; putative annotation: N/A; putative formula: C7H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.175,"smiles":null,"spectrum_id":"CCMSLIB00017299097","spectrum_index":41881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imidazo[1,2-a]pyridin-5-amine (delta mass: 9.0005 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.072,"smiles":null,"spectrum_id":"CCMSLIB00017299099","spectrum_index":41882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 70.0304 Da; putative annotation: N/A; putative formula: CH2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.111,"smiles":null,"spectrum_id":"CCMSLIB00017299101","spectrum_index":41883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 54.0251 Da; putative annotation: N/A; putative formula: C2H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.181,"smiles":null,"spectrum_id":"CCMSLIB00017299105","spectrum_index":41884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carboxylic acid (delta mass: 23.0071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.029,"smiles":null,"spectrum_id":"CCMSLIB00017299107","spectrum_index":41885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinine (delta mass: 68.0328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.224,"smiles":null,"spectrum_id":"CCMSLIB00017299110","spectrum_index":41886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 124.0671 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.132,"smiles":null,"spectrum_id":"CCMSLIB00017299113","spectrum_index":41887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 557.0812 Da; putative annotation: N/A; putative formula: C17H25N3O14P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.205,"smiles":null,"spectrum_id":"CCMSLIB00017299116","spectrum_index":41888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 170.0579 Da; putative annotation: N/A; putative formula: C8H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017299119","spectrum_index":41889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 31.0344 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.1,"smiles":null,"spectrum_id":"CCMSLIB00017299121","spectrum_index":41890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 326.344 Da; putative annotation: N/A; putative formula: C19H42N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.415,"smiles":null,"spectrum_id":"CCMSLIB00017299124","spectrum_index":41891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 321.1561 Da; putative annotation: N/A; putative formula: C14H15N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.206,"smiles":null,"spectrum_id":"CCMSLIB00017299127","spectrum_index":41892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 14.0501 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.157,"smiles":null,"spectrum_id":"CCMSLIB00017299130","spectrum_index":41893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 176.0322 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.129,"smiles":null,"spectrum_id":"CCMSLIB00017299132","spectrum_index":41894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 962.3881 Da; putative annotation: N/A; putative formula: C64H50N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1117.46,"smiles":null,"spectrum_id":"CCMSLIB00017299135","spectrum_index":41895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenylphenol (delta mass: 180.1145 Da; putative annotation: N/A; putative formula: C11H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.195,"smiles":null,"spectrum_id":"CCMSLIB00017299138","spectrum_index":41896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301340 Ethylbeta-carboline (delta mass: 56.0729 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.18,"smiles":null,"spectrum_id":"CCMSLIB00017299141","spectrum_index":41897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 453.1399 Da; putative annotation: N/A; putative formula: C28H23NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.231,"smiles":null,"spectrum_id":"CCMSLIB00017299144","spectrum_index":41898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 248.0796 Da; putative annotation: N/A; putative formula: C12H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.192,"smiles":null,"spectrum_id":"CCMSLIB00017299145","spectrum_index":41899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 823.435 Da; putative annotation: N/A; putative formula: C55H57N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.495,"smiles":null,"spectrum_id":"CCMSLIB00017299148","spectrum_index":41900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 164.0453 Da; putative annotation: N/A; putative formula: C5H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.148,"smiles":null,"spectrum_id":"CCMSLIB00017299151","spectrum_index":41901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 326.2219 Da; putative annotation: N/A; putative formula: C18H26N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.37,"smiles":null,"spectrum_id":"CCMSLIB00017299154","spectrum_index":41902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2H-Pyran-2-one, tetrahydro-4-hydroxy-6-pentyl- (delta mass: 222.0195 Da; putative annotation: N/A; putative formula: C9H7N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.152,"smiles":null,"spectrum_id":"CCMSLIB00017299157","spectrum_index":41903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 165.958 Da; putative annotation: N/A; putative formula: C4H6OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.06,"smiles":null,"spectrum_id":"CCMSLIB00017299159","spectrum_index":41904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-Fluorophenyl)-1H-pyrazol-5-ylamine (delta mass: 45.0558 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017299162","spectrum_index":41905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxycytidine\u00a05'-monophosphate (delta mass: 112.0138 Da; putative annotation: N/A; putative formula: CN6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.078,"smiles":null,"spectrum_id":"CCMSLIB00017299165","spectrum_index":41906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 128.0105 Da; putative annotation: N/A; putative formula: C5H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.096,"smiles":null,"spectrum_id":"CCMSLIB00017299168","spectrum_index":41907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isobutyrylphloroglucinol (delta mass: 212.0586 Da; putative annotation: N/A; putative formula: C12H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.139,"smiles":null,"spectrum_id":"CCMSLIB00017299171","spectrum_index":41908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 270.2551 Da; putative annotation: N/A; putative formula: C17H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.347,"smiles":null,"spectrum_id":"CCMSLIB00017299173","spectrum_index":41909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Biotin CollisionEnergy:102040 (delta mass: 422.1808 Da; putative annotation: N/A; putative formula: C12H26N10O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.276,"smiles":null,"spectrum_id":"CCMSLIB00017299176","spectrum_index":41910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-methoxy-1-(2,4,6-trihydroxyphenyl)ethan-1-one CollisionEnergy:205060\"\" (delta mass: 125.0839 Da; putative annotation: N/A; putative formula: C7H11NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.144,"smiles":null,"spectrum_id":"CCMSLIB00017299179","spectrum_index":41911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 774.4568 Da; putative annotation: N/A; putative formula: C44H62N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.491,"smiles":null,"spectrum_id":"CCMSLIB00017299181","spectrum_index":41912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-hydroxybenzo(a)pyrene (delta mass: 100.0984 Da; putative annotation: N/A; putative formula: C5H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.194,"smiles":null,"spectrum_id":"CCMSLIB00017299184","spectrum_index":41913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 301.1327 Da; putative annotation: N/A; putative formula: C18H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.26,"smiles":null,"spectrum_id":"CCMSLIB00017299187","spectrum_index":41914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 761.2622 Da; putative annotation: N/A; putative formula: C47H39NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1428.49,"smiles":null,"spectrum_id":"CCMSLIB00017299188","spectrum_index":41915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 251.1882 Da; putative annotation: N/A; putative formula: C15H25NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.337,"smiles":null,"spectrum_id":"CCMSLIB00017299191","spectrum_index":41916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 40.0 eV (delta mass: 103.0899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.176,"smiles":null,"spectrum_id":"CCMSLIB00017299194","spectrum_index":41917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 321.0406 Da; putative annotation: N/A; putative formula: C6H18N3O6P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.08,"smiles":null,"spectrum_id":"CCMSLIB00017299197","spectrum_index":41918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-hydroxyoctanoate (delta mass: 245.163 Da; putative annotation: N/A; putative formula: C12H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.311,"smiles":null,"spectrum_id":"CCMSLIB00017299200","spectrum_index":41919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Methyl-1H-imidazol-5-yl)acetic acid (delta mass: 85.1187 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.185,"smiles":null,"spectrum_id":"CCMSLIB00017299203","spectrum_index":41920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 95.0735 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.17,"smiles":null,"spectrum_id":"CCMSLIB00017299205","spectrum_index":41921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 23UXW8136A - 40.0 eV (delta mass: 521.3069 Da; putative annotation: N/A; putative formula: C23H39N9O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.377,"smiles":null,"spectrum_id":"CCMSLIB00017299208","spectrum_index":41922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 46.004 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.095,"smiles":null,"spectrum_id":"CCMSLIB00017299211","spectrum_index":41923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxyphenyl)-1H-indole-3-carbaldehyde (delta mass: 187.2614 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.363,"smiles":null,"spectrum_id":"CCMSLIB00017299214","spectrum_index":41924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 162.0514 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.101,"smiles":null,"spectrum_id":"CCMSLIB00017299216","spectrum_index":41925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1-Hydroxyethyl)oxolan-2-one (delta mass: 200.1201 Da; putative annotation: N/A; putative formula: C14H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017299219","spectrum_index":41926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 487.9627 Da; putative annotation: N/A; putative formula: C20H12N2O5S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.023,"smiles":null,"spectrum_id":"CCMSLIB00017299222","spectrum_index":41927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aloesin (delta mass: 18.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.145,"smiles":null,"spectrum_id":"CCMSLIB00017299225","spectrum_index":41928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 240.1472 Da; putative annotation: N/A; putative formula: C12H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.244,"smiles":null,"spectrum_id":"CCMSLIB00017299227","spectrum_index":41929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 26.0287 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.105,"smiles":null,"spectrum_id":"CCMSLIB00017299230","spectrum_index":41930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 181.0946 Da; putative annotation: N/A; putative formula: C3H7N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.16,"smiles":null,"spectrum_id":"CCMSLIB00017299233","spectrum_index":41931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 340.0011 Da; putative annotation: N/A; putative formula: C13H12N2O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.125,"smiles":null,"spectrum_id":"CCMSLIB00017299236","spectrum_index":41932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylxanthoxylin (delta mass: 36.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.117,"smiles":null,"spectrum_id":"CCMSLIB00017299239","spectrum_index":41933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 199.1992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.379,"smiles":null,"spectrum_id":"CCMSLIB00017299240","spectrum_index":41934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Arg-Ile from NIST14 (delta mass: 515.2914 Da; putative annotation: N/A; putative formula: C28H42N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.494,"smiles":null,"spectrum_id":"CCMSLIB00017299243","spectrum_index":41935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 645.2534 Da; putative annotation: N/A; putative formula: C31H39N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.34,"smiles":null,"spectrum_id":"CCMSLIB00017299246","spectrum_index":41936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 98.0366 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.096,"smiles":null,"spectrum_id":"CCMSLIB00017299248","spectrum_index":41937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 42.1631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.278,"smiles":null,"spectrum_id":"CCMSLIB00017299250","spectrum_index":41938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyethyl acrylate (delta mass: 637.368 Da; putative annotation: N/A; putative formula: C33H56N3O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.423,"smiles":null,"spectrum_id":"CCMSLIB00017299253","spectrum_index":41939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxfendazole (delta mass: 90.9835 Da; putative annotation: N/A; putative formula: HN3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.059,"smiles":null,"spectrum_id":"CCMSLIB00017299258","spectrum_index":41940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mitraphylline (delta mass: 388.1363 Da; putative annotation: N/A; putative formula: C30H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.317,"smiles":null,"spectrum_id":"CCMSLIB00017299259","spectrum_index":41941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dioxy-creatinine - 40.0 eV (delta mass: 30.014 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.064,"smiles":null,"spectrum_id":"CCMSLIB00017299262","spectrum_index":41942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 70.0812 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.371,"smiles":null,"spectrum_id":"CCMSLIB00017299265","spectrum_index":41943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylpyridine-4-carboxylic acid (delta mass: 41.9801 Da; putative annotation: N/A; putative formula: H-1N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.03,"smiles":null,"spectrum_id":"CCMSLIB00017299267","spectrum_index":41944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 187.1571 Da; putative annotation: N/A; putative formula: C10H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.212,"smiles":null,"spectrum_id":"CCMSLIB00017299269","spectrum_index":41945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 300.1778 Da; putative annotation: N/A; putative formula: C17H24N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.305,"smiles":null,"spectrum_id":"CCMSLIB00017299272","spectrum_index":41946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Pyridin-3-yl)furan-2-yl]methanamine (delta mass: 30.9945 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.081,"smiles":null,"spectrum_id":"CCMSLIB00017299275","spectrum_index":41947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 525.3468 Da; putative annotation: N/A; putative formula: C33H43N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.428,"smiles":null,"spectrum_id":"CCMSLIB00017299278","spectrum_index":41948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 118.063 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.154,"smiles":null,"spectrum_id":"CCMSLIB00017299279","spectrum_index":41949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Fluorophenyl)-1H-imidazole (delta mass: 16.9989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.066,"smiles":null,"spectrum_id":"CCMSLIB00017299282","spectrum_index":41950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.284,"smiles":null,"spectrum_id":"CCMSLIB00017299285","spectrum_index":41951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 630.3047 Da; putative annotation: N/A; putative formula: C26H52N2O11P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":794.396,"smiles":null,"spectrum_id":"CCMSLIB00017299288","spectrum_index":41952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 88.091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.209,"smiles":null,"spectrum_id":"CCMSLIB00017299291","spectrum_index":41953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 260.0945 Da; putative annotation: N/A; putative formula: C9H16N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.16,"smiles":null,"spectrum_id":"CCMSLIB00017299293","spectrum_index":41954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 82.0038 Da; putative annotation: N/A; putative formula: H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.079,"smiles":null,"spectrum_id":"CCMSLIB00017299296","spectrum_index":41955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4-(octyloxyl)benzophenone (delta mass: 396.1842 Da; putative annotation: N/A; putative formula: C11H20N14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.38,"smiles":null,"spectrum_id":"CCMSLIB00017299299","spectrum_index":41956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[(3,4-dimethoxyphenyl)methyl](4-oxo(3-hydrophthalazinyl))carboxamide CollisionEnergy:205060\"\" (delta mass: 117.0508 Da; putative annotation: N/A; putative formula: C3H7N3O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.18,"smiles":null,"spectrum_id":"CCMSLIB00017299301","spectrum_index":41957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 157.188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.357,"smiles":null,"spectrum_id":"CCMSLIB00017299304","spectrum_index":41958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(2-methoxybenzyl)ethanamine (delta mass: 1.9779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.122,"smiles":null,"spectrum_id":"CCMSLIB00017299307","spectrum_index":41959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT101553 3,4-Dihydroxy-L-phenylalanine|L-DOPA|L-3-Hydroxytyrosine|Levodopa|3-(3,4-Dihydroxyphenyl)-L-alanine|(2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid (delta mass: 173.0691 Da; putative annotation: N/A; putative formula: C7H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.145,"smiles":null,"spectrum_id":"CCMSLIB00017299310","spectrum_index":41960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 357.127 Da; putative annotation: N/A; putative formula: C12H23NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.187,"smiles":null,"spectrum_id":"CCMSLIB00017299313","spectrum_index":41961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 172.0893 Da; putative annotation: N/A; putative formula: C5H12N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.16,"smiles":null,"spectrum_id":"CCMSLIB00017299315","spectrum_index":41962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 302.2245 Da; putative annotation: N/A; putative formula: C20H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.495,"smiles":null,"spectrum_id":"CCMSLIB00017299318","spectrum_index":41963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methoxytyramine (delta mass: 238.232 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.334,"smiles":null,"spectrum_id":"CCMSLIB00017299321","spectrum_index":41964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxyamphetamine (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.206,"smiles":null,"spectrum_id":"CCMSLIB00017299324","spectrum_index":41965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 58.0628 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.154,"smiles":null,"spectrum_id":"CCMSLIB00017299327","spectrum_index":41966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 88.1468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.227,"smiles":null,"spectrum_id":"CCMSLIB00017299330","spectrum_index":41967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 26.0179 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.104,"smiles":null,"spectrum_id":"CCMSLIB00017299333","spectrum_index":41968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylimidazole (delta mass: 165.9501 Da; putative annotation: N/A; putative formula: C3H5O2P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.01,"smiles":null,"spectrum_id":"CCMSLIB00017299335","spectrum_index":41969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 80.0623 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.268,"smiles":null,"spectrum_id":"CCMSLIB00017299337","spectrum_index":41970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyanomethyl)-1H-indole-2-carboxylic acid (delta mass: 96.0078 Da; putative annotation: N/A; putative formula: C2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.074,"smiles":null,"spectrum_id":"CCMSLIB00017299340","spectrum_index":41971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 272.1915 Da; putative annotation: N/A; putative formula: C14H28N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.371,"smiles":null,"spectrum_id":"CCMSLIB00017299343","spectrum_index":41972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 199.2054 Da; putative annotation: N/A; putative formula: C11H25N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.312,"smiles":null,"spectrum_id":"CCMSLIB00017299346","spectrum_index":41973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 112.0886 Da; putative annotation: 4-(Hydroxymethyl)cyclohexanol; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.149,"smiles":null,"spectrum_id":"CCMSLIB00017299349","spectrum_index":41974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 178.0633 Da; putative annotation: 2H-Pyran-2-one, 6-(3,4-dihydroxy-1-penten-1-yl)-; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.192,"smiles":null,"spectrum_id":"CCMSLIB00017299350","spectrum_index":41975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 157.0749 Da; putative annotation: 4,4-Dimethyl-L-glutamic acid; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.276,"smiles":null,"spectrum_id":"CCMSLIB00017299353","spectrum_index":41976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 125.0478 Da; putative annotation: (2-Oxo-1-pyrrolidinyl)acetic acid; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.118,"smiles":null,"spectrum_id":"CCMSLIB00017299356","spectrum_index":41977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 296.235 Da; putative annotation: 12,13-Dihydroxy-9Z-octadecenoic acid; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.3,"smiles":null,"spectrum_id":"CCMSLIB00017299359","spectrum_index":41978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 275.1364 Da; putative annotation: Massbank:PR310825 N-Fructosyl isoleucine; putative formula: C12H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.207,"smiles":null,"spectrum_id":"CCMSLIB00017299361","spectrum_index":41979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 137.2137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.289,"smiles":null,"spectrum_id":"CCMSLIB00017299364","spectrum_index":41980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 345.1567 Da; putative annotation: N/A; putative formula: C13H24N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.326,"smiles":null,"spectrum_id":"CCMSLIB00017299367","spectrum_index":41981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 128.0626 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017299370","spectrum_index":41982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 102.0675 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.216,"smiles":null,"spectrum_id":"CCMSLIB00017299373","spectrum_index":41983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Benzo[g]indole (delta mass: 30.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.138,"smiles":null,"spectrum_id":"CCMSLIB00017299376","spectrum_index":41984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 363.1537 Da; putative annotation: N/A; putative formula: C5H19N17O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.266,"smiles":null,"spectrum_id":"CCMSLIB00017299379","spectrum_index":41985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 196.0738 Da; putative annotation: N/A; putative formula: C10H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.186,"smiles":null,"spectrum_id":"CCMSLIB00017299381","spectrum_index":41986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxy-2-methylindole-3-carboxylic acid CollisionEnergy:205060 (delta mass: 41.1211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.187,"smiles":null,"spectrum_id":"CCMSLIB00017299384","spectrum_index":41987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 62.0514 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017299387","spectrum_index":41988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 98.0585 Da; putative annotation: N/A; putative formula: C3H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.186,"smiles":null,"spectrum_id":"CCMSLIB00017299390","spectrum_index":41989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 107.0373 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.077,"smiles":null,"spectrum_id":"CCMSLIB00017299392","spectrum_index":41990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-3,4-(methylenedioxy)benzylamine (delta mass: 41.015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.101,"smiles":null,"spectrum_id":"CCMSLIB00017299394","spectrum_index":41991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norpropoxyphene (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.206,"smiles":null,"spectrum_id":"CCMSLIB00017299397","spectrum_index":41992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 187.0365 Da; putative annotation: N/A; putative formula: C5HN9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.123,"smiles":null,"spectrum_id":"CCMSLIB00017299400","spectrum_index":41993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301340 Ethylbeta-carboline (delta mass: 449.2726 Da; putative annotation: N/A; putative formula: C25H35N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.38,"smiles":null,"spectrum_id":"CCMSLIB00017299403","spectrum_index":41994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 46.1033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.23,"smiles":null,"spectrum_id":"CCMSLIB00017299405","spectrum_index":41995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE (delta mass: 904.8205 Da; putative annotation: N/A; putative formula: C56H108N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1214.93,"smiles":null,"spectrum_id":"CCMSLIB00017299408","spectrum_index":41996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 268.237 Da; putative annotation: N/A; putative formula: C13H28N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.49,"smiles":null,"spectrum_id":"CCMSLIB00017299411","spectrum_index":41997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 282.0522 Da; putative annotation: N/A; putative formula: C8H14N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.181,"smiles":null,"spectrum_id":"CCMSLIB00017299414","spectrum_index":41998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 113.9881 Da; putative annotation: N/A; putative formula: C3H2N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.074,"smiles":null,"spectrum_id":"CCMSLIB00017299415","spectrum_index":41999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrexone (delta mass: 10.9168 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.087,"smiles":null,"spectrum_id":"CCMSLIB00017299418","spectrum_index":42000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 170.1056 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.207,"smiles":null,"spectrum_id":"CCMSLIB00017299421","spectrum_index":42001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 76.0416 Da; putative annotation: N/A; putative formula: C5H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.128,"smiles":null,"spectrum_id":"CCMSLIB00017299423","spectrum_index":42002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 305.1348 Da; putative annotation: N/A; putative formula: C11H15N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.221,"smiles":null,"spectrum_id":"CCMSLIB00017299426","spectrum_index":42003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 27.9961 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.114,"smiles":null,"spectrum_id":"CCMSLIB00017299429","spectrum_index":42004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Leu from NIST14 (delta mass: 204.1008 Da; putative annotation: N/A; putative formula: C10H20S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.271,"smiles":null,"spectrum_id":"CCMSLIB00017299431","spectrum_index":42005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 34.0201 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.085,"smiles":null,"spectrum_id":"CCMSLIB00017299434","spectrum_index":42006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 162.0721 Da; putative annotation: N/A; putative formula: C7H16P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.174,"smiles":null,"spectrum_id":"CCMSLIB00017299437","spectrum_index":42007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[1-(Aminomethyl)cyclopentyl]acetic acid (delta mass: 84.0565 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.174,"smiles":null,"spectrum_id":"CCMSLIB00017299440","spectrum_index":42008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Octen-3-ol (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.169,"smiles":null,"spectrum_id":"CCMSLIB00017299441","spectrum_index":42009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 156.0758 Da; putative annotation: N/A; putative formula: C4H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.199,"smiles":null,"spectrum_id":"CCMSLIB00017299444","spectrum_index":42010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Phenylalanine, methyl ester (delta mass: 111.0323 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017299447","spectrum_index":42011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 153.0787 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.181,"smiles":null,"spectrum_id":"CCMSLIB00017299449","spectrum_index":42012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 177.0989 Da; putative annotation: N/A; putative formula: C7H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.185,"smiles":null,"spectrum_id":"CCMSLIB00017299452","spectrum_index":42013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 222.0593 Da; putative annotation: N/A; putative formula: C7H15N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.151,"smiles":null,"spectrum_id":"CCMSLIB00017299453","spectrum_index":42014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 74.0736 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.134,"smiles":null,"spectrum_id":"CCMSLIB00017299456","spectrum_index":42015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 258.1697 Da; putative annotation: N/A; putative formula: C11H22N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.272,"smiles":null,"spectrum_id":"CCMSLIB00017299459","spectrum_index":42016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 412.3296 Da; putative annotation: N/A; putative formula: C23H44N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.489,"smiles":null,"spectrum_id":"CCMSLIB00017299461","spectrum_index":42017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 45.9342 Da; putative annotation: N/A; putative formula: H-2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.036,"smiles":null,"spectrum_id":"CCMSLIB00017299464","spectrum_index":42018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 158.1307 Da; putative annotation: N/A; putative formula: C9H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017299465","spectrum_index":42019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 197.0904 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.181,"smiles":null,"spectrum_id":"CCMSLIB00017299468","spectrum_index":42020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 238.1025 Da; putative annotation: N/A; putative formula: C16H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.256,"smiles":null,"spectrum_id":"CCMSLIB00017299471","spectrum_index":42021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380158-01!2-[2-[2-[[2-[2-(2-hydroxypropanoylamino)-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoyl]oxypropanoylamino]-3-methylbutanoic acid (delta mass: 153.1169 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.435,"smiles":null,"spectrum_id":"CCMSLIB00017299473","spectrum_index":42022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 13.1624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.217,"smiles":null,"spectrum_id":"CCMSLIB00017299476","spectrum_index":42023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 125.048 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017299478","spectrum_index":42024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 38.0706 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.194,"smiles":null,"spectrum_id":"CCMSLIB00017299481","spectrum_index":42025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 298.121 Da; putative annotation: N/A; putative formula: C18H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.192,"smiles":null,"spectrum_id":"CCMSLIB00017299483","spectrum_index":42026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 49.0019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.104,"smiles":null,"spectrum_id":"CCMSLIB00017299486","spectrum_index":42027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 761.6022 Da; putative annotation: N/A; putative formula: C42H83NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":924.662,"smiles":null,"spectrum_id":"CCMSLIB00017299489","spectrum_index":42028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptamine (delta mass: 349.1821 Da; putative annotation: N/A; putative formula: C20H24N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.289,"smiles":null,"spectrum_id":"CCMSLIB00017299492","spectrum_index":42029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 485.1744 Da; putative annotation: N/A; putative formula: C16H19N15O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.298,"smiles":null,"spectrum_id":"CCMSLIB00017299493","spectrum_index":42030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 22.0094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.07,"smiles":null,"spectrum_id":"CCMSLIB00017299496","spectrum_index":42031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 197.1034 Da; putative annotation: N/A; putative formula: C6H11N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.19,"smiles":null,"spectrum_id":"CCMSLIB00017299499","spectrum_index":42032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 162.0485 Da; putative annotation: N/A; putative formula: C4H11N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.13,"smiles":null,"spectrum_id":"CCMSLIB00017299502","spectrum_index":42033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 17.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.217,"smiles":null,"spectrum_id":"CCMSLIB00017299504","spectrum_index":42034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 24.0366 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.18,"smiles":null,"spectrum_id":"CCMSLIB00017299506","spectrum_index":42035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 180.0423 Da; putative annotation: N/A; putative formula: C9H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.207,"smiles":null,"spectrum_id":"CCMSLIB00017299509","spectrum_index":42036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 82.1502 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.21,"smiles":null,"spectrum_id":"CCMSLIB00017299512","spectrum_index":42037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methanone, [1-(2-hydroxypentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)- (delta mass: 201.1 Da; putative annotation: N/A; putative formula: C9H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.327,"smiles":null,"spectrum_id":"CCMSLIB00017299515","spectrum_index":42038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 181.0378 Da; putative annotation: N/A; putative formula: C8H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.103,"smiles":null,"spectrum_id":"CCMSLIB00017299517","spectrum_index":42039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 794.4451 Da; putative annotation: N/A; putative formula: C40H54N14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1001.53,"smiles":null,"spectrum_id":"CCMSLIB00017299520","spectrum_index":42040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 336.0639 Da; putative annotation: N/A; putative formula: C4H8N12O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.187,"smiles":null,"spectrum_id":"CCMSLIB00017299522","spectrum_index":42041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 63.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.138,"smiles":null,"spectrum_id":"CCMSLIB00017299525","spectrum_index":42042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 180.0934 Da; putative annotation: N/A; putative formula: C14H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.217,"smiles":null,"spectrum_id":"CCMSLIB00017299528","spectrum_index":42043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 61.9798 Da; putative annotation: N/A; putative formula: C4H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.101,"smiles":null,"spectrum_id":"CCMSLIB00017299530","spectrum_index":42044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 150.1984 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.29,"smiles":null,"spectrum_id":"CCMSLIB00017299533","spectrum_index":42045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 31.804 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.91,"smiles":null,"spectrum_id":"CCMSLIB00017299536","spectrum_index":42046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GUANOSINE 5'-MONOPHOSPHATE - 20.0 eV (delta mass: 726.1168 Da; putative annotation: N/A; putative formula: C29H26N8O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1090.18,"smiles":null,"spectrum_id":"CCMSLIB00017299538","spectrum_index":42047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017299541","spectrum_index":42048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 1042.531 Da; putative annotation: N/A; putative formula: C53H74N10O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1264.63,"smiles":null,"spectrum_id":"CCMSLIB00017299544","spectrum_index":42049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 17.9742 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.107,"smiles":null,"spectrum_id":"CCMSLIB00017299547","spectrum_index":42050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 410.1512 Da; putative annotation: N/A; putative formula: C19H26N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.274,"smiles":null,"spectrum_id":"CCMSLIB00017299549","spectrum_index":42051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 88.068 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.116,"smiles":null,"spectrum_id":"CCMSLIB00017299552","spectrum_index":42052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 94.0164 Da; putative annotation: N/A; putative formula: C4H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.081,"smiles":null,"spectrum_id":"CCMSLIB00017299555","spectrum_index":42053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 76.0254 Da; putative annotation: N/A; putative formula: CH4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.096,"smiles":null,"spectrum_id":"CCMSLIB00017299558","spectrum_index":42054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 90.0468 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.138,"smiles":null,"spectrum_id":"CCMSLIB00017299560","spectrum_index":42055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 175.1534 Da; putative annotation: N/A; putative formula: C5H17N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.255,"smiles":null,"spectrum_id":"CCMSLIB00017299563","spectrum_index":42056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl indole-4-carboxylate (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.076,"smiles":null,"spectrum_id":"CCMSLIB00017299565","spectrum_index":42057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 111.0306 Da; putative annotation: N/A; putative formula: C3H4F3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.117,"smiles":null,"spectrum_id":"CCMSLIB00017299568","spectrum_index":42058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 141.0428 Da; putative annotation: N/A; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.108,"smiles":null,"spectrum_id":"CCMSLIB00017299571","spectrum_index":42059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GALACTOSAMINE (delta mass: 106.0652 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.152,"smiles":null,"spectrum_id":"CCMSLIB00017299572","spectrum_index":42060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-(Difluoromethylthio)phenyl)-N-methylmethanamine (delta mass: 194.116 Da; putative annotation: N/A; putative formula: C9H14N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.181,"smiles":null,"spectrum_id":"CCMSLIB00017299575","spectrum_index":42061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 237.144 Da; putative annotation: N/A; putative formula: C8H15N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.298,"smiles":null,"spectrum_id":"CCMSLIB00017299578","spectrum_index":42062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311112 Caffeoyl putrescin (isomer of 1059) (delta mass: 248.1145 Da; putative annotation: N/A; putative formula: C7H17N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.254,"smiles":null,"spectrum_id":"CCMSLIB00017299581","spectrum_index":42063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 131.1122 Da; putative annotation: N/A; putative formula: C10H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.134,"smiles":null,"spectrum_id":"CCMSLIB00017299584","spectrum_index":42064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-3-(1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole (delta mass: 151.1073 Da; putative annotation: N/A; putative formula: C8H13N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.191,"smiles":null,"spectrum_id":"CCMSLIB00017299586","spectrum_index":42065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 428.3552 Da; putative annotation: N/A; putative formula: C23H48N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.483,"smiles":null,"spectrum_id":"CCMSLIB00017299589","spectrum_index":42066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 130.1149 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.342,"smiles":null,"spectrum_id":"CCMSLIB00017299591","spectrum_index":42067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 382.3561 Da; putative annotation: N/A; putative formula: C23H46N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.453,"smiles":null,"spectrum_id":"CCMSLIB00017299594","spectrum_index":42068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 66.0465 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.289,"smiles":null,"spectrum_id":"CCMSLIB00017299597","spectrum_index":42069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 182.0667 Da; putative annotation: N/A; putative formula: C4H6N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.153,"smiles":null,"spectrum_id":"CCMSLIB00017299600","spectrum_index":42070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 755.5507 Da; putative annotation: N/A; putative formula: C37H77N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1047.65,"smiles":null,"spectrum_id":"CCMSLIB00017299601","spectrum_index":42071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 17.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.191,"smiles":null,"spectrum_id":"CCMSLIB00017299604","spectrum_index":42072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 312.2754 Da; putative annotation: N/A; putative formula: C14H32N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.334,"smiles":null,"spectrum_id":"CCMSLIB00017299607","spectrum_index":42073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 36.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.16,"smiles":null,"spectrum_id":"CCMSLIB00017299610","spectrum_index":42074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 84.0575 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.133,"smiles":null,"spectrum_id":"CCMSLIB00017299612","spectrum_index":42075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 26.9878 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.048,"smiles":null,"spectrum_id":"CCMSLIB00017299614","spectrum_index":42076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 283.1171 Da; putative annotation: N/A; putative formula: C12H17N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.203,"smiles":null,"spectrum_id":"CCMSLIB00017299617","spectrum_index":42077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dobutamine (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.181,"smiles":null,"spectrum_id":"CCMSLIB00017299620","spectrum_index":42078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 131.0949 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.223,"smiles":null,"spectrum_id":"CCMSLIB00017299623","spectrum_index":42079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 265.405 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.432,"smiles":null,"spectrum_id":"CCMSLIB00017299625","spectrum_index":42080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Buten-1-ol (delta mass: 41.0263 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":114.091,"smiles":null,"spectrum_id":"CCMSLIB00017299627","spectrum_index":42081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 159.0317 Da; putative annotation: N/A; putative formula: C9H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.129,"smiles":null,"spectrum_id":"CCMSLIB00017299630","spectrum_index":42082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 84.1119 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.198,"smiles":null,"spectrum_id":"CCMSLIB00017299633","spectrum_index":42083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 114.0832 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017299636","spectrum_index":42084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 91.053 Da; putative annotation: N/A; putative formula: C5H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.124,"smiles":null,"spectrum_id":"CCMSLIB00017299638","spectrum_index":42085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-(benzyloxy)-1H-indole-2-carboxylate (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.139,"smiles":null,"spectrum_id":"CCMSLIB00017299640","spectrum_index":42086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017299643","spectrum_index":42087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 51.0463 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.117,"smiles":null,"spectrum_id":"CCMSLIB00017299646","spectrum_index":42088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 90.0659 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.235,"smiles":null,"spectrum_id":"CCMSLIB00017299648","spectrum_index":42089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 303.2292 Da; putative annotation: N/A; putative formula: C14H25N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.5,"smiles":null,"spectrum_id":"CCMSLIB00017299651","spectrum_index":42090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-His (delta mass: 196.0856 Da; putative annotation: N/A; putative formula: C10H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.184,"smiles":null,"spectrum_id":"CCMSLIB00017299654","spectrum_index":42091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 30.0411 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.127,"smiles":null,"spectrum_id":"CCMSLIB00017299657","spectrum_index":42092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 154.1107 Da; putative annotation: N/A; putative formula: C8H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.176,"smiles":null,"spectrum_id":"CCMSLIB00017299659","spectrum_index":42093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 25.9776 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.09,"smiles":null,"spectrum_id":"CCMSLIB00017299661","spectrum_index":42094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 157.1467 Da; putative annotation: N/A; putative formula: C9H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.212,"smiles":null,"spectrum_id":"CCMSLIB00017299664","spectrum_index":42095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 372.2661 Da; putative annotation: N/A; putative formula: C24H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.368,"smiles":null,"spectrum_id":"CCMSLIB00017299667","spectrum_index":42096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 107.0733 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.164,"smiles":null,"spectrum_id":"CCMSLIB00017299670","spectrum_index":42097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 109.0118 Da; putative annotation: N/A; putative formula: H3N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.093,"smiles":null,"spectrum_id":"CCMSLIB00017299672","spectrum_index":42098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNITOL (delta mass: 350.0796 Da; putative annotation: N/A; putative formula: C12H20N2O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.166,"smiles":null,"spectrum_id":"CCMSLIB00017299674","spectrum_index":42099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 2-methyl-4-phenyl-1H-pyrrole-3-carboxylate (delta mass: 14.0313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.149,"smiles":null,"spectrum_id":"CCMSLIB00017299677","spectrum_index":42100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 76.0678 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.138,"smiles":null,"spectrum_id":"CCMSLIB00017299680","spectrum_index":42101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 325.2963 Da; putative annotation: N/A; putative formula: C16H35N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.383,"smiles":null,"spectrum_id":"CCMSLIB00017299683","spectrum_index":42102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 45.0426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017299686","spectrum_index":42103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Glu from NIST14 (delta mass: 129.0415 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.186,"smiles":null,"spectrum_id":"CCMSLIB00017299688","spectrum_index":42104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 205.0929 Da; putative annotation: N-Acetyl-D-galactosaminitol; putative formula: C8H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.153,"smiles":null,"spectrum_id":"CCMSLIB00017299690","spectrum_index":42105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 118.0409 Da; putative annotation: Phenylacetic acid; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.117,"smiles":null,"spectrum_id":"CCMSLIB00017299693","spectrum_index":42106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 194.0578 Da; putative annotation: 2,4,5-trimethoxybenzoic acid; putative formula: C10H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.15,"smiles":null,"spectrum_id":"CCMSLIB00017299696","spectrum_index":42107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 172.0977 Da; putative annotation: L-Hydroxyarginine; putative formula: C6H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.179,"smiles":null,"spectrum_id":"CCMSLIB00017299698","spectrum_index":42108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 309.1073 Da; putative annotation: Spectral Match to (-)-N-Acetylneuraminic acid from NIST14; putative formula: C11H19NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.221,"smiles":null,"spectrum_id":"CCMSLIB00017299701","spectrum_index":42109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydro-beta-carboline (delta mass: 125.0574 Da; putative annotation: 2-Imino-1-imidazolidineacetic acid; putative formula: C5H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.18,"smiles":null,"spectrum_id":"CCMSLIB00017299704","spectrum_index":42110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 113.0839 Da; putative annotation: L-ISOLEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.212,"smiles":null,"spectrum_id":"CCMSLIB00017299707","spectrum_index":42111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 876.4899 Da; putative annotation: 3-hydroxy-6-[(9-hydroxy-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,14a-dodecahydropicen-3-yl)oxy]-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-5-(3,4,5-trihydroxyoxan-2-yl)oxyoxane-2-carboxylic acid; putative formula: C47H72O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1039.55,"smiles":null,"spectrum_id":"CCMSLIB00017299710","spectrum_index":42112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 129.0579 Da; putative annotation: 6-Hydroxy-2-methylindole; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.149,"smiles":null,"spectrum_id":"CCMSLIB00017299713","spectrum_index":42113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 120.0418 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.175,"smiles":null,"spectrum_id":"CCMSLIB00017299715","spectrum_index":42114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 37.9861 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.124,"smiles":null,"spectrum_id":"CCMSLIB00017299717","spectrum_index":42115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 126.1022 Da; putative annotation: N/A; putative formula: C4H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.162,"smiles":null,"spectrum_id":"CCMSLIB00017299720","spectrum_index":42116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 174.087 Da; putative annotation: N/A; putative formula: C12H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.267,"smiles":null,"spectrum_id":"CCMSLIB00017299723","spectrum_index":42117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vincamine (delta mass: 41.0697 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.271,"smiles":null,"spectrum_id":"CCMSLIB00017299726","spectrum_index":42118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 105.0474 Da; putative annotation: N/A; putative formula: CH7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.134,"smiles":null,"spectrum_id":"CCMSLIB00017299728","spectrum_index":42119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385769-01!4-[3,5-dihydroxy-7-(4-hydroxyphenyl)heptyl]benzene-1,2-diol (delta mass: 258.1042 Da; putative annotation: N/A; putative formula: C19H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.274,"smiles":null,"spectrum_id":"CCMSLIB00017299731","spectrum_index":42120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 285.179 Da; putative annotation: N/A; putative formula: C12H23N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.244,"smiles":null,"spectrum_id":"CCMSLIB00017299734","spectrum_index":42121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU244306 2-Amino-9H-pyrido[2,3-b]indole (AalphaC)|2-Amino-9H-pyrido[2,3-b]indole|9H-pyrido[2,3-b]indol-2-amine (delta mass: 326.3047 Da; putative annotation: N/A; putative formula: C18H38N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.392,"smiles":null,"spectrum_id":"CCMSLIB00017299737","spectrum_index":42122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 998.3338 Da; putative annotation: N/A; putative formula: C66H46N8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1220.43,"smiles":null,"spectrum_id":"CCMSLIB00017299740","spectrum_index":42123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.237,"smiles":null,"spectrum_id":"CCMSLIB00017299741","spectrum_index":42124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 551.2 Da; putative annotation: N/A; putative formula: C24H21N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":912.365,"smiles":null,"spectrum_id":"CCMSLIB00017299744","spectrum_index":42125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 779.4095 Da; putative annotation: N/A; putative formula: C54H49N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.48,"smiles":null,"spectrum_id":"CCMSLIB00017299747","spectrum_index":42126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 348.1993 Da; putative annotation: N/A; putative formula: C26H24N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.311,"smiles":null,"spectrum_id":"CCMSLIB00017299750","spectrum_index":42127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 184.1934 Da; putative annotation: N/A; putative formula: C11H24N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.28,"smiles":null,"spectrum_id":"CCMSLIB00017299751","spectrum_index":42128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 240.1207 Da; putative annotation: N/A; putative formula: C12H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.232,"smiles":null,"spectrum_id":"CCMSLIB00017299754","spectrum_index":42129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 203.094 Da; putative annotation: N/A; putative formula: C6H14N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.191,"smiles":null,"spectrum_id":"CCMSLIB00017299757","spectrum_index":42130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 55.0013 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.171,"smiles":null,"spectrum_id":"CCMSLIB00017299760","spectrum_index":42131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 106.0995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.201,"smiles":null,"spectrum_id":"CCMSLIB00017299763","spectrum_index":42132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 97.0954 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.275,"smiles":null,"spectrum_id":"CCMSLIB00017299766","spectrum_index":42133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 317.9851 Da; putative annotation: N/A; putative formula: C8H10N6S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.144,"smiles":null,"spectrum_id":"CCMSLIB00017299767","spectrum_index":42134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 341.2932 Da; putative annotation: N/A; putative formula: C20H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.369,"smiles":null,"spectrum_id":"CCMSLIB00017299770","spectrum_index":42135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 116.0483 Da; putative annotation: N/A; putative formula: C6H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.094,"smiles":null,"spectrum_id":"CCMSLIB00017299773","spectrum_index":42136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 20.0 eV (delta mass: 103.0588 Da; putative annotation: N/A; putative formula: C3H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.172,"smiles":null,"spectrum_id":"CCMSLIB00017299776","spectrum_index":42137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 310.2142 Da; putative annotation: N/A; putative formula: C18H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.311,"smiles":null,"spectrum_id":"CCMSLIB00017299779","spectrum_index":42138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Longicaulenone (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.138,"smiles":null,"spectrum_id":"CCMSLIB00017299780","spectrum_index":42139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 76.0672 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.221,"smiles":null,"spectrum_id":"CCMSLIB00017299783","spectrum_index":42140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 1-methyl-9H-beta-carbolin-7-yl ether (delta mass: 146.0978 Da; putative annotation: N/A; putative formula: C6H15N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.2,"smiles":null,"spectrum_id":"CCMSLIB00017299786","spectrum_index":42141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 283.1447 Da; putative annotation: N/A; putative formula: C13H22N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.231,"smiles":null,"spectrum_id":"CCMSLIB00017299789","spectrum_index":42142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 751.4502 Da; putative annotation: N/A; putative formula: C53H57N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.55,"smiles":null,"spectrum_id":"CCMSLIB00017299791","spectrum_index":42143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 52.0321 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.103,"smiles":null,"spectrum_id":"CCMSLIB00017299794","spectrum_index":42144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 167.1263 Da; putative annotation: N/A; putative formula: C6H13N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.202,"smiles":null,"spectrum_id":"CCMSLIB00017299797","spectrum_index":42145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zinterol (delta mass: 43.9882 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.157,"smiles":null,"spectrum_id":"CCMSLIB00017299800","spectrum_index":42146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 244.2186 Da; putative annotation: N/A; putative formula: C12H29N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.487,"smiles":null,"spectrum_id":"CCMSLIB00017299803","spectrum_index":42147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 194.0697 Da; putative annotation: N/A; putative formula: C2H10N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.14,"smiles":null,"spectrum_id":"CCMSLIB00017299805","spectrum_index":42148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 126.2987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.5,"smiles":null,"spectrum_id":"CCMSLIB00017299808","spectrum_index":42149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 204.0637 Da; putative annotation: N/A; putative formula: C8H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.24,"smiles":null,"spectrum_id":"CCMSLIB00017299810","spectrum_index":42150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxymelatonin (delta mass: 59.0366 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.16,"smiles":null,"spectrum_id":"CCMSLIB00017299813","spectrum_index":42151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 133.0898 Da; putative annotation: N/A; putative formula: C9H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.171,"smiles":null,"spectrum_id":"CCMSLIB00017299816","spectrum_index":42152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 142.9421 Da; putative annotation: N/A; putative formula: C4H2NO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.997,"smiles":null,"spectrum_id":"CCMSLIB00017299819","spectrum_index":42153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 571.5162 Da; putative annotation: N/A; putative formula: C31H61N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":734.576,"smiles":null,"spectrum_id":"CCMSLIB00017299821","spectrum_index":42154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 83.0589 Da; putative annotation: N/A; putative formula: C2H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.107,"smiles":null,"spectrum_id":"CCMSLIB00017299824","spectrum_index":42155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 300.1573 Da; putative annotation: N/A; putative formula: C15H24O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.311,"smiles":null,"spectrum_id":"CCMSLIB00017299827","spectrum_index":42156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-(5-ethyl(1,3,4-thiadiazol-2-yl))-2-(2-1,2,3,4-tetrahydroisoquinolyl)acetamid e CollisionEnergy:205060\"\" (delta mass: 94.9933 Da; putative annotation: N/A; putative formula: C4H2NP)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.121,"smiles":null,"spectrum_id":"CCMSLIB00017299829","spectrum_index":42157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 96.0531 Da; putative annotation: N/A; putative formula: C2H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.155,"smiles":null,"spectrum_id":"CCMSLIB00017299832","spectrum_index":42158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 104.0624 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.221,"smiles":null,"spectrum_id":"CCMSLIB00017299835","spectrum_index":42159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 112.147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.311,"smiles":null,"spectrum_id":"CCMSLIB00017299838","spectrum_index":42160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucylvaline (delta mass: 230.0639 Da; putative annotation: N/A; putative formula: C4H2N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.234,"smiles":null,"spectrum_id":"CCMSLIB00017299840","spectrum_index":42161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 685.1972 Da; putative annotation: N/A; putative formula: C31H36N5O9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.268,"smiles":null,"spectrum_id":"CCMSLIB00017299843","spectrum_index":42162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 301.0588 Da; putative annotation: N/A; putative formula: C15H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.134,"smiles":null,"spectrum_id":"CCMSLIB00017299845","spectrum_index":42163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 29.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.055,"smiles":null,"spectrum_id":"CCMSLIB00017299848","spectrum_index":42164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE0; MS2Dec (delta mass: 129.0425 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.103,"smiles":null,"spectrum_id":"CCMSLIB00017299850","spectrum_index":42165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 188.0588 Da; putative annotation: N/A; putative formula: C10H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.145,"smiles":null,"spectrum_id":"CCMSLIB00017299853","spectrum_index":42166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 343.1741 Da; putative annotation: N/A; putative formula: C15H25N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.256,"smiles":null,"spectrum_id":"CCMSLIB00017299856","spectrum_index":42167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 209.0689 Da; putative annotation: N/A; putative formula: C10H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.134,"smiles":null,"spectrum_id":"CCMSLIB00017299858","spectrum_index":42168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 73.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.197,"smiles":null,"spectrum_id":"CCMSLIB00017299860","spectrum_index":42169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 221.2225 Da; putative annotation: N/A; putative formula: C14H27N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.319,"smiles":null,"spectrum_id":"CCMSLIB00017299863","spectrum_index":42170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethoxy-2(1H)-quinolinone (delta mass: 57.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.119,"smiles":null,"spectrum_id":"CCMSLIB00017299866","spectrum_index":42171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 38.052 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.143,"smiles":null,"spectrum_id":"CCMSLIB00017299867","spectrum_index":42172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl .alpha.-D-mannopyranoside (delta mass: 73.051 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.137,"smiles":null,"spectrum_id":"CCMSLIB00017299870","spectrum_index":42173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 158.0852 Da; putative annotation: N/A; putative formula: C10H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.172,"smiles":null,"spectrum_id":"CCMSLIB00017299873","spectrum_index":42174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 27.021 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.098,"smiles":null,"spectrum_id":"CCMSLIB00017299874","spectrum_index":42175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethyleneberberine (delta mass: 291.0815 Da; putative annotation: N/A; putative formula: C8H13N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.205,"smiles":null,"spectrum_id":"CCMSLIB00017299877","spectrum_index":42176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 40.0 eV (delta mass: 123.0392 Da; putative annotation: N/A; putative formula: H5N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.13,"smiles":null,"spectrum_id":"CCMSLIB00017299880","spectrum_index":42177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-6-chloro-1H-indole-2-carboxylic acid (delta mass: 77.3314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.258,"smiles":null,"spectrum_id":"CCMSLIB00017299883","spectrum_index":42178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 467.1643 Da; putative annotation: N/A; putative formula: C21H30N3O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.288,"smiles":null,"spectrum_id":"CCMSLIB00017299884","spectrum_index":42179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 603.3785 Da; putative annotation: N/A; putative formula: C35H49N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":946.502,"smiles":null,"spectrum_id":"CCMSLIB00017299887","spectrum_index":42180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-1-(4-phenoxyphenyl)methanamine (delta mass: 208.0792 Da; putative annotation: N/A; putative formula: C7H17N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.202,"smiles":null,"spectrum_id":"CCMSLIB00017299890","spectrum_index":42181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 110.1095 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.233,"smiles":null,"spectrum_id":"CCMSLIB00017299892","spectrum_index":42182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 403.2855 Da; putative annotation: N/A; putative formula: C21H42NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.32,"smiles":null,"spectrum_id":"CCMSLIB00017299895","spectrum_index":42183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 45.9116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.008,"smiles":null,"spectrum_id":"CCMSLIB00017299897","spectrum_index":42184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 126.0472 Da; putative annotation: N/A; putative formula: C10H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017299901","spectrum_index":42185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 128.0261 Da; putative annotation: N/A; putative formula: C9H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.175,"smiles":null,"spectrum_id":"CCMSLIB00017299903","spectrum_index":42186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 30.0313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017299906","spectrum_index":42187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 55.108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.252,"smiles":null,"spectrum_id":"CCMSLIB00017299909","spectrum_index":42188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 258.1829 Da; putative annotation: N/A; putative formula: C14H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.285,"smiles":null,"spectrum_id":"CCMSLIB00017299910","spectrum_index":42189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-hydroxycamptothecin (delta mass: 308.2274 Da; putative annotation: N/A; putative formula: C19H33OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.341,"smiles":null,"spectrum_id":"CCMSLIB00017299913","spectrum_index":42190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 339.1119 Da; putative annotation: N/A; putative formula: C20H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.214,"smiles":null,"spectrum_id":"CCMSLIB00017299916","spectrum_index":42191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Hydroxymethyl)-6-methylpyridin-3-ol (delta mass: 37.9792 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.05,"smiles":null,"spectrum_id":"CCMSLIB00017299919","spectrum_index":42192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lysergol CollisionEnergy:205060 (delta mass: 176.0325 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.182,"smiles":null,"spectrum_id":"CCMSLIB00017299921","spectrum_index":42193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 69.0556 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.152,"smiles":null,"spectrum_id":"CCMSLIB00017299923","spectrum_index":42194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 122.9013 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.982,"smiles":null,"spectrum_id":"CCMSLIB00017299926","spectrum_index":42195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 110.045 Da; putative annotation: N/A; putative formula: CH2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.116,"smiles":null,"spectrum_id":"CCMSLIB00017299929","spectrum_index":42196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 90.0467 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.133,"smiles":null,"spectrum_id":"CCMSLIB00017299932","spectrum_index":42197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 278.1742 Da; putative annotation: N/A; putative formula: C14H22N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.26,"smiles":null,"spectrum_id":"CCMSLIB00017299933","spectrum_index":42198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 157.0733 Da; putative annotation: N/A; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.133,"smiles":null,"spectrum_id":"CCMSLIB00017299936","spectrum_index":42199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 194.1306 Da; putative annotation: N/A; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.238,"smiles":null,"spectrum_id":"CCMSLIB00017299939","spectrum_index":42200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 57.9606 Da; putative annotation: N/A; putative formula: CH-1OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.047,"smiles":null,"spectrum_id":"CCMSLIB00017299941","spectrum_index":42201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 158.0732 Da; putative annotation: N/A; putative formula: C11H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.144,"smiles":null,"spectrum_id":"CCMSLIB00017299944","spectrum_index":42202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 80.0823 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.179,"smiles":null,"spectrum_id":"CCMSLIB00017299947","spectrum_index":42203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (1S,15S,17S)-17-[(1S)-1-hydroxyethyl]-3,13-diazapentacyclo[13.3.1.0,?.0?,?.0,?]nonadeca-2(10),4,6,8-tetraene-1-carboxylate (delta mass: 300.2584 Da; putative annotation: N/A; putative formula: C18H37OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.46,"smiles":null,"spectrum_id":"CCMSLIB00017299949","spectrum_index":42204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 327.11 Da; putative annotation: N/A; putative formula: C10H21N3O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.207,"smiles":null,"spectrum_id":"CCMSLIB00017299952","spectrum_index":42205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 680.7684 Da; putative annotation: N/A; putative formula: C50H96O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.855,"smiles":null,"spectrum_id":"CCMSLIB00017299955","spectrum_index":42206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 243.2918 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.362,"smiles":null,"spectrum_id":"CCMSLIB00017299958","spectrum_index":42207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PYRROLE-2-CARBOXYLIC ACID CollisionEnergy:205060 (delta mass: 144.0436 Da; putative annotation: N/A; putative formula: C7H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.083,"smiles":null,"spectrum_id":"CCMSLIB00017299959","spectrum_index":42208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 161.0802 Da; putative annotation: N/A; putative formula: C5H11N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.362,"smiles":null,"spectrum_id":"CCMSLIB00017299962","spectrum_index":42209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 559.2485 Da; putative annotation: N/A; putative formula: C36H29N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.372,"smiles":null,"spectrum_id":"CCMSLIB00017299965","spectrum_index":42210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 582.3088 Da; putative annotation: N/A; putative formula: C28H46N4O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.38,"smiles":null,"spectrum_id":"CCMSLIB00017299968","spectrum_index":42211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 171.0667 Da; putative annotation: N/A; putative formula: C5H10N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.172,"smiles":null,"spectrum_id":"CCMSLIB00017299969","spectrum_index":42212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 1172.5571 Da; putative annotation: N/A; putative formula: C65H80N4O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1353.63,"smiles":null,"spectrum_id":"CCMSLIB00017299972","spectrum_index":42213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 482.1191 Da; putative annotation: N/A; putative formula: C29H22O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.205,"smiles":null,"spectrum_id":"CCMSLIB00017299975","spectrum_index":42214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 46.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.201,"smiles":null,"spectrum_id":"CCMSLIB00017299978","spectrum_index":42215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vincarine (delta mass: 87.0757 Da; putative annotation: N/A; putative formula: C3H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.262,"smiles":null,"spectrum_id":"CCMSLIB00017299979","spectrum_index":42216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.128,"smiles":null,"spectrum_id":"CCMSLIB00017299982","spectrum_index":42217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benserazide (delta mass: 46.0116 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.12,"smiles":null,"spectrum_id":"CCMSLIB00017299985","spectrum_index":42218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 283.0491 Da; putative annotation: N/A; putative formula: C16H13NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.125,"smiles":null,"spectrum_id":"CCMSLIB00017299987","spectrum_index":42219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 175.1927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.248,"smiles":null,"spectrum_id":"CCMSLIB00017299990","spectrum_index":42220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 182.1663 Da; putative annotation: N/A; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.226,"smiles":null,"spectrum_id":"CCMSLIB00017299992","spectrum_index":42221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 651.4133 Da; putative annotation: N/A; putative formula: C39H57NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.516,"smiles":null,"spectrum_id":"CCMSLIB00017299996","spectrum_index":42222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 18.0503 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.138,"smiles":null,"spectrum_id":"CCMSLIB00017299999","spectrum_index":42223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 54.9948 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.097,"smiles":null,"spectrum_id":"CCMSLIB00017300002","spectrum_index":42224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 61.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.113,"smiles":null,"spectrum_id":"CCMSLIB00017300005","spectrum_index":42225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 120.0231 Da; putative annotation: N/A; putative formula: C6H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.11,"smiles":null,"spectrum_id":"CCMSLIB00017300008","spectrum_index":42226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 104.0836 Da; putative annotation: N/A; putative formula: CH8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017300010","spectrum_index":42227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Phenyl-1H-pyrazol-1-yl)piperidine (delta mass: 81.0505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.2,"smiles":null,"spectrum_id":"CCMSLIB00017300013","spectrum_index":42228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 220.1829 Da; putative annotation: N/A; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.306,"smiles":null,"spectrum_id":"CCMSLIB00017300016","spectrum_index":42229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 166.0838 Da; putative annotation: N/A; putative formula: C3H6N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.143,"smiles":null,"spectrum_id":"CCMSLIB00017300018","spectrum_index":42230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 213.0774 Da; putative annotation: N/A; putative formula: C13H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.158,"smiles":null,"spectrum_id":"CCMSLIB00017300021","spectrum_index":42231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 35.0384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.183,"smiles":null,"spectrum_id":"CCMSLIB00017300023","spectrum_index":42232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 42.0317 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.175,"smiles":null,"spectrum_id":"CCMSLIB00017300026","spectrum_index":42233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 226.0845 Da; putative annotation: N/A; putative formula: C4H14N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.181,"smiles":null,"spectrum_id":"CCMSLIB00017300029","spectrum_index":42234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-beta-D-galactosamine - 40.0 eV (delta mass: 407.1943 Da; putative annotation: N/A; putative formula: C21H29NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.292,"smiles":null,"spectrum_id":"CCMSLIB00017300032","spectrum_index":42235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Val (delta mass: 113.0833 Da; putative annotation: Norleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017300034","spectrum_index":42236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 356.2201 Da; putative annotation: (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[4-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)butan-2-yloxy]oxane-3,4,5-triol; putative formula: C19H32O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.28,"smiles":null,"spectrum_id":"CCMSLIB00017300036","spectrum_index":42237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 270.147 Da; putative annotation: (E)-3,10-Dihydroxy-4,9-dimethyldodec-6-enedioic acid; putative formula: C14H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.207,"smiles":null,"spectrum_id":"CCMSLIB00017300039","spectrum_index":42238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 113.0476 Da; putative annotation: Acetyl-.beta.-alanine; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.118,"smiles":null,"spectrum_id":"CCMSLIB00017300042","spectrum_index":42239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 280.1519 Da; putative annotation: 2-Methyl-2-[4-(1-methyl-1-phenylethyl)phenoxy]propanoic acid; putative formula: C19H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.243,"smiles":null,"spectrum_id":"CCMSLIB00017300045","spectrum_index":42240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 260.214 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.274,"smiles":null,"spectrum_id":"CCMSLIB00017300047","spectrum_index":42241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 205.074 Da; putative annotation: N-Acetyl-L-tyrosine; putative formula: C11H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.16,"smiles":null,"spectrum_id":"CCMSLIB00017300049","spectrum_index":42242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 404.1506 Da; putative annotation: Losartan; putative formula: C22H21ClN6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.216,"smiles":null,"spectrum_id":"CCMSLIB00017300052","spectrum_index":42243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 214.0953 Da; putative annotation: Sorbicillin; putative formula: C14H14O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.182,"smiles":null,"spectrum_id":"CCMSLIB00017300055","spectrum_index":42244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine (delta mass: 113.0843 Da; putative annotation: 6-Aminocaproic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.26,"smiles":null,"spectrum_id":"CCMSLIB00017300058","spectrum_index":42245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 144.0424 Da; putative annotation: 1,6-Anhydro-.beta.-D-glucose; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.118,"smiles":null,"spectrum_id":"CCMSLIB00017300060","spectrum_index":42246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 64.0126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.198,"smiles":null,"spectrum_id":"CCMSLIB00017300062","spectrum_index":42247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isomaltose (delta mass: 221.2143 Da; putative annotation: N/A; putative formula: C15H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.338,"smiles":null,"spectrum_id":"CCMSLIB00017300065","spectrum_index":42248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S-(2-Aminoethyl)isothiourea (delta mass: 57.9997 Da; putative annotation: N/A; putative formula: CH2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.059,"smiles":null,"spectrum_id":"CCMSLIB00017300068","spectrum_index":42249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 130.0781 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017300071","spectrum_index":42250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 124.04 Da; putative annotation: N/A; putative formula: C4H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.105,"smiles":null,"spectrum_id":"CCMSLIB00017300073","spectrum_index":42251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 416.1532 Da; putative annotation: N/A; putative formula: C21H20N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.256,"smiles":null,"spectrum_id":"CCMSLIB00017300075","spectrum_index":42252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 44.0839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.191,"smiles":null,"spectrum_id":"CCMSLIB00017300078","spectrum_index":42253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 713.4567 Da; putative annotation: N/A; putative formula: C48H55N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.527,"smiles":null,"spectrum_id":"CCMSLIB00017300081","spectrum_index":42254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-glutamic acid (delta mass: 37.0307 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.086,"smiles":null,"spectrum_id":"CCMSLIB00017300082","spectrum_index":42255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 127.4348 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.5,"smiles":null,"spectrum_id":"CCMSLIB00017300085","spectrum_index":42256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 779.5335 Da; putative annotation: N/A; putative formula: C47H73NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.594,"smiles":null,"spectrum_id":"CCMSLIB00017300088","spectrum_index":42257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 141.0217 Da; putative annotation: N/A; putative formula: C9H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017300091","spectrum_index":42258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 208.1251 Da; putative annotation: N/A; putative formula: C16H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.196,"smiles":null,"spectrum_id":"CCMSLIB00017300093","spectrum_index":42259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 201.1157 Da; putative annotation: N/A; putative formula: C6H15N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.244,"smiles":null,"spectrum_id":"CCMSLIB00017300096","spectrum_index":42260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 59.0373 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.264,"smiles":null,"spectrum_id":"CCMSLIB00017300098","spectrum_index":42261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl .alpha.-D-mannopyranoside (delta mass: 77.0437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.13,"smiles":null,"spectrum_id":"CCMSLIB00017300101","spectrum_index":42262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 296.2636 Da; putative annotation: N/A; putative formula: C19H37P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.298,"smiles":null,"spectrum_id":"CCMSLIB00017300104","spectrum_index":42263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 254.0794 Da; putative annotation: N/A; putative formula: C12H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.16,"smiles":null,"spectrum_id":"CCMSLIB00017300106","spectrum_index":42264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 243.1835 Da; putative annotation: N/A; putative formula: C13H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.243,"smiles":null,"spectrum_id":"CCMSLIB00017300108","spectrum_index":42265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 260.1377 Da; putative annotation: N/A; putative formula: C13H27O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.234,"smiles":null,"spectrum_id":"CCMSLIB00017300111","spectrum_index":42266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 176.0318 Da; putative annotation: N/A; putative formula: C6H8O6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.113,"smiles":null,"spectrum_id":"CCMSLIB00017300114","spectrum_index":42267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE10; MS2Dec (delta mass: 213.0588 Da; putative annotation: N/A; putative formula: C8H13N3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.14,"smiles":null,"spectrum_id":"CCMSLIB00017300115","spectrum_index":42268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140306 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 48.9036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017300118","spectrum_index":42269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Acetylserine (delta mass: 56.0266 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017300121","spectrum_index":42270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 145.1081 Da; putative annotation: N/A; putative formula: C3H11N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.288,"smiles":null,"spectrum_id":"CCMSLIB00017300124","spectrum_index":42271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 110.0466 Da; putative annotation: N/A; putative formula: CH2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.223,"smiles":null,"spectrum_id":"CCMSLIB00017300125","spectrum_index":42272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 52.0297 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.074,"smiles":null,"spectrum_id":"CCMSLIB00017300128","spectrum_index":42273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 30.9943 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.081,"smiles":null,"spectrum_id":"CCMSLIB00017300131","spectrum_index":42274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 46.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.15,"smiles":null,"spectrum_id":"CCMSLIB00017300134","spectrum_index":42275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 114.1375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.172,"smiles":null,"spectrum_id":"CCMSLIB00017300136","spectrum_index":42276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 28.041 Da; putative annotation: N/A; putative formula: CH4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.143,"smiles":null,"spectrum_id":"CCMSLIB00017300138","spectrum_index":42277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 49.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.305,"smiles":null,"spectrum_id":"CCMSLIB00017300141","spectrum_index":42278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 65.0477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.181,"smiles":null,"spectrum_id":"CCMSLIB00017300144","spectrum_index":42279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-Lys (delta mass: 228.1103 Da; putative annotation: N/A; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.26,"smiles":null,"spectrum_id":"CCMSLIB00017300146","spectrum_index":42280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 162.9676 Da; putative annotation: N/A; putative formula: C4H6NPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.091,"smiles":null,"spectrum_id":"CCMSLIB00017300148","spectrum_index":42281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 248.199 Da; putative annotation: N/A; putative formula: C14H24N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.301,"smiles":null,"spectrum_id":"CCMSLIB00017300151","spectrum_index":42282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 102.0466 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017300154","spectrum_index":42283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 133.0016 Da; putative annotation: N/A; putative formula: C4H7NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.052,"smiles":null,"spectrum_id":"CCMSLIB00017300155","spectrum_index":42284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 312.0608 Da; putative annotation: N/A; putative formula: C21H12OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.121,"smiles":null,"spectrum_id":"CCMSLIB00017300158","spectrum_index":42285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.076,"smiles":null,"spectrum_id":"CCMSLIB00017300161","spectrum_index":42286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 38.0112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.098,"smiles":null,"spectrum_id":"CCMSLIB00017300164","spectrum_index":42287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 361.1825 Da; putative annotation: N/A; putative formula: C19H27N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":722.347,"smiles":null,"spectrum_id":"CCMSLIB00017300166","spectrum_index":42288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 200.1458 Da; putative annotation: N/A; putative formula: C9H20N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.211,"smiles":null,"spectrum_id":"CCMSLIB00017300168","spectrum_index":42289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT106523 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole|2-(4-methyl-1,3-thiazol-5-yl)ethanol (delta mass: 12.065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.113,"smiles":null,"spectrum_id":"CCMSLIB00017300171","spectrum_index":42290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-isothiocyanato-1H-indole-2-carboxylate (delta mass: 131.0664 Da; putative annotation: N/A; putative formula: C4H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.12,"smiles":null,"spectrum_id":"CCMSLIB00017300174","spectrum_index":42291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 16.0349 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.21,"smiles":null,"spectrum_id":"CCMSLIB00017300175","spectrum_index":42292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 163.0629 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.233,"smiles":null,"spectrum_id":"CCMSLIB00017300178","spectrum_index":42293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 245.0036 Da; putative annotation: N/A; putative formula: C7H10N3OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.157,"smiles":null,"spectrum_id":"CCMSLIB00017300181","spectrum_index":42294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 87.0573 Da; putative annotation: N/A; putative formula: CH5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.154,"smiles":null,"spectrum_id":"CCMSLIB00017300184","spectrum_index":42295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 230.1034 Da; putative annotation: N/A; putative formula: C9H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.165,"smiles":null,"spectrum_id":"CCMSLIB00017300186","spectrum_index":42296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 113.0799 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.249,"smiles":null,"spectrum_id":"CCMSLIB00017300188","spectrum_index":42297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxytryptamine (delta mass: 146.0821 Da; putative annotation: N/A; putative formula: C4H10N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.2,"smiles":null,"spectrum_id":"CCMSLIB00017300191","spectrum_index":42298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 92.1186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.257,"smiles":null,"spectrum_id":"CCMSLIB00017300193","spectrum_index":42299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 48.0384 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.088,"smiles":null,"spectrum_id":"CCMSLIB00017300195","spectrum_index":42300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 106.0425 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.16,"smiles":null,"spectrum_id":"CCMSLIB00017300198","spectrum_index":42301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Benzyl-2-methyl-1H-indol-3-yl)acetohydrazide (delta mass: 41.9972 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.157,"smiles":null,"spectrum_id":"CCMSLIB00017300201","spectrum_index":42302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 306.0955 Da; putative annotation: N/A; putative formula: C15H19N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.214,"smiles":null,"spectrum_id":"CCMSLIB00017300204","spectrum_index":42303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 135.0322 Da; putative annotation: N/A; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.156,"smiles":null,"spectrum_id":"CCMSLIB00017300205","spectrum_index":42304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU160208 Oxycodone|(4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one (delta mass: 33.0462 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.201,"smiles":null,"spectrum_id":"CCMSLIB00017300208","spectrum_index":42305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Tyr (delta mass: 113.0839 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.197,"smiles":null,"spectrum_id":"CCMSLIB00017300211","spectrum_index":42306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 16.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.186,"smiles":null,"spectrum_id":"CCMSLIB00017300213","spectrum_index":42307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 17.834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.952,"smiles":null,"spectrum_id":"CCMSLIB00017300216","spectrum_index":42308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7S,7aR)-N-Methylhexahydro-1H-1,6-epoxypyrrolizin-7-amine (delta mass: 53.0347 Da; putative annotation: N/A; putative formula: C2H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.153,"smiles":null,"spectrum_id":"CCMSLIB00017300218","spectrum_index":42309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 92.0835 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.18,"smiles":null,"spectrum_id":"CCMSLIB00017300221","spectrum_index":42310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 151.0996 Da; putative annotation: N/A; putative formula: C9H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.196,"smiles":null,"spectrum_id":"CCMSLIB00017300224","spectrum_index":42311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 403.1477 Da; putative annotation: N/A; putative formula: C15H13N15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.261,"smiles":null,"spectrum_id":"CCMSLIB00017300226","spectrum_index":42312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 503.1852 Da; putative annotation: N/A; putative formula: C24H25N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.309,"smiles":null,"spectrum_id":"CCMSLIB00017300229","spectrum_index":42313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 116.0471 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.16,"smiles":null,"spectrum_id":"CCMSLIB00017300231","spectrum_index":42314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 158.0153 Da; putative annotation: N/A; putative formula: C5H6N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.164,"smiles":null,"spectrum_id":"CCMSLIB00017300234","spectrum_index":42315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S)-4-Amino-5-hydroxypentanoic acid (delta mass: 71.0046 Da; putative annotation: N/A; putative formula: CH2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017300237","spectrum_index":42316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 162.0418 Da; putative annotation: N/A; putative formula: C2H7N6OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.144,"smiles":null,"spectrum_id":"CCMSLIB00017300240","spectrum_index":42317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ310301 Warfarin|2-hydroxy-3-(3-oxo-1-phenylbutyl)chromen-4-one|Coumafen (delta mass: 152.1263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.238,"smiles":null,"spectrum_id":"CCMSLIB00017300242","spectrum_index":42318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentaethylenehexamine (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.313,"smiles":null,"spectrum_id":"CCMSLIB00017300244","spectrum_index":42319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 167.0925 Da; putative annotation: N/A; putative formula: C5H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.206,"smiles":null,"spectrum_id":"CCMSLIB00017300247","spectrum_index":42320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 55.0285 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.125,"smiles":null,"spectrum_id":"CCMSLIB00017300250","spectrum_index":42321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 192.0792 Da; putative annotation: N/A; putative formula: C11H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.223,"smiles":null,"spectrum_id":"CCMSLIB00017300252","spectrum_index":42322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharmine (delta mass: 365.1916 Da; putative annotation: N/A; putative formula: C16H28N7O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.325,"smiles":null,"spectrum_id":"CCMSLIB00017300254","spectrum_index":42323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 338.2602 Da; putative annotation: N/A; putative formula: C18H35N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.346,"smiles":null,"spectrum_id":"CCMSLIB00017300257","spectrum_index":42324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 176.9501 Da; putative annotation: N/A; putative formula: C2HN3O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.03,"smiles":null,"spectrum_id":"CCMSLIB00017300260","spectrum_index":42325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 164.0229 Da; putative annotation: N/A; putative formula: C7H4N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.109,"smiles":null,"spectrum_id":"CCMSLIB00017300263","spectrum_index":42326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoroindole-2-carboxylic acid (delta mass: 134.0393 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.085,"smiles":null,"spectrum_id":"CCMSLIB00017300264","spectrum_index":42327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 28.0314 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.123,"smiles":null,"spectrum_id":"CCMSLIB00017300267","spectrum_index":42328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 106.0987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.252,"smiles":null,"spectrum_id":"CCMSLIB00017300270","spectrum_index":42329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 250.231 Da; putative annotation: N/A; putative formula: C17H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.339,"smiles":null,"spectrum_id":"CCMSLIB00017300272","spectrum_index":42330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 79.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017300275","spectrum_index":42331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 942.4468 Da; putative annotation: N/A; putative formula: C60H58N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1149.53,"smiles":null,"spectrum_id":"CCMSLIB00017300277","spectrum_index":42332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 108.0896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.243,"smiles":null,"spectrum_id":"CCMSLIB00017300280","spectrum_index":42333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Aminobutyl)hydroxylamine (delta mass: 273.2196 Da; putative annotation: N/A; putative formula: C17H27N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.322,"smiles":null,"spectrum_id":"CCMSLIB00017300283","spectrum_index":42334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 19.0123 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.14,"smiles":null,"spectrum_id":"CCMSLIB00017300286","spectrum_index":42335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 278.2092 Da; putative annotation: N/A; putative formula: C11H22N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.269,"smiles":null,"spectrum_id":"CCMSLIB00017300287","spectrum_index":42336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 65.0264 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017300290","spectrum_index":42337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 258.0915 Da; putative annotation: N/A; putative formula: C14H15N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.193,"smiles":null,"spectrum_id":"CCMSLIB00017300293","spectrum_index":42338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-ethanamine, .alpha.-methyl-5-(2-thienylmethoxy)- (delta mass: 35.0437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.165,"smiles":null,"spectrum_id":"CCMSLIB00017300294","spectrum_index":42339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methoxytyramine (delta mass: 316.1515 Da; putative annotation: N/A; putative formula: C19H26P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.253,"smiles":null,"spectrum_id":"CCMSLIB00017300297","spectrum_index":42340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 9.9842 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.044,"smiles":null,"spectrum_id":"CCMSLIB00017300300","spectrum_index":42341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 19.017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.14,"smiles":null,"spectrum_id":"CCMSLIB00017300303","spectrum_index":42342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 51.0478 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.134,"smiles":null,"spectrum_id":"CCMSLIB00017300304","spectrum_index":42343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 42.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.181,"smiles":null,"spectrum_id":"CCMSLIB00017300307","spectrum_index":42344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 101.0808 Da; putative annotation: N/A; putative formula: CH7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017300310","spectrum_index":42345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Glutathione, reduced (delta mass: 162.0526 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.144,"smiles":null,"spectrum_id":"CCMSLIB00017300313","spectrum_index":42346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 39.0668 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.137,"smiles":null,"spectrum_id":"CCMSLIB00017300315","spectrum_index":42347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 71.0372 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.139,"smiles":null,"spectrum_id":"CCMSLIB00017300317","spectrum_index":42348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-3,4,5-trimethyl-4,5,8,10,12,13,13a,13b-octahydro-2H-[1,6]dioxacycloundecino[2,3,4-gh]pyrrolizine-2,6(3H)-dione (delta mass: 79.0527 Da; putative annotation: N/A; putative formula: C4H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.212,"smiles":null,"spectrum_id":"CCMSLIB00017300320","spectrum_index":42349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 45.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.16,"smiles":null,"spectrum_id":"CCMSLIB00017300323","spectrum_index":42350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 160.095 Da; putative annotation: N/A; putative formula: C5H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.156,"smiles":null,"spectrum_id":"CCMSLIB00017300325","spectrum_index":42351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 680.4027 Da; putative annotation: N/A; putative formula: C33H57N6O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.489,"smiles":null,"spectrum_id":"CCMSLIB00017300328","spectrum_index":42352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 157.1202 Da; putative annotation: N/A; putative formula: C3H11N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.201,"smiles":null,"spectrum_id":"CCMSLIB00017300331","spectrum_index":42353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 184.0391 Da; putative annotation: N/A; putative formula: C9H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1013.32,"smiles":null,"spectrum_id":"CCMSLIB00017300333","spectrum_index":42354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 218.0547 Da; putative annotation: N/A; putative formula: C8H14N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.146,"smiles":null,"spectrum_id":"CCMSLIB00017300336","spectrum_index":42355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylpyridine-4-carboxylic acid (delta mass: 41.9401 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.99,"smiles":null,"spectrum_id":"CCMSLIB00017300339","spectrum_index":42356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 322.2037 Da; putative annotation: N/A; putative formula: C13H30N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.29,"smiles":null,"spectrum_id":"CCMSLIB00017300342","spectrum_index":42357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.181,"smiles":null,"spectrum_id":"CCMSLIB00017300345","spectrum_index":42358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 89.1014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.123,"smiles":null,"spectrum_id":"CCMSLIB00017300347","spectrum_index":42359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 108.0216 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.15,"smiles":null,"spectrum_id":"CCMSLIB00017300350","spectrum_index":42360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 123.0992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.201,"smiles":null,"spectrum_id":"CCMSLIB00017300353","spectrum_index":42361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimifugin (delta mass: 116.0452 Da; putative annotation: N/A; putative formula: CH4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.163,"smiles":null,"spectrum_id":"CCMSLIB00017300356","spectrum_index":42362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 61.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.145,"smiles":null,"spectrum_id":"CCMSLIB00017300359","spectrum_index":42363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 242.1279 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.283,"smiles":null,"spectrum_id":"CCMSLIB00017300361","spectrum_index":42364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 214.0644 Da; putative annotation: N/A; putative formula: C8H8F2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.125,"smiles":null,"spectrum_id":"CCMSLIB00017300363","spectrum_index":42365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 338.0872 Da; putative annotation: N/A; putative formula: C14H18N4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.184,"smiles":null,"spectrum_id":"CCMSLIB00017300366","spectrum_index":42366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 17.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.175,"smiles":null,"spectrum_id":"CCMSLIB00017300369","spectrum_index":42367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 78.0317 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.175,"smiles":null,"spectrum_id":"CCMSLIB00017300372","spectrum_index":42368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 51.0537 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017300373","spectrum_index":42369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 64.0678 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.123,"smiles":null,"spectrum_id":"CCMSLIB00017300376","spectrum_index":42370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 118.0994 Da; putative annotation: N/A; putative formula: C2H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017300379","spectrum_index":42371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C16:1 (delta mass: 83.0745 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.454,"smiles":null,"spectrum_id":"CCMSLIB00017300381","spectrum_index":42372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 131.0772 Da; putative annotation: N/A; putative formula: C6H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.153,"smiles":null,"spectrum_id":"CCMSLIB00017300384","spectrum_index":42373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-amino-3-hydroxynonanoic acid CollisionEnergy:102040 (delta mass: 55.0562 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017300386","spectrum_index":42374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 572.0422 Da; putative annotation: N/A; putative formula: C22H16N6O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.165,"smiles":null,"spectrum_id":"CCMSLIB00017300389","spectrum_index":42375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 124.0425 Da; putative annotation: N/A; putative formula: C9H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.142,"smiles":null,"spectrum_id":"CCMSLIB00017300392","spectrum_index":42376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 113.0689 Da; putative annotation: N/A; putative formula: C3H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.233,"smiles":null,"spectrum_id":"CCMSLIB00017300395","spectrum_index":42377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000876942-01!5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenylheptan-3-one (delta mass: 144.0638 Da; putative annotation: N/A; putative formula: C4H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.238,"smiles":null,"spectrum_id":"CCMSLIB00017300397","spectrum_index":42378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Pro (delta mass: 97.0533 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.182,"smiles":null,"spectrum_id":"CCMSLIB00017300399","spectrum_index":42379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 131.0405 Da; putative annotation: Massbank:CE000444 Methionine; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.111,"smiles":null,"spectrum_id":"CCMSLIB00017300402","spectrum_index":42380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 214.0623 Da; putative annotation: Kifunensine; putative formula: C8H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.122,"smiles":null,"spectrum_id":"CCMSLIB00017300405","spectrum_index":42381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Phe (delta mass: 97.0519 Da; putative annotation: PROLINE; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.191,"smiles":null,"spectrum_id":"CCMSLIB00017300406","spectrum_index":42382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 249.0581 Da; putative annotation: N/A; putative formula: C4H3N13O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.182,"smiles":null,"spectrum_id":"CCMSLIB00017300409","spectrum_index":42383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 175.1194 Da; putative annotation: N/A; putative formula: C8H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.289,"smiles":null,"spectrum_id":"CCMSLIB00017300412","spectrum_index":42384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.096,"smiles":null,"spectrum_id":"CCMSLIB00017300415","spectrum_index":42385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 207.0525 Da; putative annotation: N/A; putative formula: C4H10N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.1,"smiles":null,"spectrum_id":"CCMSLIB00017300416","spectrum_index":42386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 547.0588 Da; putative annotation: N/A; putative formula: C20H17N7O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.156,"smiles":null,"spectrum_id":"CCMSLIB00017300419","spectrum_index":42387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cordycepin (delta mass: 221.0897 Da; putative annotation: N/A; putative formula: C8H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.199,"smiles":null,"spectrum_id":"CCMSLIB00017300422","spectrum_index":42388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 64.0672 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.138,"smiles":null,"spectrum_id":"CCMSLIB00017300425","spectrum_index":42389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 98.069 Da; putative annotation: N/A; putative formula: C2H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.16,"smiles":null,"spectrum_id":"CCMSLIB00017300426","spectrum_index":42390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 173.084 Da; putative annotation: N/A; putative formula: C11H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.186,"smiles":null,"spectrum_id":"CCMSLIB00017300429","spectrum_index":42391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 149.0776 Da; putative annotation: N/A; putative formula: C9H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.201,"smiles":null,"spectrum_id":"CCMSLIB00017300432","spectrum_index":42392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 114.0709 Da; putative annotation: N/A; putative formula: C5H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.235,"smiles":null,"spectrum_id":"CCMSLIB00017300433","spectrum_index":42393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 140.1021 Da; putative annotation: N/A; putative formula: C9H16O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.174,"smiles":null,"spectrum_id":"CCMSLIB00017300436","spectrum_index":42394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-tyrosine (delta mass: 171.1622 Da; putative annotation: N/A; putative formula: C10H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.254,"smiles":null,"spectrum_id":"CCMSLIB00017300439","spectrum_index":42395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methoxytyramine (delta mass: 406.1943 Da; putative annotation: N/A; putative formula: C19H35O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.296,"smiles":null,"spectrum_id":"CCMSLIB00017300442","spectrum_index":42396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 106.027 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.113,"smiles":null,"spectrum_id":"CCMSLIB00017300444","spectrum_index":42397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 52.4036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.5,"smiles":null,"spectrum_id":"CCMSLIB00017300447","spectrum_index":42398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 132.0786 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.201,"smiles":null,"spectrum_id":"CCMSLIB00017300449","spectrum_index":42399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 244.0878 Da; putative annotation: N/A; putative formula: C12H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.242,"smiles":null,"spectrum_id":"CCMSLIB00017300452","spectrum_index":42400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 146.0216 Da; putative annotation: N/A; putative formula: C5H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.056,"smiles":null,"spectrum_id":"CCMSLIB00017300454","spectrum_index":42401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 265.2476 Da; putative annotation: N/A; putative formula: C16H31N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.313,"smiles":null,"spectrum_id":"CCMSLIB00017300457","spectrum_index":42402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 106.0384 Da; putative annotation: N/A; putative formula: C2H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.119,"smiles":null,"spectrum_id":"CCMSLIB00017300460","spectrum_index":42403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 220.1257 Da; putative annotation: N/A; putative formula: C17H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.201,"smiles":null,"spectrum_id":"CCMSLIB00017300463","spectrum_index":42404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 144.0932 Da; putative annotation: N/A; putative formula: C11H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.32,"smiles":null,"spectrum_id":"CCMSLIB00017300464","spectrum_index":42405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 104.0588 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.118,"smiles":null,"spectrum_id":"CCMSLIB00017300467","spectrum_index":42406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 34.0421 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017300470","spectrum_index":42407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Indolinone (delta mass: 16.0674 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.127,"smiles":null,"spectrum_id":"CCMSLIB00017300473","spectrum_index":42408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 104.0298 Da; putative annotation: N/A; putative formula: C4H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.132,"smiles":null,"spectrum_id":"CCMSLIB00017300474","spectrum_index":42409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 178.0641 Da; putative annotation: N/A; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.135,"smiles":null,"spectrum_id":"CCMSLIB00017300477","spectrum_index":42410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methoxytyramine (delta mass: 87.0689 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.171,"smiles":null,"spectrum_id":"CCMSLIB00017300480","spectrum_index":42411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-o-Tyrosine (delta mass: 173.0677 Da; putative annotation: N/A; putative formula: C7H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.149,"smiles":null,"spectrum_id":"CCMSLIB00017300483","spectrum_index":42412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 149.0464 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.107,"smiles":null,"spectrum_id":"CCMSLIB00017300484","spectrum_index":42413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 45.0556 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.167,"smiles":null,"spectrum_id":"CCMSLIB00017300487","spectrum_index":42414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 185.0296 Da; putative annotation: N/A; putative formula: C3H3N7O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.095,"smiles":null,"spectrum_id":"CCMSLIB00017300490","spectrum_index":42415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 101.047 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.107,"smiles":null,"spectrum_id":"CCMSLIB00017300491","spectrum_index":42416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 261.1137 Da; putative annotation: N/A; putative formula: C12H24NO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.29,"smiles":null,"spectrum_id":"CCMSLIB00017300494","spectrum_index":42417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 229.133 Da; putative annotation: N/A; putative formula: C12H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.209,"smiles":null,"spectrum_id":"CCMSLIB00017300497","spectrum_index":42418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 425.1825 Da; putative annotation: N/A; putative formula: C21H19N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.279,"smiles":null,"spectrum_id":"CCMSLIB00017300500","spectrum_index":42419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 92.0526 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.227,"smiles":null,"spectrum_id":"CCMSLIB00017300501","spectrum_index":42420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 50.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.097,"smiles":null,"spectrum_id":"CCMSLIB00017300504","spectrum_index":42421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 107.0384 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.146,"smiles":null,"spectrum_id":"CCMSLIB00017300507","spectrum_index":42422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-Hydroxynonenal from NIST14 (delta mass: 179.0797 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.202,"smiles":null,"spectrum_id":"CCMSLIB00017300510","spectrum_index":42423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z)-3-(4-hydroxyphenyl)-N-[4-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]butyl]prop-2-enamide (delta mass: 233.1056 Da; putative annotation: N/A; putative formula: C6H15N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.286,"smiles":null,"spectrum_id":"CCMSLIB00017300511","spectrum_index":42424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 111.0462 Da; putative annotation: N/A; putative formula: C9H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.148,"smiles":null,"spectrum_id":"CCMSLIB00017300514","spectrum_index":42425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 162.0521 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.128,"smiles":null,"spectrum_id":"CCMSLIB00017300517","spectrum_index":42426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 190.0304 Da; putative annotation: N/A; putative formula: C8H14O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.101,"smiles":null,"spectrum_id":"CCMSLIB00017300519","spectrum_index":42427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 168.1335 Da; putative annotation: N/A; putative formula: C11H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.182,"smiles":null,"spectrum_id":"CCMSLIB00017300522","spectrum_index":42428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 174.0679 Da; putative annotation: N/A; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.144,"smiles":null,"spectrum_id":"CCMSLIB00017300525","spectrum_index":42429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 16.0384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.098,"smiles":null,"spectrum_id":"CCMSLIB00017300528","spectrum_index":42430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 445.1867 Da; putative annotation: N/A; putative formula: C20H32NO8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.284,"smiles":null,"spectrum_id":"CCMSLIB00017300529","spectrum_index":42431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 149.0838 Da; putative annotation: N/A; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.165,"smiles":null,"spectrum_id":"CCMSLIB00017300532","spectrum_index":42432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 87.0292 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.11,"smiles":null,"spectrum_id":"CCMSLIB00017300535","spectrum_index":42433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 11.9946 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.081,"smiles":null,"spectrum_id":"CCMSLIB00017300538","spectrum_index":42434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.118,"smiles":null,"spectrum_id":"CCMSLIB00017300540","spectrum_index":42435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 141.0795 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.155,"smiles":null,"spectrum_id":"CCMSLIB00017300542","spectrum_index":42436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 84.058 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.212,"smiles":null,"spectrum_id":"CCMSLIB00017300546","spectrum_index":42437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 396.1846 Da; putative annotation: N/A; putative formula: C19H24N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.323,"smiles":null,"spectrum_id":"CCMSLIB00017300549","spectrum_index":42438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 258.1013 Da; putative annotation: N/A; putative formula: C7H14N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.256,"smiles":null,"spectrum_id":"CCMSLIB00017300551","spectrum_index":42439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 60.0616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.185,"smiles":null,"spectrum_id":"CCMSLIB00017300554","spectrum_index":42440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 77.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.191,"smiles":null,"spectrum_id":"CCMSLIB00017300557","spectrum_index":42441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET020002 CLE_291.1026_12.2|Clensiopenterol|1-(4-amino-3,5-dichlorophenyl)-2-(3-methylbutylamino)ethanol (delta mass: 32.0099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.112,"smiles":null,"spectrum_id":"CCMSLIB00017300558","spectrum_index":42442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 397.195 Da; putative annotation: N/A; putative formula: C16H31NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.318,"smiles":null,"spectrum_id":"CCMSLIB00017300561","spectrum_index":42443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 69.047 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017300564","spectrum_index":42444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 29.0131 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.078,"smiles":null,"spectrum_id":"CCMSLIB00017300566","spectrum_index":42445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 42.0289 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.117,"smiles":null,"spectrum_id":"CCMSLIB00017300569","spectrum_index":42446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 317.1407 Da; putative annotation: N/A; putative formula: C13H23N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.227,"smiles":null,"spectrum_id":"CCMSLIB00017300572","spectrum_index":42447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 664.5968 Da; putative annotation: N/A; putative formula: C49H76)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.668,"smiles":null,"spectrum_id":"CCMSLIB00017300575","spectrum_index":42448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 197.1055 Da; putative annotation: N/A; putative formula: C10H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.192,"smiles":null,"spectrum_id":"CCMSLIB00017300577","spectrum_index":42449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 40.0 eV (delta mass: 39.9937 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.069,"smiles":null,"spectrum_id":"CCMSLIB00017300580","spectrum_index":42450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 683.248 Da; putative annotation: N/A; putative formula: C29H51NO9P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.308,"smiles":null,"spectrum_id":"CCMSLIB00017300582","spectrum_index":42451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 59.0371 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.128,"smiles":null,"spectrum_id":"CCMSLIB00017300584","spectrum_index":42452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 379.9137 Da; putative annotation: N/A; putative formula: C15H8O2S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.0,"smiles":null,"spectrum_id":"CCMSLIB00017300587","spectrum_index":42453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 248.1062 Da; putative annotation: N/A; putative formula: C15H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.171,"smiles":null,"spectrum_id":"CCMSLIB00017300590","spectrum_index":42454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 101.0473 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017300591","spectrum_index":42455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 29.0043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.079,"smiles":null,"spectrum_id":"CCMSLIB00017300594","spectrum_index":42456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 674.3664 Da; putative annotation: N/A; putative formula: C37H54O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.453,"smiles":null,"spectrum_id":"CCMSLIB00017300597","spectrum_index":42457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 676.3824 Da; putative annotation: N/A; putative formula: C37H56O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.469,"smiles":null,"spectrum_id":"CCMSLIB00017300598","spectrum_index":42458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 218.2116 Da; putative annotation: N/A; putative formula: C15H26N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.311,"smiles":null,"spectrum_id":"CCMSLIB00017300601","spectrum_index":42459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00938 Curcumin (delta mass: 4.3667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.5,"smiles":null,"spectrum_id":"CCMSLIB00017300604","spectrum_index":42460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthioamphetamine (delta mass: 74.0548 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.191,"smiles":null,"spectrum_id":"CCMSLIB00017300605","spectrum_index":42461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 810.4409 Da; putative annotation: N/A; putative formula: C56H54N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1017.53,"smiles":null,"spectrum_id":"CCMSLIB00017300608","spectrum_index":42462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 74.0022 Da; putative annotation: N/A; putative formula: C3H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.063,"smiles":null,"spectrum_id":"CCMSLIB00017300610","spectrum_index":42463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 317.1563 Da; putative annotation: N/A; putative formula: C17H23N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.285,"smiles":null,"spectrum_id":"CCMSLIB00017300612","spectrum_index":42464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 629.2792 Da; putative annotation: N/A; putative formula: C41H35N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.32,"smiles":null,"spectrum_id":"CCMSLIB00017300615","spectrum_index":42465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 156.1523 Da; putative annotation: N/A; putative formula: C10H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.249,"smiles":null,"spectrum_id":"CCMSLIB00017300618","spectrum_index":42466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 185.0551 Da; putative annotation: N/A; putative formula: C5H7N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.12,"smiles":null,"spectrum_id":"CCMSLIB00017300620","spectrum_index":42467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 91.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.217,"smiles":null,"spectrum_id":"CCMSLIB00017300622","spectrum_index":42468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 253.1692 Da; putative annotation: N/A; putative formula: C15H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.261,"smiles":null,"spectrum_id":"CCMSLIB00017300625","spectrum_index":42469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 516.1633 Da; putative annotation: N/A; putative formula: C31H26N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.223,"smiles":null,"spectrum_id":"CCMSLIB00017300628","spectrum_index":42470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 119.0445 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.23,"smiles":null,"spectrum_id":"CCMSLIB00017300629","spectrum_index":42471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 118.9791 Da; putative annotation: N/A; putative formula: CHN3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.128,"smiles":null,"spectrum_id":"CCMSLIB00017300632","spectrum_index":42472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 14.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.273,"smiles":null,"spectrum_id":"CCMSLIB00017300635","spectrum_index":42473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 476.2404 Da; putative annotation: N/A; putative formula: C20H37N4O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.306,"smiles":null,"spectrum_id":"CCMSLIB00017300636","spectrum_index":42474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 241.2497 Da; putative annotation: N/A; putative formula: C14H31N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.347,"smiles":null,"spectrum_id":"CCMSLIB00017300639","spectrum_index":42475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 143.0826 Da; putative annotation: N/A; putative formula: C4H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.205,"smiles":null,"spectrum_id":"CCMSLIB00017300642","spectrum_index":42476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 754.1578 Da; putative annotation: N/A; putative formula: C37H38O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":964.307,"smiles":null,"spectrum_id":"CCMSLIB00017300644","spectrum_index":42477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 162.0448 Da; putative annotation: N/A; putative formula: C6H11O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.204,"smiles":null,"spectrum_id":"CCMSLIB00017300646","spectrum_index":42478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 162.1101 Da; putative annotation: N/A; putative formula: CH10N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.248,"smiles":null,"spectrum_id":"CCMSLIB00017300649","spectrum_index":42479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 59.016 Da; putative annotation: N/A; putative formula: C5HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.139,"smiles":null,"spectrum_id":"CCMSLIB00017300651","spectrum_index":42480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 398.1622 Da; putative annotation: N/A; putative formula: C27H27O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.259,"smiles":null,"spectrum_id":"CCMSLIB00017300653","spectrum_index":42481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 96.0571 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.117,"smiles":null,"spectrum_id":"CCMSLIB00017300656","spectrum_index":42482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 135.1361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.249,"smiles":null,"spectrum_id":"CCMSLIB00017300659","spectrum_index":42483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CLE_291.1026_12.2 (delta mass: 46.1366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.239,"smiles":null,"spectrum_id":"CCMSLIB00017300661","spectrum_index":42484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 519.3357 Da; putative annotation: N/A; putative formula: C34H49NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.412,"smiles":null,"spectrum_id":"CCMSLIB00017300663","spectrum_index":42485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 778.4492 Da; putative annotation: N/A; putative formula: C39H58N10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":985.536,"smiles":null,"spectrum_id":"CCMSLIB00017300666","spectrum_index":42486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1203.5772 Da; putative annotation: N/A; putative formula: C53H81N13O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1396.65,"smiles":null,"spectrum_id":"CCMSLIB00017300669","spectrum_index":42487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 162.0428 Da; putative annotation: N/A; putative formula: C8H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.155,"smiles":null,"spectrum_id":"CCMSLIB00017300671","spectrum_index":42488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 85.0893 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.197,"smiles":null,"spectrum_id":"CCMSLIB00017300673","spectrum_index":42489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 41.0341 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.146,"smiles":null,"spectrum_id":"CCMSLIB00017300676","spectrum_index":42490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 371.2669 Da; putative annotation: N/A; putative formula: C20H37NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.327,"smiles":null,"spectrum_id":"CCMSLIB00017300679","spectrum_index":42491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 336.2756 Da; putative annotation: N/A; putative formula: C16H32N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.334,"smiles":null,"spectrum_id":"CCMSLIB00017300681","spectrum_index":42492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 832.0168 Da; putative annotation: N/A; putative formula: C65H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1054.11,"smiles":null,"spectrum_id":"CCMSLIB00017300683","spectrum_index":42493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1177.4901 Da; putative annotation: N/A; putative formula: C57H75N7O18S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1399.59,"smiles":null,"spectrum_id":"CCMSLIB00017300686","spectrum_index":42494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 93.0577 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.18,"smiles":null,"spectrum_id":"CCMSLIB00017300689","spectrum_index":42495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Thr (delta mass: 336.083 Da; putative annotation: N/A; putative formula: C13H8N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.175,"smiles":null,"spectrum_id":"CCMSLIB00017300690","spectrum_index":42496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 777.6224 Da; putative annotation: N/A; putative formula: C45H83N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":928.682,"smiles":null,"spectrum_id":"CCMSLIB00017300693","spectrum_index":42497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 151.0632 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.165,"smiles":null,"spectrum_id":"CCMSLIB00017300696","spectrum_index":42498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 94.0492 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.13,"smiles":null,"spectrum_id":"CCMSLIB00017300697","spectrum_index":42499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 56.0662 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.118,"smiles":null,"spectrum_id":"CCMSLIB00017300700","spectrum_index":42500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 56.0654 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.131,"smiles":null,"spectrum_id":"CCMSLIB00017300703","spectrum_index":42501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 85.0624 Da; putative annotation: N/A; putative formula: C3H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.207,"smiles":null,"spectrum_id":"CCMSLIB00017300704","spectrum_index":42502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 310.0483 Da; putative annotation: N/A; putative formula: C9H16N2O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.124,"smiles":null,"spectrum_id":"CCMSLIB00017300707","spectrum_index":42503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 103.0271 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.082,"smiles":null,"spectrum_id":"CCMSLIB00017300710","spectrum_index":42504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 209.0893 Da; putative annotation: N/A; putative formula: C11H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.238,"smiles":null,"spectrum_id":"CCMSLIB00017300712","spectrum_index":42505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 86.0368 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.117,"smiles":null,"spectrum_id":"CCMSLIB00017300714","spectrum_index":42506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 246.1252 Da; putative annotation: N/A; putative formula: C15H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.193,"smiles":null,"spectrum_id":"CCMSLIB00017300717","spectrum_index":42507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxybutorphanol (delta mass: 396.2385 Da; putative annotation: N/A; putative formula: C20H28N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.461,"smiles":null,"spectrum_id":"CCMSLIB00017300720","spectrum_index":42508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 279.1847 Da; putative annotation: N/A; putative formula: C17H21N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.255,"smiles":null,"spectrum_id":"CCMSLIB00017300721","spectrum_index":42509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 272.2492 Da; putative annotation: N/A; putative formula: C14H33N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.52,"smiles":null,"spectrum_id":"CCMSLIB00017300724","spectrum_index":42510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (delta mass: 3.3562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.5,"smiles":null,"spectrum_id":"CCMSLIB00017300727","spectrum_index":42511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 162.0542 Da; putative annotation: N/A; putative formula: C7H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.141,"smiles":null,"spectrum_id":"CCMSLIB00017300730","spectrum_index":42512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 46.4196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017300733","spectrum_index":42513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine; LC-tDDA; CE10 (delta mass: 214.0462 Da; putative annotation: N/A; putative formula: C6H2N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.143,"smiles":null,"spectrum_id":"CCMSLIB00017300735","spectrum_index":42514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 78.0315 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.097,"smiles":null,"spectrum_id":"CCMSLIB00017300737","spectrum_index":42515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (2Z)-2-cyano-3-(1H-indol-3-yl)prop-2-enoate (delta mass: 56.026 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.123,"smiles":null,"spectrum_id":"CCMSLIB00017300740","spectrum_index":42516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 92.0472 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.191,"smiles":null,"spectrum_id":"CCMSLIB00017300743","spectrum_index":42517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 26.0224 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.098,"smiles":null,"spectrum_id":"CCMSLIB00017300745","spectrum_index":42518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 69.0583 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017300748","spectrum_index":42519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 75.0208 Da; putative annotation: N/A; putative formula: C4HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.1,"smiles":null,"spectrum_id":"CCMSLIB00017300750","spectrum_index":42520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 111.032 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.097,"smiles":null,"spectrum_id":"CCMSLIB00017300753","spectrum_index":42521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-Methyl-DL-serine (delta mass: 111.0326 Da; putative annotation: D-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.098,"smiles":null,"spectrum_id":"CCMSLIB00017300756","spectrum_index":42522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 272.0678 Da; putative annotation: D-(+)-Catechin - 30.0 eV; putative formula: C15H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.143,"smiles":null,"spectrum_id":"CCMSLIB00017300759","spectrum_index":42523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Val (delta mass: 99.0684 Da; putative annotation: N-Methyl-.alpha.-aminoisobutyric acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.202,"smiles":null,"spectrum_id":"CCMSLIB00017300761","spectrum_index":42524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 107.0365 Da; putative annotation: 5-Hydroxy-2-(hydroxymethyl)pyridine; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.16,"smiles":null,"spectrum_id":"CCMSLIB00017300763","spectrum_index":42525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne Acetate (delta mass: 94.0778 Da; putative annotation: 1,2,3,6-Tetrahydrobenzylalcohol; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.331,"smiles":null,"spectrum_id":"CCMSLIB00017300766","spectrum_index":42526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 222.126 Da; putative annotation: (Z)-2-Oct-7-enylpent-2-enedioic acid; putative formula: C13H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.223,"smiles":null,"spectrum_id":"CCMSLIB00017300769","spectrum_index":42527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-QUINOLINECARBOXYLIC ACID (delta mass: 87.0308 Da; putative annotation: SERINE; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.086,"smiles":null,"spectrum_id":"CCMSLIB00017300772","spectrum_index":42528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 124.016 Da; putative annotation: trans,trans-Muconic acid; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.092,"smiles":null,"spectrum_id":"CCMSLIB00017300773","spectrum_index":42529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 370.2143 Da; putative annotation: 2,4-Dihydroxy-6-(hydroxymethyl)-3-[(6-hydroxy-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl)methyl]benzaldehyde; putative formula: C23H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.29,"smiles":null,"spectrum_id":"CCMSLIB00017300776","spectrum_index":42530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 161.1204 Da; putative annotation: 2-Amino-1-phenyl-1-pentanol; putative formula: C11H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.207,"smiles":null,"spectrum_id":"CCMSLIB00017300779","spectrum_index":42531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 103.0632 Da; putative annotation: Tris(hydroxymethyl)aminomethane; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.123,"smiles":null,"spectrum_id":"CCMSLIB00017300782","spectrum_index":42532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 54.0468 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.133,"smiles":null,"spectrum_id":"CCMSLIB00017300785","spectrum_index":42533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 285.1001 Da; putative annotation: N/A; putative formula: C16H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.176,"smiles":null,"spectrum_id":"CCMSLIB00017300786","spectrum_index":42534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 26.0046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.039,"smiles":null,"spectrum_id":"CCMSLIB00017300789","spectrum_index":42535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Gln-Arg (delta mass: 114.0421 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.263,"smiles":null,"spectrum_id":"CCMSLIB00017300792","spectrum_index":42536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 508.2499 Da; putative annotation: N/A; putative formula: C27H40O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.373,"smiles":null,"spectrum_id":"CCMSLIB00017300795","spectrum_index":42537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 43.9899 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017300797","spectrum_index":42538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 324.1282 Da; putative annotation: N/A; putative formula: C10H20N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.215,"smiles":null,"spectrum_id":"CCMSLIB00017300799","spectrum_index":42539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 278.1973 Da; putative annotation: N/A; putative formula: C12H22N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.294,"smiles":null,"spectrum_id":"CCMSLIB00017300802","spectrum_index":42540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 207.0618 Da; putative annotation: N/A; putative formula: C5H5N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.153,"smiles":null,"spectrum_id":"CCMSLIB00017300805","spectrum_index":42541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300144 Hydroxygardnutine (delta mass: 28.0754 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.246,"smiles":null,"spectrum_id":"CCMSLIB00017300806","spectrum_index":42542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 32.0836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.222,"smiles":null,"spectrum_id":"CCMSLIB00017300809","spectrum_index":42543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R)-4-Methyl-6-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one (delta mass: 462.2912 Da; putative annotation: N/A; putative formula: C28H39N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":849.484,"smiles":null,"spectrum_id":"CCMSLIB00017300812","spectrum_index":42544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 103.1025 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.393,"smiles":null,"spectrum_id":"CCMSLIB00017300814","spectrum_index":42545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 675.269 Da; putative annotation: N/A; putative formula: C38H45NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":841.392,"smiles":null,"spectrum_id":"CCMSLIB00017300817","spectrum_index":42546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 88.0518 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.185,"smiles":null,"spectrum_id":"CCMSLIB00017300819","spectrum_index":42547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 258.0888 Da; putative annotation: N/A; putative formula: C10H14N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.164,"smiles":null,"spectrum_id":"CCMSLIB00017300822","spectrum_index":42548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 218.1157 Da; putative annotation: N/A; putative formula: C10H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.186,"smiles":null,"spectrum_id":"CCMSLIB00017300825","spectrum_index":42549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 523.3045 Da; putative annotation: N/A; putative formula: C30H41N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.401,"smiles":null,"spectrum_id":"CCMSLIB00017300826","spectrum_index":42550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 214.0992 Da; putative annotation: N/A; putative formula: C14H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.154,"smiles":null,"spectrum_id":"CCMSLIB00017300829","spectrum_index":42551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 333.2027 Da; putative annotation: N/A; putative formula: C14H23N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.299,"smiles":null,"spectrum_id":"CCMSLIB00017300832","spectrum_index":42552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.102,"smiles":null,"spectrum_id":"CCMSLIB00017300834","spectrum_index":42553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Asp-Lys (delta mass: 110.0754 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.268,"smiles":null,"spectrum_id":"CCMSLIB00017300836","spectrum_index":42554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 23.0157 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.076,"smiles":null,"spectrum_id":"CCMSLIB00017300839","spectrum_index":42555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 59.0374 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.119,"smiles":null,"spectrum_id":"CCMSLIB00017300842","spectrum_index":42556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(5-fluoropentyl)- (delta mass: 129.0454 Da; putative annotation: N/A; putative formula: C4H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.169,"smiles":null,"spectrum_id":"CCMSLIB00017300845","spectrum_index":42557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 64.0521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017300846","spectrum_index":42558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 185.2148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.28,"smiles":null,"spectrum_id":"CCMSLIB00017300849","spectrum_index":42559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 175.103 Da; putative annotation: N/A; putative formula: C8H17NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.163,"smiles":null,"spectrum_id":"CCMSLIB00017300852","spectrum_index":42560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 208.9316 Da; putative annotation: N/A; putative formula: CH-1N5O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.012,"smiles":null,"spectrum_id":"CCMSLIB00017300855","spectrum_index":42561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 85.0206 Da; putative annotation: N/A; putative formula: C2H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.118,"smiles":null,"spectrum_id":"CCMSLIB00017300857","spectrum_index":42562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Leu (delta mass: 113.0825 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.211,"smiles":null,"spectrum_id":"CCMSLIB00017300859","spectrum_index":42563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 221.0786 Da; putative annotation: N/A; putative formula: C12H16NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.201,"smiles":null,"spectrum_id":"CCMSLIB00017300862","spectrum_index":42564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 141.0576 Da; putative annotation: N/A; putative formula: C10H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.128,"smiles":null,"spectrum_id":"CCMSLIB00017300865","spectrum_index":42565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 16.7245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.795,"smiles":null,"spectrum_id":"CCMSLIB00017300866","spectrum_index":42566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 380.2022 Da; putative annotation: N/A; putative formula: C21H32O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.346,"smiles":null,"spectrum_id":"CCMSLIB00017300869","spectrum_index":42567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 15.0691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.14,"smiles":null,"spectrum_id":"CCMSLIB00017300872","spectrum_index":42568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 121.089 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.175,"smiles":null,"spectrum_id":"CCMSLIB00017300875","spectrum_index":42569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methoxytyramine (delta mass: 45.0504 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.152,"smiles":null,"spectrum_id":"CCMSLIB00017300878","spectrum_index":42570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 70.0423 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.17,"smiles":null,"spectrum_id":"CCMSLIB00017300880","spectrum_index":42571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 179.0919 Da; putative annotation: N/A; putative formula: C6H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.228,"smiles":null,"spectrum_id":"CCMSLIB00017300883","spectrum_index":42572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-nitro-1H-indole-2-carboxylate (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.082,"smiles":null,"spectrum_id":"CCMSLIB00017300886","spectrum_index":42573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ajmaline (delta mass: 65.0482 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.255,"smiles":null,"spectrum_id":"CCMSLIB00017300888","spectrum_index":42574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 113.0265 Da; putative annotation: N/A; putative formula: C8H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.113,"smiles":null,"spectrum_id":"CCMSLIB00017300891","spectrum_index":42575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 154.0109 Da; putative annotation: N/A; putative formula: C3H6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.082,"smiles":null,"spectrum_id":"CCMSLIB00017300894","spectrum_index":42576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 1.9383 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.092,"smiles":null,"spectrum_id":"CCMSLIB00017300896","spectrum_index":42577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 158.0214 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.102,"smiles":null,"spectrum_id":"CCMSLIB00017300899","spectrum_index":42578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(?)-ampicillin - 30.0 eV (delta mass: 43.9894 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.106,"smiles":null,"spectrum_id":"CCMSLIB00017300902","spectrum_index":42579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 54.0554 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.225,"smiles":null,"spectrum_id":"CCMSLIB00017300905","spectrum_index":42580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 50.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017300907","spectrum_index":42581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 16.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.128,"smiles":null,"spectrum_id":"CCMSLIB00017300910","spectrum_index":42582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 120.0456 Da; putative annotation: N/A; putative formula: C3H9N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.085,"smiles":null,"spectrum_id":"CCMSLIB00017300913","spectrum_index":42583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 298.2902 Da; putative annotation: N/A; putative formula: C18H39N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.362,"smiles":null,"spectrum_id":"CCMSLIB00017300916","spectrum_index":42584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 284.271 Da; putative annotation: N/A; putative formula: C18H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.42,"smiles":null,"spectrum_id":"CCMSLIB00017300917","spectrum_index":42585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Leu (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.229,"smiles":null,"spectrum_id":"CCMSLIB00017300920","spectrum_index":42586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 220.1218 Da; putative annotation: N/A; putative formula: C12H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.192,"smiles":null,"spectrum_id":"CCMSLIB00017300923","spectrum_index":42587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 100.0682 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.192,"smiles":null,"spectrum_id":"CCMSLIB00017300926","spectrum_index":42588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:102040\"\" (delta mass: 120.0177 Da; putative annotation: N/A; putative formula: C3H8N2O-1S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.115,"smiles":null,"spectrum_id":"CCMSLIB00017300927","spectrum_index":42589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 40.038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.129,"smiles":null,"spectrum_id":"CCMSLIB00017300930","spectrum_index":42590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 218.1246 Da; putative annotation: N/A; putative formula: C13H18N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.284,"smiles":null,"spectrum_id":"CCMSLIB00017300933","spectrum_index":42591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100147 Indole-3-acetaldehyde (delta mass: 171.1249 Da; putative annotation: N/A; putative formula: C9H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.201,"smiles":null,"spectrum_id":"CCMSLIB00017300936","spectrum_index":42592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 72.0113 Da; putative annotation: N/A; putative formula: C5N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.103,"smiles":null,"spectrum_id":"CCMSLIB00017300937","spectrum_index":42593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 78.0508 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.138,"smiles":null,"spectrum_id":"CCMSLIB00017300940","spectrum_index":42594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 223.4573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.5,"smiles":null,"spectrum_id":"CCMSLIB00017300943","spectrum_index":42595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 46.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.113,"smiles":null,"spectrum_id":"CCMSLIB00017300946","spectrum_index":42596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 101.0156 Da; putative annotation: N/A; putative formula: CH3N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017300948","spectrum_index":42597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 199.1203 Da; putative annotation: N/A; putative formula: C10H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.207,"smiles":null,"spectrum_id":"CCMSLIB00017300950","spectrum_index":42598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 14.9821 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.073,"smiles":null,"spectrum_id":"CCMSLIB00017300953","spectrum_index":42599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 9.8779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.969,"smiles":null,"spectrum_id":"CCMSLIB00017300956","spectrum_index":42600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 300.1868 Da; putative annotation: N/A; putative formula: C17H25N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.31,"smiles":null,"spectrum_id":"CCMSLIB00017300958","spectrum_index":42601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT107850 D-Mannose-6-phosphate mono sodium salt|Man-6P|6-phosphono-D-mannopyranose|[(2R,3S,4S,5S)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl dihydrogen phosphate (delta mass: 381.3253 Da; putative annotation: N/A; putative formula: C24H39N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.362,"smiles":null,"spectrum_id":"CCMSLIB00017300960","spectrum_index":42602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.134,"smiles":null,"spectrum_id":"CCMSLIB00017300963","spectrum_index":42603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 96.0941 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.216,"smiles":null,"spectrum_id":"CCMSLIB00017300966","spectrum_index":42604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 137.0532 Da; putative annotation: N/A; putative formula: CH7N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.165,"smiles":null,"spectrum_id":"CCMSLIB00017300969","spectrum_index":42605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 153.1159 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.187,"smiles":null,"spectrum_id":"CCMSLIB00017300972","spectrum_index":42606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 162.0691 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.218,"smiles":null,"spectrum_id":"CCMSLIB00017300973","spectrum_index":42607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 197.1263 Da; putative annotation: N/A; putative formula: C4H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.28,"smiles":null,"spectrum_id":"CCMSLIB00017300976","spectrum_index":42608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 44.0487 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.109,"smiles":null,"spectrum_id":"CCMSLIB00017300979","spectrum_index":42609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 792.4331 Da; putative annotation: N/A; putative formula: C60H56O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.509,"smiles":null,"spectrum_id":"CCMSLIB00017300982","spectrum_index":42610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reserpic acid (delta mass: 444.1885 Da; putative annotation: N/A; putative formula: C27H30N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":845.396,"smiles":null,"spectrum_id":"CCMSLIB00017300985","spectrum_index":42611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl .alpha.-D-mannopyranoside (delta mass: 341.1324 Da; putative annotation: N/A; putative formula: C12H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.219,"smiles":null,"spectrum_id":"CCMSLIB00017300987","spectrum_index":42612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 119.108 Da; putative annotation: N/A; putative formula: C9H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.173,"smiles":null,"spectrum_id":"CCMSLIB00017300989","spectrum_index":42613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 113.184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.2,"smiles":null,"spectrum_id":"CCMSLIB00017300992","spectrum_index":42614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 69.0579 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.202,"smiles":null,"spectrum_id":"CCMSLIB00017300995","spectrum_index":42615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 493.2459 Da; putative annotation: N/A; putative formula: C21H39N3O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.306,"smiles":null,"spectrum_id":"CCMSLIB00017300998","spectrum_index":42616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 137.0374 Da; putative annotation: N/A; putative formula: CH7N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.191,"smiles":null,"spectrum_id":"CCMSLIB00017300999","spectrum_index":42617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 631.23 Da; putative annotation: N/A; putative formula: C49H29N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1136.41,"smiles":null,"spectrum_id":"CCMSLIB00017301002","spectrum_index":42618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 240.1866 Da; putative annotation: N/A; putative formula: C12H25N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.273,"smiles":null,"spectrum_id":"CCMSLIB00017301005","spectrum_index":42619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 43.0058 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.103,"smiles":null,"spectrum_id":"CCMSLIB00017301007","spectrum_index":42620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 2.9489 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.093,"smiles":null,"spectrum_id":"CCMSLIB00017301009","spectrum_index":42621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Ethyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)acetic acid (delta mass: 72.0297 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.138,"smiles":null,"spectrum_id":"CCMSLIB00017301012","spectrum_index":42622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 59.0291 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.22,"smiles":null,"spectrum_id":"CCMSLIB00017301015","spectrum_index":42623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Hydroxyphenyl)glycine (delta mass: 70.0048 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.07,"smiles":null,"spectrum_id":"CCMSLIB00017301018","spectrum_index":42624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 17.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.144,"smiles":null,"spectrum_id":"CCMSLIB00017301020","spectrum_index":42625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Amino-4,4-dimethylpentanoic acid (delta mass: 71.0373 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.155,"smiles":null,"spectrum_id":"CCMSLIB00017301022","spectrum_index":42626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 256.0819 Da; putative annotation: N/A; putative formula: C10H8N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.184,"smiles":null,"spectrum_id":"CCMSLIB00017301025","spectrum_index":42627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 136.0497 Da; putative annotation: N/A; putative formula: C4H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.209,"smiles":null,"spectrum_id":"CCMSLIB00017301028","spectrum_index":42628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 70.0572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.107,"smiles":null,"spectrum_id":"CCMSLIB00017301030","spectrum_index":42629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 665.2464 Da; putative annotation: N/A; putative formula: C48H31N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1170.42,"smiles":null,"spectrum_id":"CCMSLIB00017301033","spectrum_index":42630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-(5-ethyl(1,3,4-thiadiazol-2-yl))-2-(2-1,2,3,4-tetrahydroisoquinolyl)acetamid e CollisionEnergy:205060\"\" (delta mass: 119.0652 Da; putative annotation: N/A; putative formula: C3H10N3P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.193,"smiles":null,"spectrum_id":"CCMSLIB00017301036","spectrum_index":42631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 480.2705 Da; putative annotation: N/A; putative formula: C23H40N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.409,"smiles":null,"spectrum_id":"CCMSLIB00017301039","spectrum_index":42632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 174.162 Da; putative annotation: N/A; putative formula: C6H18N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.311,"smiles":null,"spectrum_id":"CCMSLIB00017301040","spectrum_index":42633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 119.1212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.153,"smiles":null,"spectrum_id":"CCMSLIB00017301043","spectrum_index":42634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 106.0267 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.086,"smiles":null,"spectrum_id":"CCMSLIB00017301046","spectrum_index":42635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(3-Aminopropyl)-N1-methylpropane-1,3-diamine (delta mass: 238.2283 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.393,"smiles":null,"spectrum_id":"CCMSLIB00017301049","spectrum_index":42636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 617.4037 Da; putative annotation: N/A; putative formula: C34H55N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.464,"smiles":null,"spectrum_id":"CCMSLIB00017301051","spectrum_index":42637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 197.0902 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.176,"smiles":null,"spectrum_id":"CCMSLIB00017301053","spectrum_index":42638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 252.2741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.351,"smiles":null,"spectrum_id":"CCMSLIB00017301056","spectrum_index":42639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 296.1671 Da; putative annotation: N/A; putative formula: C14H24N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.305,"smiles":null,"spectrum_id":"CCMSLIB00017301059","spectrum_index":42640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 248.2499 Da; putative annotation: N/A; putative formula: C18H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.373,"smiles":null,"spectrum_id":"CCMSLIB00017301061","spectrum_index":42641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 146.0706 Da; putative annotation: N/A; putative formula: C6H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.141,"smiles":null,"spectrum_id":"CCMSLIB00017301063","spectrum_index":42642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 870.047 Da; putative annotation: N/A; putative formula: C56H22O3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.14,"smiles":null,"spectrum_id":"CCMSLIB00017301066","spectrum_index":42643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 341.1305 Da; putative annotation: N/A; putative formula: C17H27NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.167,"smiles":null,"spectrum_id":"CCMSLIB00017301069","spectrum_index":42644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 363.2408 Da; putative annotation: N/A; putative formula: C21H33NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.369,"smiles":null,"spectrum_id":"CCMSLIB00017301071","spectrum_index":42645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 255.2193 Da; putative annotation: N/A; putative formula: C15H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.279,"smiles":null,"spectrum_id":"CCMSLIB00017301074","spectrum_index":42646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 563.2366 Da; putative annotation: N/A; putative formula: C28H37NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.323,"smiles":null,"spectrum_id":"CCMSLIB00017301077","spectrum_index":42647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 142.099 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.217,"smiles":null,"spectrum_id":"CCMSLIB00017301080","spectrum_index":42648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 137.1046 Da; putative annotation: N/A; putative formula: C6H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.17,"smiles":null,"spectrum_id":"CCMSLIB00017301082","spectrum_index":42649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 9.9837 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.07,"smiles":null,"spectrum_id":"CCMSLIB00017301085","spectrum_index":42650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 394.1821 Da; putative annotation: N/A; putative formula: C22H34S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.284,"smiles":null,"spectrum_id":"CCMSLIB00017301088","spectrum_index":42651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 119.0452 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.086,"smiles":null,"spectrum_id":"CCMSLIB00017301090","spectrum_index":42652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 250.1562 Da; putative annotation: N/A; putative formula: C9H23N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.237,"smiles":null,"spectrum_id":"CCMSLIB00017301093","spectrum_index":42653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 425.0485 Da; putative annotation: N/A; putative formula: C21H16NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.116,"smiles":null,"spectrum_id":"CCMSLIB00017301096","spectrum_index":42654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 300.1148 Da; putative annotation: N/A; putative formula: C21H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.18,"smiles":null,"spectrum_id":"CCMSLIB00017301098","spectrum_index":42655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 220.0905 Da; putative annotation: N/A; putative formula: C7H17N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.166,"smiles":null,"spectrum_id":"CCMSLIB00017301100","spectrum_index":42656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 45.4243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017301103","spectrum_index":42657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 151.1203 Da; putative annotation: N/A; putative formula: C7H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.191,"smiles":null,"spectrum_id":"CCMSLIB00017301106","spectrum_index":42658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 9H-carbazole-3-carboxylate (delta mass: 76.0162 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.118,"smiles":null,"spectrum_id":"CCMSLIB00017301108","spectrum_index":42659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 59.937 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.997,"smiles":null,"spectrum_id":"CCMSLIB00017301111","spectrum_index":42660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 83.0727 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.133,"smiles":null,"spectrum_id":"CCMSLIB00017301113","spectrum_index":42661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 94.0787 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.238,"smiles":null,"spectrum_id":"CCMSLIB00017301116","spectrum_index":42662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinemethanol (delta mass: 154.0086 Da; putative annotation: N/A; putative formula: C7H6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.069,"smiles":null,"spectrum_id":"CCMSLIB00017301119","spectrum_index":42663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 100.0683 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.295,"smiles":null,"spectrum_id":"CCMSLIB00017301122","spectrum_index":42664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 15.0743 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.134,"smiles":null,"spectrum_id":"CCMSLIB00017301124","spectrum_index":42665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 145.0057 Da; putative annotation: N/A; putative formula: C2H3N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.119,"smiles":null,"spectrum_id":"CCMSLIB00017301127","spectrum_index":42666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 23.0039 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.126,"smiles":null,"spectrum_id":"CCMSLIB00017301130","spectrum_index":42667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 191.1162 Da; putative annotation: N/A; putative formula: C8H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.187,"smiles":null,"spectrum_id":"CCMSLIB00017301133","spectrum_index":42668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-(Difluoromethylthio)phenyl)-N-methylmethanamine (delta mass: 164.1055 Da; putative annotation: N/A; putative formula: C8H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.171,"smiles":null,"spectrum_id":"CCMSLIB00017301135","spectrum_index":42669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 111.0324 Da; putative annotation: L-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.133,"smiles":null,"spectrum_id":"CCMSLIB00017301138","spectrum_index":42670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 138.0799 Da; putative annotation: N-Acetyl-L-Prolinamide; putative formula: C7H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.14,"smiles":null,"spectrum_id":"CCMSLIB00017301140","spectrum_index":42671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 162.0526 Da; putative annotation: MYO-INOSITOL; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.113,"smiles":null,"spectrum_id":"CCMSLIB00017301143","spectrum_index":42672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 96.0576 Da; putative annotation: 3-Methylpent-2-enoic acid; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017301145","spectrum_index":42673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 164.1566 Da; putative annotation: 1-(3,3-Dimethylbicyclo[2.2.1]hept-2-yl)-1-propanol; putative formula: C12H20)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.222,"smiles":null,"spectrum_id":"CCMSLIB00017301148","spectrum_index":42674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 358.1259 Da; putative annotation: Loganic acid; putative formula: C16H22O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.223,"smiles":null,"spectrum_id":"CCMSLIB00017301151","spectrum_index":42675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 188.1207 Da; putative annotation: Aureonitol; putative formula: C13H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.176,"smiles":null,"spectrum_id":"CCMSLIB00017301153","spectrum_index":42676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 494.2513 Da; putative annotation: NCGC00385101-01_C26H40O10_1,6-Bis-O-{[4-(2-hydroxy-2-propanyl)-1-cyclohexen-1-yl]carbonyl}-beta-D-glucopyranose; putative formula: C26H38O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.317,"smiles":null,"spectrum_id":"CCMSLIB00017301155","spectrum_index":42677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 64.0678 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017301158","spectrum_index":42678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 144.0865 Da; putative annotation: N/A; putative formula: C5H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.21,"smiles":null,"spectrum_id":"CCMSLIB00017301161","spectrum_index":42679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-His (delta mass: 226.1683 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.288,"smiles":null,"spectrum_id":"CCMSLIB00017301164","spectrum_index":42680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 169.1382 Da; putative annotation: N/A; putative formula: C10H20NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.186,"smiles":null,"spectrum_id":"CCMSLIB00017301167","spectrum_index":42681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 144.0848 Da; putative annotation: N/A; putative formula: C5H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.14,"smiles":null,"spectrum_id":"CCMSLIB00017301168","spectrum_index":42682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 406.1469 Da; putative annotation: N/A; putative formula: C30H18N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.233,"smiles":null,"spectrum_id":"CCMSLIB00017301171","spectrum_index":42683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017301174","spectrum_index":42684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxy-2-methylindole-3-carboxylic acid CollisionEnergy:205060 (delta mass: 188.03 Da; putative annotation: N/A; putative formula: C4H8N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.095,"smiles":null,"spectrum_id":"CCMSLIB00017301177","spectrum_index":42685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 255.2557 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.331,"smiles":null,"spectrum_id":"CCMSLIB00017301180","spectrum_index":42686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 40.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017301182","spectrum_index":42687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 623.4375 Da; putative annotation: N/A; putative formula: C39H61NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.498,"smiles":null,"spectrum_id":"CCMSLIB00017301185","spectrum_index":42688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 220.2188 Da; putative annotation: N/A; putative formula: C16H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.289,"smiles":null,"spectrum_id":"CCMSLIB00017301187","spectrum_index":42689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 174.067 Da; putative annotation: N/A; putative formula: C5H11N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.179,"smiles":null,"spectrum_id":"CCMSLIB00017301190","spectrum_index":42690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Pro (delta mass: 99.068 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.207,"smiles":null,"spectrum_id":"CCMSLIB00017301193","spectrum_index":42691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 58.0347 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.147,"smiles":null,"spectrum_id":"CCMSLIB00017301196","spectrum_index":42692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 276.1104 Da; putative annotation: N/A; putative formula: C16H21PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.181,"smiles":null,"spectrum_id":"CCMSLIB00017301197","spectrum_index":42693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 244.1243 Da; putative annotation: N/A; putative formula: C13H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.283,"smiles":null,"spectrum_id":"CCMSLIB00017301200","spectrum_index":42694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 119.041 Da; putative annotation: N/A; putative formula: C4H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.112,"smiles":null,"spectrum_id":"CCMSLIB00017301203","spectrum_index":42695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 138.0966 Da; putative annotation: N/A; putative formula: C9H15O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.25,"smiles":null,"spectrum_id":"CCMSLIB00017301206","spectrum_index":42696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 247.1243 Da; putative annotation: N/A; putative formula: C11H21NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.184,"smiles":null,"spectrum_id":"CCMSLIB00017301207","spectrum_index":42697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 161.0874 Da; putative annotation: N/A; putative formula: C7H15NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.147,"smiles":null,"spectrum_id":"CCMSLIB00017301210","spectrum_index":42698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 176.1537 Da; putative annotation: N/A; putative formula: C13H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.578,"smiles":null,"spectrum_id":"CCMSLIB00017301213","spectrum_index":42699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zinterol (delta mass: 43.0045 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.173,"smiles":null,"spectrum_id":"CCMSLIB00017301216","spectrum_index":42700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 91.085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.17,"smiles":null,"spectrum_id":"CCMSLIB00017301217","spectrum_index":42701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Hexane-1,6-diylbis(N'-cyanoguanidine) (delta mass: 63.0593 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.232,"smiles":null,"spectrum_id":"CCMSLIB00017301220","spectrum_index":42702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.16,"smiles":null,"spectrum_id":"CCMSLIB00017301223","spectrum_index":42703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 361.1371 Da; putative annotation: N/A; putative formula: C13H11N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.25,"smiles":null,"spectrum_id":"CCMSLIB00017301226","spectrum_index":42704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 136.1007 Da; putative annotation: N/A; putative formula: C8H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.182,"smiles":null,"spectrum_id":"CCMSLIB00017301228","spectrum_index":42705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 758.4229 Da; putative annotation: N/A; putative formula: C47H58N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":939.494,"smiles":null,"spectrum_id":"CCMSLIB00017301230","spectrum_index":42706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 861.7181 Da; putative annotation: N/A; putative formula: C60H95NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":999.809,"smiles":null,"spectrum_id":"CCMSLIB00017301233","spectrum_index":42707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 483.3204 Da; putative annotation: N/A; putative formula: C27H49NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.38,"smiles":null,"spectrum_id":"CCMSLIB00017301236","spectrum_index":42708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine - 40.0 eV (delta mass: 23.0424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.144,"smiles":null,"spectrum_id":"CCMSLIB00017301239","spectrum_index":42709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 59.0187 Da; putative annotation: N/A; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.116,"smiles":null,"spectrum_id":"CCMSLIB00017301241","spectrum_index":42710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 86.0569 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017301243","spectrum_index":42711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 140.0074 Da; putative annotation: N/A; putative formula: C2N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.136,"smiles":null,"spectrum_id":"CCMSLIB00017301246","spectrum_index":42712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 580.3572 Da; putative annotation: N/A; putative formula: C30H61O2PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.459,"smiles":null,"spectrum_id":"CCMSLIB00017301249","spectrum_index":42713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 149.1569 Da; putative annotation: N/A; putative formula: C11H19NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.28,"smiles":null,"spectrum_id":"CCMSLIB00017301252","spectrum_index":42714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 132.0937 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.347,"smiles":null,"spectrum_id":"CCMSLIB00017301254","spectrum_index":42715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 159.0535 Da; putative annotation: N/A; putative formula: C6H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.108,"smiles":null,"spectrum_id":"CCMSLIB00017301256","spectrum_index":42716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 138.0891 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.149,"smiles":null,"spectrum_id":"CCMSLIB00017301259","spectrum_index":42717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 14.0728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.159,"smiles":null,"spectrum_id":"CCMSLIB00017301262","spectrum_index":42718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Man3 a (delta mass: 168.0435 Da; putative annotation: N/A; putative formula: C9H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1079.38,"smiles":null,"spectrum_id":"CCMSLIB00017301265","spectrum_index":42719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetamide (delta mass: 70.0412 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.128,"smiles":null,"spectrum_id":"CCMSLIB00017301266","spectrum_index":42720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 282.2202 Da; putative annotation: N/A; putative formula: C18H26N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.333,"smiles":null,"spectrum_id":"CCMSLIB00017301269","spectrum_index":42721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 517.1557 Da; putative annotation: N/A; putative formula: C21H23N7O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.242,"smiles":null,"spectrum_id":"CCMSLIB00017301272","spectrum_index":42722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 51.0179 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.094,"smiles":null,"spectrum_id":"CCMSLIB00017301275","spectrum_index":42723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-1-methyl-1H-indole-2-carboxylic acid (delta mass: 87.0357 Da; putative annotation: N/A; putative formula: C2H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.067,"smiles":null,"spectrum_id":"CCMSLIB00017301278","spectrum_index":42724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 17.0506 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.127,"smiles":null,"spectrum_id":"CCMSLIB00017301279","spectrum_index":42725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 644.5516 Da; putative annotation: N/A; putative formula: C38H77O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1253.82,"smiles":null,"spectrum_id":"CCMSLIB00017301282","spectrum_index":42726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 81.0583 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.16,"smiles":null,"spectrum_id":"CCMSLIB00017301285","spectrum_index":42727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 137.0683 Da; putative annotation: N/A; putative formula: C5H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.134,"smiles":null,"spectrum_id":"CCMSLIB00017301287","spectrum_index":42728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 84.0211 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.123,"smiles":null,"spectrum_id":"CCMSLIB00017301290","spectrum_index":42729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 72.0582 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.118,"smiles":null,"spectrum_id":"CCMSLIB00017301292","spectrum_index":42730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 112.0965 Da; putative annotation: N/A; putative formula: C6H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.24,"smiles":null,"spectrum_id":"CCMSLIB00017301295","spectrum_index":42731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 74.0322 Da; putative annotation: N/A; putative formula: C2H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.134,"smiles":null,"spectrum_id":"CCMSLIB00017301298","spectrum_index":42732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 45.9381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.04,"smiles":null,"spectrum_id":"CCMSLIB00017301299","spectrum_index":42733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 26.9527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.06,"smiles":null,"spectrum_id":"CCMSLIB00017301302","spectrum_index":42734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 36.9135 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.0,"smiles":null,"spectrum_id":"CCMSLIB00017301305","spectrum_index":42735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 52.0545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.151,"smiles":null,"spectrum_id":"CCMSLIB00017301308","spectrum_index":42736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 15.9396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.015,"smiles":null,"spectrum_id":"CCMSLIB00017301310","spectrum_index":42737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 43.0056 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.086,"smiles":null,"spectrum_id":"CCMSLIB00017301312","spectrum_index":42738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 221.2024 Da; putative annotation: N/A; putative formula: C12H23N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.284,"smiles":null,"spectrum_id":"CCMSLIB00017301315","spectrum_index":42739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 112.0483 Da; putative annotation: N/A; putative formula: C2H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.135,"smiles":null,"spectrum_id":"CCMSLIB00017301318","spectrum_index":42740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 81.1229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.188,"smiles":null,"spectrum_id":"CCMSLIB00017301321","spectrum_index":42741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 197.1047 Da; putative annotation: N/A; putative formula: C10H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.191,"smiles":null,"spectrum_id":"CCMSLIB00017301323","spectrum_index":42742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 14.0145 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.138,"smiles":null,"spectrum_id":"CCMSLIB00017301325","spectrum_index":42743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 14.0162 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.269,"smiles":null,"spectrum_id":"CCMSLIB00017301328","spectrum_index":42744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 146.0373 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.161,"smiles":null,"spectrum_id":"CCMSLIB00017301331","spectrum_index":42745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 465.3101 Da; putative annotation: N/A; putative formula: C27H47NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.439,"smiles":null,"spectrum_id":"CCMSLIB00017301334","spectrum_index":42746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 71.9838 Da; putative annotation: N/A; putative formula: C2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.085,"smiles":null,"spectrum_id":"CCMSLIB00017301336","spectrum_index":42747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 382.2231 Da; putative annotation: N/A; putative formula: C19H26N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.347,"smiles":null,"spectrum_id":"CCMSLIB00017301339","spectrum_index":42748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 161.1784 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.281,"smiles":null,"spectrum_id":"CCMSLIB00017301342","spectrum_index":42749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 449.7471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.871,"smiles":null,"spectrum_id":"CCMSLIB00017301344","spectrum_index":42750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 300.6888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.812,"smiles":null,"spectrum_id":"CCMSLIB00017301346","spectrum_index":42751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbamazepine 10,11-epoxide (delta mass: 123.0998 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.197,"smiles":null,"spectrum_id":"CCMSLIB00017301349","spectrum_index":42752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 31.0444 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.11,"smiles":null,"spectrum_id":"CCMSLIB00017301352","spectrum_index":42753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 205.0655 Da; putative annotation: N/A; putative formula: C11H12NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.141,"smiles":null,"spectrum_id":"CCMSLIB00017301355","spectrum_index":42754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 42.9901 Da; putative annotation: N/A; putative formula: CHNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.07,"smiles":null,"spectrum_id":"CCMSLIB00017301357","spectrum_index":42755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 168.0707 Da; putative annotation: N/A; putative formula: C9H13OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.152,"smiles":null,"spectrum_id":"CCMSLIB00017301359","spectrum_index":42756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.097,"smiles":null,"spectrum_id":"CCMSLIB00017301362","spectrum_index":42757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 268.2415 Da; putative annotation: N/A; putative formula: C17H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.349,"smiles":null,"spectrum_id":"CCMSLIB00017301365","spectrum_index":42758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 999.4879 Da; putative annotation: N/A; putative formula: C58H69N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1180.56,"smiles":null,"spectrum_id":"CCMSLIB00017301368","spectrum_index":42759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 88.0513 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.163,"smiles":null,"spectrum_id":"CCMSLIB00017301371","spectrum_index":42760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 646.5167 Da; putative annotation: N/A; putative formula: C36H78N2O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.614,"smiles":null,"spectrum_id":"CCMSLIB00017301372","spectrum_index":42761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 15.1527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.223,"smiles":null,"spectrum_id":"CCMSLIB00017301375","spectrum_index":42762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 150.0442 Da; putative annotation: N/A; putative formula: C5H11O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.115,"smiles":null,"spectrum_id":"CCMSLIB00017301378","spectrum_index":42763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine 6-phosphate - 30.0 eV (delta mass: 70.0117 Da; putative annotation: N/A; putative formula: C2H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.065,"smiles":null,"spectrum_id":"CCMSLIB00017301380","spectrum_index":42764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tropine (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.118,"smiles":null,"spectrum_id":"CCMSLIB00017301382","spectrum_index":42765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 108.0937 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.269,"smiles":null,"spectrum_id":"CCMSLIB00017301385","spectrum_index":42766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 120.046 Da; putative annotation: N/A; putative formula: C3H9N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.1,"smiles":null,"spectrum_id":"CCMSLIB00017301388","spectrum_index":42767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 51.0471 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.107,"smiles":null,"spectrum_id":"CCMSLIB00017301390","spectrum_index":42768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrindole (delta mass: 45.0802 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.282,"smiles":null,"spectrum_id":"CCMSLIB00017301393","spectrum_index":42769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 92.0991 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017301396","spectrum_index":42770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 58.0204 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.154,"smiles":null,"spectrum_id":"CCMSLIB00017301398","spectrum_index":42771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Val - 30.0 eV (delta mass: 87.0317 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.139,"smiles":null,"spectrum_id":"CCMSLIB00017301401","spectrum_index":42772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Amino-4,4-dimethylpentanoic acid (delta mass: 262.2304 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.348,"smiles":null,"spectrum_id":"CCMSLIB00017301404","spectrum_index":42773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 534.2528 Da; putative annotation: N/A; putative formula: C35H38N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.35,"smiles":null,"spectrum_id":"CCMSLIB00017301407","spectrum_index":42774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 52.0305 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.257,"smiles":null,"spectrum_id":"CCMSLIB00017301410","spectrum_index":42775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 282.0551 Da; putative annotation: N/A; putative formula: C10H6N10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.126,"smiles":null,"spectrum_id":"CCMSLIB00017301412","spectrum_index":42776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311158 Methoxytyramine (delta mass: 348.1887 Da; putative annotation: N/A; putative formula: C17H33O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.291,"smiles":null,"spectrum_id":"CCMSLIB00017301414","spectrum_index":42777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Leu (delta mass: 99.0686 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.229,"smiles":null,"spectrum_id":"CCMSLIB00017301417","spectrum_index":42778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 193.0953 Da; putative annotation: N/A; putative formula: C7H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.171,"smiles":null,"spectrum_id":"CCMSLIB00017301420","spectrum_index":42779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 89.0444 Da; putative annotation: N/A; putative formula: C2H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.141,"smiles":null,"spectrum_id":"CCMSLIB00017301423","spectrum_index":42780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 73.0524 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.15,"smiles":null,"spectrum_id":"CCMSLIB00017301424","spectrum_index":42781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 190.0629 Da; putative annotation: N/A; putative formula: C11H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.139,"smiles":null,"spectrum_id":"CCMSLIB00017301427","spectrum_index":42782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine methyl ester (delta mass: 84.0574 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.134,"smiles":null,"spectrum_id":"CCMSLIB00017301430","spectrum_index":42783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 799.2407 Da; putative annotation: N/A; putative formula: C54H33N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":980.311,"smiles":null,"spectrum_id":"CCMSLIB00017301433","spectrum_index":42784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 210.1042 Da; putative annotation: N/A; putative formula: C15H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017301434","spectrum_index":42785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 268.204 Da; putative annotation: N/A; putative formula: C16H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.241,"smiles":null,"spectrum_id":"CCMSLIB00017301437","spectrum_index":42786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311093 Cinnamoyl putrescin (delta mass: 56.0371 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.186,"smiles":null,"spectrum_id":"CCMSLIB00017301440","spectrum_index":42787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 104.0996 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.353,"smiles":null,"spectrum_id":"CCMSLIB00017301443","spectrum_index":42788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 47.9669 Da; putative annotation: N/A; putative formula: OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.063,"smiles":null,"spectrum_id":"CCMSLIB00017301445","spectrum_index":42789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 235.0488 Da; putative annotation: N/A; putative formula: C4H9N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.151,"smiles":null,"spectrum_id":"CCMSLIB00017301447","spectrum_index":42790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 431.264 Da; putative annotation: N/A; putative formula: C21H41N3O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.375,"smiles":null,"spectrum_id":"CCMSLIB00017301450","spectrum_index":42791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 202.0752 Da; putative annotation: N/A; putative formula: C8H14N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.156,"smiles":null,"spectrum_id":"CCMSLIB00017301453","spectrum_index":42792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 172.0309 Da; putative annotation: N/A; putative formula: C6H8N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.107,"smiles":null,"spectrum_id":"CCMSLIB00017301455","spectrum_index":42793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 50.0259 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.107,"smiles":null,"spectrum_id":"CCMSLIB00017301457","spectrum_index":42794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 139.0647 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.125,"smiles":null,"spectrum_id":"CCMSLIB00017301460","spectrum_index":42795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 198.0588 Da; putative annotation: N/A; putative formula: C7H12N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.14,"smiles":null,"spectrum_id":"CCMSLIB00017301463","spectrum_index":42796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-methyl-2-aminoindane (delta mass: 15.0341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.146,"smiles":null,"spectrum_id":"CCMSLIB00017301466","spectrum_index":42797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrindole (delta mass: 261.1118 Da; putative annotation: N/A; putative formula: C6H15N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.313,"smiles":null,"spectrum_id":"CCMSLIB00017301467","spectrum_index":42798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Heptanone, 1,7-bis(3,4-dihydroxyphenyl)-6-methoxy- (delta mass: 60.0254 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.19,"smiles":null,"spectrum_id":"CCMSLIB00017301470","spectrum_index":42799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 840.3897 Da; putative annotation: N/A; putative formula: C54H56N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1062.49,"smiles":null,"spectrum_id":"CCMSLIB00017301473","spectrum_index":42800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 58.0058 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.123,"smiles":null,"spectrum_id":"CCMSLIB00017301476","spectrum_index":42801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gramine (delta mass: 130.0605 Da; putative annotation: N/A; putative formula: C2H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.184,"smiles":null,"spectrum_id":"CCMSLIB00017301478","spectrum_index":42802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 149.1047 Da; putative annotation: N/A; putative formula: C7H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.253,"smiles":null,"spectrum_id":"CCMSLIB00017301480","spectrum_index":42803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 10.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.128,"smiles":null,"spectrum_id":"CCMSLIB00017301483","spectrum_index":42804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 573.217 Da; putative annotation: N/A; putative formula: C24H35N3O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.303,"smiles":null,"spectrum_id":"CCMSLIB00017301486","spectrum_index":42805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylpyridine-4-carboxylic acid (delta mass: 42.0801 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.13,"smiles":null,"spectrum_id":"CCMSLIB00017301489","spectrum_index":42806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 31.0058 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.103,"smiles":null,"spectrum_id":"CCMSLIB00017301491","spectrum_index":42807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 66.0325 Da; putative annotation: N/A; putative formula: C2H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.103,"smiles":null,"spectrum_id":"CCMSLIB00017301493","spectrum_index":42808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 111.0318 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.192,"smiles":null,"spectrum_id":"CCMSLIB00017301496","spectrum_index":42809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-.beta.-alanine (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017301499","spectrum_index":42810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 99.0174 Da; putative annotation: N/A; putative formula: CHN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.072,"smiles":null,"spectrum_id":"CCMSLIB00017301502","spectrum_index":42811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 424.193 Da; putative annotation: N/A; putative formula: C25H25N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.295,"smiles":null,"spectrum_id":"CCMSLIB00017301503","spectrum_index":42812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylglutamine (delta mass: 252.2449 Da; putative annotation: N/A; putative formula: C17H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.364,"smiles":null,"spectrum_id":"CCMSLIB00017301506","spectrum_index":42813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 16.4403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017301509","spectrum_index":42814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 15.9581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.969,"smiles":null,"spectrum_id":"CCMSLIB00017301510","spectrum_index":42815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00350 (1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol (delta mass: 42.047 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.243,"smiles":null,"spectrum_id":"CCMSLIB00017301513","spectrum_index":42816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 12.0374 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.118,"smiles":null,"spectrum_id":"CCMSLIB00017301516","spectrum_index":42817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 827.2946 Da; putative annotation: N/A; putative formula: C41H45N7O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1332.47,"smiles":null,"spectrum_id":"CCMSLIB00017301519","spectrum_index":42818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 366.0742 Da; putative annotation: N/A; putative formula: C13H22N2O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.145,"smiles":null,"spectrum_id":"CCMSLIB00017301521","spectrum_index":42819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:205060 (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.196,"smiles":null,"spectrum_id":"CCMSLIB00017301523","spectrum_index":42820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 97.9999 Da; putative annotation: N/A; putative formula: C4H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.138,"smiles":null,"spectrum_id":"CCMSLIB00017301526","spectrum_index":42821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 327.1551 Da; putative annotation: N/A; putative formula: C14H25N5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.309,"smiles":null,"spectrum_id":"CCMSLIB00017301529","spectrum_index":42822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 59.11 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.212,"smiles":null,"spectrum_id":"CCMSLIB00017301531","spectrum_index":42823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 52.9945 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.086,"smiles":null,"spectrum_id":"CCMSLIB00017301534","spectrum_index":42824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ticarcillin (delta mass: 51.006 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.058,"smiles":null,"spectrum_id":"CCMSLIB00017301536","spectrum_index":42825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 85.1041 Da; putative annotation: N/A; putative formula: C4H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.19,"smiles":null,"spectrum_id":"CCMSLIB00017301539","spectrum_index":42826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Phenyl-1H-pyrazol-1-yl)piperidine (delta mass: 50.0464 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.196,"smiles":null,"spectrum_id":"CCMSLIB00017301542","spectrum_index":42827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 41.1604 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.225,"smiles":null,"spectrum_id":"CCMSLIB00017301544","spectrum_index":42828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 116.0395 Da; putative annotation: N/A; putative formula: C5H9OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.104,"smiles":null,"spectrum_id":"CCMSLIB00017301547","spectrum_index":42829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 17.0617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017301550","spectrum_index":42830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 310.0033 Da; putative annotation: N/A; putative formula: C6H6N4O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.157,"smiles":null,"spectrum_id":"CCMSLIB00017301552","spectrum_index":42831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 97.0882 Da; putative annotation: N/A; putative formula: C6H11N)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.143,"smiles":null,"spectrum_id":"CCMSLIB00017301555","spectrum_index":42832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 107.0365 Da; putative annotation: 5-Hydroxy-2-(hydroxymethyl)pyridine; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.16,"smiles":null,"spectrum_id":"CCMSLIB00017301558","spectrum_index":42833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 155.0932 Da; putative annotation: HEXANOYLGLYCINE; putative formula: C8H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.158,"smiles":null,"spectrum_id":"CCMSLIB00017301561","spectrum_index":42834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 168.0532 Da; putative annotation: 4-Isoxazolepropanoic acid, .alpha.-amino-2,3-dihydro-5-methyl-3-oxo-; putative formula: C7H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.15,"smiles":null,"spectrum_id":"CCMSLIB00017301563","spectrum_index":42835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ARABITOL (delta mass: 250.0989 Da; putative annotation: 2'-Hydroxy-5'-methyl-2-methoxychalcone; putative formula: C17H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.175,"smiles":null,"spectrum_id":"CCMSLIB00017301565","spectrum_index":42836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PYRROLE-2-CARBOXYLIC ACID CollisionEnergy:102040 (delta mass: 100.0528 Da; putative annotation: (S)-(+)-2-Hydroxy-3-methylbutyric acid; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017301568","spectrum_index":42837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 9H-carbazole-3-carboxylate (delta mass: 114.0318 Da; putative annotation: Ethyl hydrogen malonate; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.134,"smiles":null,"spectrum_id":"CCMSLIB00017301571","spectrum_index":42838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 186.0317 Da; putative annotation: 6-Methylchromone-2-carboxylic acid; putative formula: C11H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.118,"smiles":null,"spectrum_id":"CCMSLIB00017301573","spectrum_index":42839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 228.1154 Da; putative annotation: Glu-Val; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017301575","spectrum_index":42840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 350.1945 Da; putative annotation: 17-Phenyltrinorprostaglandin A2; putative formula: C23H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.364,"smiles":null,"spectrum_id":"CCMSLIB00017301578","spectrum_index":42841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 142.0741 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.176,"smiles":null,"spectrum_id":"CCMSLIB00017301581","spectrum_index":42842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .DELTA.8-Tetrahydrocannabinol (delta mass: 88.0502 Da; putative annotation: N/A; putative formula: H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.282,"smiles":null,"spectrum_id":"CCMSLIB00017301584","spectrum_index":42843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 145.0952 Da; putative annotation: N/A; putative formula: C4H11N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.192,"smiles":null,"spectrum_id":"CCMSLIB00017301586","spectrum_index":42844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 81.0427 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.212,"smiles":null,"spectrum_id":"CCMSLIB00017301588","spectrum_index":42845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 846.4035 Da; putative annotation: N/A; putative formula: C42H50N14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1039.47,"smiles":null,"spectrum_id":"CCMSLIB00017301591","spectrum_index":42846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 37.0322 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.087,"smiles":null,"spectrum_id":"CCMSLIB00017301594","spectrum_index":42847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 240.0995 Da; putative annotation: N/A; putative formula: C12H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.222,"smiles":null,"spectrum_id":"CCMSLIB00017301595","spectrum_index":42848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 103.0251 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.101,"smiles":null,"spectrum_id":"CCMSLIB00017301598","spectrum_index":42849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of thymidine (delta mass: 192.156 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.254,"smiles":null,"spectrum_id":"CCMSLIB00017301601","spectrum_index":42850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 49.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.196,"smiles":null,"spectrum_id":"CCMSLIB00017301604","spectrum_index":42851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-(benzyloxy)-1H-indole-2-carboxylate (delta mass: 165.0856 Da; putative annotation: N/A; putative formula: C4H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.198,"smiles":null,"spectrum_id":"CCMSLIB00017301606","spectrum_index":42852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 123.0673 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.148,"smiles":null,"spectrum_id":"CCMSLIB00017301608","spectrum_index":42853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-C6:0 (delta mass: 98.0732 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.196,"smiles":null,"spectrum_id":"CCMSLIB00017301611","spectrum_index":42854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethanone, 1-[1-(4-hydroxypentyl)-1H-indol-3-yl]-2-(2-methoxyphenyl)- (delta mass: 27.0431 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.234,"smiles":null,"spectrum_id":"CCMSLIB00017301614","spectrum_index":42855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 106.0534 Da; putative annotation: N/A; putative formula: C6H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.14,"smiles":null,"spectrum_id":"CCMSLIB00017301617","spectrum_index":42856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 479.1691 Da; putative annotation: N/A; putative formula: C25H25N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.271,"smiles":null,"spectrum_id":"CCMSLIB00017301620","spectrum_index":42857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 132.0422 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.129,"smiles":null,"spectrum_id":"CCMSLIB00017301621","spectrum_index":42858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 92.083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.201,"smiles":null,"spectrum_id":"CCMSLIB00017301624","spectrum_index":42859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 237.9676 Da; putative annotation: N/A; putative formula: C10H7OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.091,"smiles":null,"spectrum_id":"CCMSLIB00017301627","spectrum_index":42860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 142.1113 Da; putative annotation: N/A; putative formula: C7H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.203,"smiles":null,"spectrum_id":"CCMSLIB00017301630","spectrum_index":42861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 16.9827 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.064,"smiles":null,"spectrum_id":"CCMSLIB00017301631","spectrum_index":42862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 259.1048 Da; putative annotation: N/A; putative formula: C8H9N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.228,"smiles":null,"spectrum_id":"CCMSLIB00017301634","spectrum_index":42863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 236.1162 Da; putative annotation: N/A; putative formula: C12H16N2O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.203,"smiles":null,"spectrum_id":"CCMSLIB00017301637","spectrum_index":42864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 237.1209 Da; putative annotation: N/A; putative formula: C9H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.186,"smiles":null,"spectrum_id":"CCMSLIB00017301640","spectrum_index":42865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.148,"smiles":null,"spectrum_id":"CCMSLIB00017301641","spectrum_index":42866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 48.0365 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.195,"smiles":null,"spectrum_id":"CCMSLIB00017301644","spectrum_index":42867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 11.0174 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.114,"smiles":null,"spectrum_id":"CCMSLIB00017301647","spectrum_index":42868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.128,"smiles":null,"spectrum_id":"CCMSLIB00017301650","spectrum_index":42869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 648.3808 Da; putative annotation: N/A; putative formula: C35H56N2O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.519,"smiles":null,"spectrum_id":"CCMSLIB00017301652","spectrum_index":42870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 298.1414 Da; putative annotation: N/A; putative formula: C15H22O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.295,"smiles":null,"spectrum_id":"CCMSLIB00017301654","spectrum_index":42871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 266.9632 Da; putative annotation: N/A; putative formula: C14H5NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.122,"smiles":null,"spectrum_id":"CCMSLIB00017301657","spectrum_index":42872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 31.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.149,"smiles":null,"spectrum_id":"CCMSLIB00017301660","spectrum_index":42873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 18.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.237,"smiles":null,"spectrum_id":"CCMSLIB00017301663","spectrum_index":42874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100147 Indole-3-acetaldehyde (delta mass: 157.0214 Da; putative annotation: N/A; putative formula: C6H9NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.097,"smiles":null,"spectrum_id":"CCMSLIB00017301665","spectrum_index":42875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 56.9974 Da; putative annotation: N/A; putative formula: H-1N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.078,"smiles":null,"spectrum_id":"CCMSLIB00017301667","spectrum_index":42876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 59.0738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.186,"smiles":null,"spectrum_id":"CCMSLIB00017301670","spectrum_index":42877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 420.2595 Da; putative annotation: N/A; putative formula: C19H40N4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.361,"smiles":null,"spectrum_id":"CCMSLIB00017301672","spectrum_index":42878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 57.066 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.137,"smiles":null,"spectrum_id":"CCMSLIB00017301675","spectrum_index":42879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 983.6191 Da; putative annotation: N/A; putative formula: C53H85N5O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1205.72,"smiles":null,"spectrum_id":"CCMSLIB00017301676","spectrum_index":42880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 82.0795 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.166,"smiles":null,"spectrum_id":"CCMSLIB00017301679","spectrum_index":42881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 14.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.16,"smiles":null,"spectrum_id":"CCMSLIB00017301682","spectrum_index":42882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 141.0421 Da; putative annotation: N/A; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.113,"smiles":null,"spectrum_id":"CCMSLIB00017301684","spectrum_index":42883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 61.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.165,"smiles":null,"spectrum_id":"CCMSLIB00017301687","spectrum_index":42884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine (delta mass: 141.7561 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.02,"smiles":null,"spectrum_id":"CCMSLIB00017301690","spectrum_index":42885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:205060 (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.103,"smiles":null,"spectrum_id":"CCMSLIB00017301692","spectrum_index":42886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 82.0417 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.217,"smiles":null,"spectrum_id":"CCMSLIB00017301695","spectrum_index":42887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 155.1893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.328,"smiles":null,"spectrum_id":"CCMSLIB00017301697","spectrum_index":42888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 59.0426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.13,"smiles":null,"spectrum_id":"CCMSLIB00017301699","spectrum_index":42889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 310.0848 Da; putative annotation: N/A; putative formula: C11H14N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.171,"smiles":null,"spectrum_id":"CCMSLIB00017301702","spectrum_index":42890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 282.0931 Da; putative annotation: N/A; putative formula: C15H22O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.247,"smiles":null,"spectrum_id":"CCMSLIB00017301705","spectrum_index":42891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 276.0274 Da; putative annotation: N/A; putative formula: C16H9N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.077,"smiles":null,"spectrum_id":"CCMSLIB00017301707","spectrum_index":42892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 238.1517 Da; putative annotation: N/A; putative formula: C6H14N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.216,"smiles":null,"spectrum_id":"CCMSLIB00017301710","spectrum_index":42893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-tert-Butyl-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 306.1467 Da; putative annotation: N/A; putative formula: C17H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.301,"smiles":null,"spectrum_id":"CCMSLIB00017301711","spectrum_index":42894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 17.0854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.23,"smiles":null,"spectrum_id":"CCMSLIB00017301714","spectrum_index":42895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Diaminotoluene (delta mass: 72.0458 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.137,"smiles":null,"spectrum_id":"CCMSLIB00017301717","spectrum_index":42896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 125.0489 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.177,"smiles":null,"spectrum_id":"CCMSLIB00017301719","spectrum_index":42897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACETIC ACID (delta mass: 179.0794 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.15,"smiles":null,"spectrum_id":"CCMSLIB00017301722","spectrum_index":42898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 10.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.169,"smiles":null,"spectrum_id":"CCMSLIB00017301725","spectrum_index":42899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 74.0364 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.159,"smiles":null,"spectrum_id":"CCMSLIB00017301727","spectrum_index":42900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 201.1354 Da; putative annotation: N/A; putative formula: C10H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.206,"smiles":null,"spectrum_id":"CCMSLIB00017301730","spectrum_index":42901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 31.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.264,"smiles":null,"spectrum_id":"CCMSLIB00017301734","spectrum_index":42902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 128.0852 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.172,"smiles":null,"spectrum_id":"CCMSLIB00017301736","spectrum_index":42903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 1.981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.114,"smiles":null,"spectrum_id":"CCMSLIB00017301738","spectrum_index":42904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 82.9904 Da; putative annotation: N/A; putative formula: C3H2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.071,"smiles":null,"spectrum_id":"CCMSLIB00017301741","spectrum_index":42905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 372.1642 Da; putative annotation: N/A; putative formula: C25H25OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.23,"smiles":null,"spectrum_id":"CCMSLIB00017301744","spectrum_index":42906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,5-Phenanthrenedicarboxylic acid (delta mass: 73.9991 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.064,"smiles":null,"spectrum_id":"CCMSLIB00017301747","spectrum_index":42907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 252.1708 Da; putative annotation: N/A; putative formula: C11H20N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.27,"smiles":null,"spectrum_id":"CCMSLIB00017301749","spectrum_index":42908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 98.0734 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.165,"smiles":null,"spectrum_id":"CCMSLIB00017301751","spectrum_index":42909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 133.1103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.244,"smiles":null,"spectrum_id":"CCMSLIB00017301754","spectrum_index":42910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 125.0629 Da; putative annotation: N/A; putative formula: C10H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.149,"smiles":null,"spectrum_id":"CCMSLIB00017301757","spectrum_index":42911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 126.0061 Da; putative annotation: N/A; putative formula: C6H7O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.13,"smiles":null,"spectrum_id":"CCMSLIB00017301760","spectrum_index":42912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 78.0831 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.148,"smiles":null,"spectrum_id":"CCMSLIB00017301762","spectrum_index":42913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 101.0476 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017301764","spectrum_index":42914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 20.0 eV (delta mass: 259.7358 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.773,"smiles":null,"spectrum_id":"CCMSLIB00017301767","spectrum_index":42915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 52.0305 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.236,"smiles":null,"spectrum_id":"CCMSLIB00017301770","spectrum_index":42916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 106.0777 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.352,"smiles":null,"spectrum_id":"CCMSLIB00017301773","spectrum_index":42917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 238.2085 Da; putative annotation: N/A; putative formula: C19H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.284,"smiles":null,"spectrum_id":"CCMSLIB00017301776","spectrum_index":42918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methoxytyramine (delta mass: 430.2307 Da; putative annotation: N/A; putative formula: C22H39O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.333,"smiles":null,"spectrum_id":"CCMSLIB00017301778","spectrum_index":42919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 302.2238 Da; putative annotation: N/A; putative formula: C20H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.326,"smiles":null,"spectrum_id":"CCMSLIB00017301780","spectrum_index":42920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 69.0654 Da; putative annotation: N/A; putative formula: C3H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.12,"smiles":null,"spectrum_id":"CCMSLIB00017301783","spectrum_index":42921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 156.0591 Da; putative annotation: N/A; putative formula: C4H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.13,"smiles":null,"spectrum_id":"CCMSLIB00017301786","spectrum_index":42922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 370.1405 Da; putative annotation: N/A; putative formula: C15H23N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.269,"smiles":null,"spectrum_id":"CCMSLIB00017301788","spectrum_index":42923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mitoridine (delta mass: 400.1629 Da; putative annotation: N/A; putative formula: C23H29O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.338,"smiles":null,"spectrum_id":"CCMSLIB00017301790","spectrum_index":42924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 181.1087 Da; putative annotation: N/A; putative formula: C6H11N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.174,"smiles":null,"spectrum_id":"CCMSLIB00017301793","spectrum_index":42925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 206.0797 Da; putative annotation: N/A; putative formula: C9H18OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.229,"smiles":null,"spectrum_id":"CCMSLIB00017301796","spectrum_index":42926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 45.0658 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.158,"smiles":null,"spectrum_id":"CCMSLIB00017301798","spectrum_index":42927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 285.1578 Da; putative annotation: N/A; putative formula: C14H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.27,"smiles":null,"spectrum_id":"CCMSLIB00017301801","spectrum_index":42928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 157.2769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.446,"smiles":null,"spectrum_id":"CCMSLIB00017301803","spectrum_index":42929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 28.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.211,"smiles":null,"spectrum_id":"CCMSLIB00017301806","spectrum_index":42930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 100.0321 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.103,"smiles":null,"spectrum_id":"CCMSLIB00017301809","spectrum_index":42931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 302.0435 Da; putative annotation: N/A; putative formula: C15H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.119,"smiles":null,"spectrum_id":"CCMSLIB00017301812","spectrum_index":42932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 107.0735 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.197,"smiles":null,"spectrum_id":"CCMSLIB00017301815","spectrum_index":42933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 338.2018 Da; putative annotation: N/A; putative formula: C20H27N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.273,"smiles":null,"spectrum_id":"CCMSLIB00017301817","spectrum_index":42934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.043,"smiles":null,"spectrum_id":"CCMSLIB00017301819","spectrum_index":42935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 75.1868 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.278,"smiles":null,"spectrum_id":"CCMSLIB00017301822","spectrum_index":42936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 155.0808 Da; putative annotation: N/A; putative formula: C5H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.162,"smiles":null,"spectrum_id":"CCMSLIB00017301825","spectrum_index":42937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 317.1627 Da; putative annotation: N/A; putative formula: C18H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.228,"smiles":null,"spectrum_id":"CCMSLIB00017301827","spectrum_index":42938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 714.4341 Da; putative annotation: N/A; putative formula: C41H62O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.505,"smiles":null,"spectrum_id":"CCMSLIB00017301830","spectrum_index":42939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 914.3737 Da; putative annotation: N/A; putative formula: C51H54N4O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1136.47,"smiles":null,"spectrum_id":"CCMSLIB00017301833","spectrum_index":42940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 53.9409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.006,"smiles":null,"spectrum_id":"CCMSLIB00017301836","spectrum_index":42941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 207.1819 Da; putative annotation: N/A; putative formula: C11H21N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.23,"smiles":null,"spectrum_id":"CCMSLIB00017301839","spectrum_index":42942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 74.0431 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.115,"smiles":null,"spectrum_id":"CCMSLIB00017301840","spectrum_index":42943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 168.1298 Da; putative annotation: N/A; putative formula: C14H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.195,"smiles":null,"spectrum_id":"CCMSLIB00017301843","spectrum_index":42944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 400.2407 Da; putative annotation: N/A; putative formula: C20H38N2O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.349,"smiles":null,"spectrum_id":"CCMSLIB00017301846","spectrum_index":42945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 138.5052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.565,"smiles":null,"spectrum_id":"CCMSLIB00017301849","spectrum_index":42946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N ALPHA-ACETYL-L-LYSINE (delta mass: 84.0561 Da; putative annotation: N/A; putative formula: CH4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.18,"smiles":null,"spectrum_id":"CCMSLIB00017301850","spectrum_index":42947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 105.0226 Da; putative annotation: N/A; putative formula: C6H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.119,"smiles":null,"spectrum_id":"CCMSLIB00017301853","spectrum_index":42948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mitraphylline (delta mass: 400.16 Da; putative annotation: N/A; putative formula: C16H34O5P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":769.341,"smiles":null,"spectrum_id":"CCMSLIB00017301856","spectrum_index":42949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 10.9941 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.059,"smiles":null,"spectrum_id":"CCMSLIB00017301858","spectrum_index":42950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311112 Caffeoyl putrescin (isomer of 1059) (delta mass: 140.0833 Da; putative annotation: N/A; putative formula: C8H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.222,"smiles":null,"spectrum_id":"CCMSLIB00017301861","spectrum_index":42951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 131.0934 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.19,"smiles":null,"spectrum_id":"CCMSLIB00017301863","spectrum_index":42952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[(Dimethylamino)methyl]phenol (delta mass: 45.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.154,"smiles":null,"spectrum_id":"CCMSLIB00017301866","spectrum_index":42953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 13.9785 Da; putative annotation: N/A; putative formula: H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.07,"smiles":null,"spectrum_id":"CCMSLIB00017301869","spectrum_index":42954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 151.4091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.511,"smiles":null,"spectrum_id":"CCMSLIB00017301871","spectrum_index":42955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 334.178 Da; putative annotation: N/A; putative formula: C19H26O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.249,"smiles":null,"spectrum_id":"CCMSLIB00017301874","spectrum_index":42956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 18.0512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.154,"smiles":null,"spectrum_id":"CCMSLIB00017301876","spectrum_index":42957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 236.1793 Da; putative annotation: N/A; putative formula: CH16N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.22,"smiles":null,"spectrum_id":"CCMSLIB00017301879","spectrum_index":42958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 50.0196 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017301882","spectrum_index":42959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.091,"smiles":null,"spectrum_id":"CCMSLIB00017301885","spectrum_index":42960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 176.087 Da; putative annotation: N/A; putative formula: C8H16O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.184,"smiles":null,"spectrum_id":"CCMSLIB00017301886","spectrum_index":42961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 249.1005 Da; putative annotation: N/A; putative formula: C13H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.16,"smiles":null,"spectrum_id":"CCMSLIB00017301889","spectrum_index":42962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 111.0619 Da; putative annotation: N/A; putative formula: C6H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.084,"smiles":null,"spectrum_id":"CCMSLIB00017301892","spectrum_index":42963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 17.0995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.274,"smiles":null,"spectrum_id":"CCMSLIB00017301894","spectrum_index":42964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 10.9889 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.065,"smiles":null,"spectrum_id":"CCMSLIB00017301897","spectrum_index":42965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 24.9831 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.096,"smiles":null,"spectrum_id":"CCMSLIB00017301900","spectrum_index":42966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 56.0608 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.168,"smiles":null,"spectrum_id":"CCMSLIB00017301903","spectrum_index":42967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 394.2118 Da; putative annotation: N/A; putative formula: C21H26N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.35,"smiles":null,"spectrum_id":"CCMSLIB00017301905","spectrum_index":42968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Val (delta mass: 99.0677 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.222,"smiles":null,"spectrum_id":"CCMSLIB00017301908","spectrum_index":42969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 85.0316 Da; putative annotation: N/A; putative formula: C7H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017301911","spectrum_index":42970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 67.0535 Da; putative annotation: N/A; putative formula: C3H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.129,"smiles":null,"spectrum_id":"CCMSLIB00017301914","spectrum_index":42971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 100.058 Da; putative annotation: N/A; putative formula: C4H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.196,"smiles":null,"spectrum_id":"CCMSLIB00017301916","spectrum_index":42972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 340.1711 Da; putative annotation: N/A; putative formula: C18H28O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.231,"smiles":null,"spectrum_id":"CCMSLIB00017301919","spectrum_index":42973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-(methylsulfanyl)-1H-indole-2-carboxylate (delta mass: 14.0146 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.073,"smiles":null,"spectrum_id":"CCMSLIB00017301922","spectrum_index":42974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 119.0239 Da; putative annotation: N/A; putative formula: C4HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.137,"smiles":null,"spectrum_id":"CCMSLIB00017301924","spectrum_index":42975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 262.157 Da; putative annotation: N/A; putative formula: C16H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.281,"smiles":null,"spectrum_id":"CCMSLIB00017301926","spectrum_index":42976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 64.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.154,"smiles":null,"spectrum_id":"CCMSLIB00017301929","spectrum_index":42977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 179.0103 Da; putative annotation: N/A; putative formula: C4H10N3O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.108,"smiles":null,"spectrum_id":"CCMSLIB00017301932","spectrum_index":42978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 124.0136 Da; putative annotation: Kojic acid - 30.0 eV; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.084,"smiles":null,"spectrum_id":"CCMSLIB00017301934","spectrum_index":42979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 116.0626 Da; putative annotation: Cinnamyl alcohol; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.18,"smiles":null,"spectrum_id":"CCMSLIB00017301937","spectrum_index":42980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 228.1152 Da; putative annotation: Asp-Leu; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017301940","spectrum_index":42981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 126.0315 Da; putative annotation: 2-(Hydroxymethyl)-3-methoxy-2H-furan-5-one; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017301942","spectrum_index":42982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 158031 - 40.0 eV (delta mass: 191.0594 Da; putative annotation: [(Phenoxyacetyl)amino]acetic acid; putative formula: C10H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.146,"smiles":null,"spectrum_id":"CCMSLIB00017301945","spectrum_index":42983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 119.0445 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.131,"smiles":null,"spectrum_id":"CCMSLIB00017301948","spectrum_index":42984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 130.0633 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.171,"smiles":null,"spectrum_id":"CCMSLIB00017301951","spectrum_index":42985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1-Benzyl-2-methyl-1H-indol-3-yl)acetohydrazide (delta mass: 14.0249 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.185,"smiles":null,"spectrum_id":"CCMSLIB00017301954","spectrum_index":42986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 168.0573 Da; putative annotation: N/A; putative formula: C12H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.181,"smiles":null,"spectrum_id":"CCMSLIB00017301956","spectrum_index":42987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 21.9843 Da; putative annotation: N/A; putative formula: C2H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017301959","spectrum_index":42988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Chloro-2-hydroxy-4-phenyl-3-quinolinyl)acetic acid (delta mass: 14.0225 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.08,"smiles":null,"spectrum_id":"CCMSLIB00017301962","spectrum_index":42989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 106.0167 Da; putative annotation: N/A; putative formula: C5H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.176,"smiles":null,"spectrum_id":"CCMSLIB00017301964","spectrum_index":42990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 797.4934 Da; putative annotation: N/A; putative formula: C43H67N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.564,"smiles":null,"spectrum_id":"CCMSLIB00017301967","spectrum_index":42991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 796.1688 Da; putative annotation: N/A; putative formula: C32H48N2O9S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":962.291,"smiles":null,"spectrum_id":"CCMSLIB00017301970","spectrum_index":42992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 125.0462 Da; putative annotation: N/A; putative formula: C2H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.143,"smiles":null,"spectrum_id":"CCMSLIB00017301973","spectrum_index":42993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 40.0521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017301975","spectrum_index":42994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (Z,E)-Tetradeca-9,12-dienol from NIST14 (delta mass: 110.1086 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.314,"smiles":null,"spectrum_id":"CCMSLIB00017301977","spectrum_index":42995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 130.0634 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.165,"smiles":null,"spectrum_id":"CCMSLIB00017301980","spectrum_index":42996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 280.1872 Da; putative annotation: N/A; putative formula: C10H20N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.351,"smiles":null,"spectrum_id":"CCMSLIB00017301983","spectrum_index":42997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 199.0937 Da; putative annotation: N/A; putative formula: C4H9N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.192,"smiles":null,"spectrum_id":"CCMSLIB00017301986","spectrum_index":42998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 50.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.13,"smiles":null,"spectrum_id":"CCMSLIB00017301989","spectrum_index":42999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 55.0413 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.096,"smiles":null,"spectrum_id":"CCMSLIB00017301991","spectrum_index":43000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 215.0271 Da; putative annotation: N/A; putative formula: C9H5N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.124,"smiles":null,"spectrum_id":"CCMSLIB00017301994","spectrum_index":43001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 34.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.14,"smiles":null,"spectrum_id":"CCMSLIB00017301996","spectrum_index":43002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 252.0855 Da; putative annotation: N/A; putative formula: C10H20O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.219,"smiles":null,"spectrum_id":"CCMSLIB00017301999","spectrum_index":43003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 58.0049 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.211,"smiles":null,"spectrum_id":"CCMSLIB00017302002","spectrum_index":43004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 110.0725 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.336,"smiles":null,"spectrum_id":"CCMSLIB00017302005","spectrum_index":43005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-1H-pyrrole-2-carboxylic acid (delta mass: 46.0107 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.96,"smiles":null,"spectrum_id":"CCMSLIB00017302007","spectrum_index":43006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00332267-02!N-(2-phenylethyl)acetamide (delta mass: 92.0591 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.166,"smiles":null,"spectrum_id":"CCMSLIB00017302009","spectrum_index":43007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.102,"smiles":null,"spectrum_id":"CCMSLIB00017302012","spectrum_index":43008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ARABITOL (delta mass: 18.0615 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.137,"smiles":null,"spectrum_id":"CCMSLIB00017302015","spectrum_index":43009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 566.2545 Da; putative annotation: N/A; putative formula: C31H39N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.419,"smiles":null,"spectrum_id":"CCMSLIB00017302016","spectrum_index":43010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 333.195 Da; putative annotation: N/A; putative formula: C20H31NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.37,"smiles":null,"spectrum_id":"CCMSLIB00017302019","spectrum_index":43011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 605.5523 Da; putative annotation: N/A; putative formula: C42H71NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.624,"smiles":null,"spectrum_id":"CCMSLIB00017302022","spectrum_index":43012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aristolactam (delta mass: 266.1448 Da; putative annotation: N/A; putative formula: C14H22N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.221,"smiles":null,"spectrum_id":"CCMSLIB00017302025","spectrum_index":43013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 7.0076 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.083,"smiles":null,"spectrum_id":"CCMSLIB00017302027","spectrum_index":43014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 74.0407 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.101,"smiles":null,"spectrum_id":"CCMSLIB00017302029","spectrum_index":43015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 98.0455 Da; putative annotation: N/A; putative formula: H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.086,"smiles":null,"spectrum_id":"CCMSLIB00017302032","spectrum_index":43016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 145.0529 Da; putative annotation: N/A; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.186,"smiles":null,"spectrum_id":"CCMSLIB00017302035","spectrum_index":43017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Trifluoromethylphenyl)ethylamine (delta mass: 234.1402 Da; putative annotation: N/A; putative formula: C10H22N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.224,"smiles":null,"spectrum_id":"CCMSLIB00017302038","spectrum_index":43018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 45.0461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.174,"smiles":null,"spectrum_id":"CCMSLIB00017302039","spectrum_index":43019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 277.3696 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.64,"smiles":null,"spectrum_id":"CCMSLIB00017302042","spectrum_index":43020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 16.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.14,"smiles":null,"spectrum_id":"CCMSLIB00017302045","spectrum_index":43021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 161.0847 Da; putative annotation: N/A; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.135,"smiles":null,"spectrum_id":"CCMSLIB00017302048","spectrum_index":43022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 46.0092 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.122,"smiles":null,"spectrum_id":"CCMSLIB00017302050","spectrum_index":43023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 193.9512 Da; putative annotation: N/A; putative formula: N6O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.011,"smiles":null,"spectrum_id":"CCMSLIB00017302053","spectrum_index":43024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 367.3813 Da; putative annotation: N/A; putative formula: C24H49NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.463,"smiles":null,"spectrum_id":"CCMSLIB00017302055","spectrum_index":43025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 775.6161 Da; putative annotation: N/A; putative formula: C56H77N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":938.676,"smiles":null,"spectrum_id":"CCMSLIB00017302058","spectrum_index":43026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 334.2557 Da; putative annotation: N/A; putative formula: C19H34N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.405,"smiles":null,"spectrum_id":"CCMSLIB00017302061","spectrum_index":43027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 85.994 Da; putative annotation: N/A; putative formula: C2H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.082,"smiles":null,"spectrum_id":"CCMSLIB00017302064","spectrum_index":43028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyluridine (delta mass: 106.0222 Da; putative annotation: N/A; putative formula: C2H8N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.115,"smiles":null,"spectrum_id":"CCMSLIB00017302066","spectrum_index":43029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 41.0141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.074,"smiles":null,"spectrum_id":"CCMSLIB00017302068","spectrum_index":43030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 15.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.133,"smiles":null,"spectrum_id":"CCMSLIB00017302071","spectrum_index":43031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 79.0402 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.132,"smiles":null,"spectrum_id":"CCMSLIB00017302074","spectrum_index":43032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 375.5076 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.594,"smiles":null,"spectrum_id":"CCMSLIB00017302077","spectrum_index":43033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.258,"smiles":null,"spectrum_id":"CCMSLIB00017302078","spectrum_index":43034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 56.0264 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.092,"smiles":null,"spectrum_id":"CCMSLIB00017302081","spectrum_index":43035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 30.9342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.994,"smiles":null,"spectrum_id":"CCMSLIB00017302084","spectrum_index":43036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 173.0371 Da; putative annotation: N/A; putative formula: C4H7N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.108,"smiles":null,"spectrum_id":"CCMSLIB00017302087","spectrum_index":43037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 81.0461 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.169,"smiles":null,"spectrum_id":"CCMSLIB00017302090","spectrum_index":43038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 72.0215 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017302093","spectrum_index":43039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 182.1356 Da; putative annotation: N/A; putative formula: C10H19N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.259,"smiles":null,"spectrum_id":"CCMSLIB00017302094","spectrum_index":43040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nitrazepam (delta mass: 45.1142 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.202,"smiles":null,"spectrum_id":"CCMSLIB00017302097","spectrum_index":43041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 159.1146 Da; putative annotation: N/A; putative formula: C10H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.201,"smiles":null,"spectrum_id":"CCMSLIB00017302100","spectrum_index":43042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 75.0322 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.108,"smiles":null,"spectrum_id":"CCMSLIB00017302103","spectrum_index":43043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 99.0193 Da; putative annotation: N/A; putative formula: CHN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.09,"smiles":null,"spectrum_id":"CCMSLIB00017302106","spectrum_index":43044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxybutorphanol (delta mass: 308.1852 Da; putative annotation: N/A; putative formula: C15H24N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.407,"smiles":null,"spectrum_id":"CCMSLIB00017302108","spectrum_index":43045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 99.0321 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.087,"smiles":null,"spectrum_id":"CCMSLIB00017302110","spectrum_index":43046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corytuberine (delta mass: 361.1881 Da; putative annotation: N/A; putative formula: C14H28N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":689.342,"smiles":null,"spectrum_id":"CCMSLIB00017302113","spectrum_index":43047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 82.0501 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.105,"smiles":null,"spectrum_id":"CCMSLIB00017302116","spectrum_index":43048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 244.1093 Da; putative annotation: N/A; putative formula: C9H17N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.18,"smiles":null,"spectrum_id":"CCMSLIB00017302119","spectrum_index":43049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 10.0208 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.143,"smiles":null,"spectrum_id":"CCMSLIB00017302121","spectrum_index":43050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 333.2435 Da; putative annotation: N/A; putative formula: C17H36NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.309,"smiles":null,"spectrum_id":"CCMSLIB00017302123","spectrum_index":43051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 285.1374 Da; putative annotation: N/A; putative formula: C10H19N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.271,"smiles":null,"spectrum_id":"CCMSLIB00017302126","spectrum_index":43052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 53.0634 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.15,"smiles":null,"spectrum_id":"CCMSLIB00017302129","spectrum_index":43053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 178.0607 Da; putative annotation: N/A; putative formula: C6H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.163,"smiles":null,"spectrum_id":"CCMSLIB00017302132","spectrum_index":43054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 196.0377 Da; putative annotation: N/A; putative formula: C10H12S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.15,"smiles":null,"spectrum_id":"CCMSLIB00017302133","spectrum_index":43055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 64.0279 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.119,"smiles":null,"spectrum_id":"CCMSLIB00017302136","spectrum_index":43056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 85.0396 Da; putative annotation: N/A; putative formula: CH3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.12,"smiles":null,"spectrum_id":"CCMSLIB00017302139","spectrum_index":43057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 218.0789 Da; putative annotation: N/A; putative formula: C9H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.16,"smiles":null,"spectrum_id":"CCMSLIB00017302142","spectrum_index":43058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Allyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol (delta mass: 191.0946 Da; putative annotation: N/A; putative formula: C11H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.259,"smiles":null,"spectrum_id":"CCMSLIB00017302144","spectrum_index":43059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 123.0411 Da; putative annotation: N/A; putative formula: CHN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.149,"smiles":null,"spectrum_id":"CCMSLIB00017302146","spectrum_index":43060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 112.125 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.201,"smiles":null,"spectrum_id":"CCMSLIB00017302149","spectrum_index":43061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 79.0518 Da; putative annotation: N/A; putative formula: C4H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.174,"smiles":null,"spectrum_id":"CCMSLIB00017302152","spectrum_index":43062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 529.6901 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.844,"smiles":null,"spectrum_id":"CCMSLIB00017302155","spectrum_index":43063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Glu (delta mass: 240.0745 Da; putative annotation: N/A; putative formula: C15H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.193,"smiles":null,"spectrum_id":"CCMSLIB00017302156","spectrum_index":43064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 155.0404 Da; putative annotation: N/A; putative formula: C7H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.127,"smiles":null,"spectrum_id":"CCMSLIB00017302159","spectrum_index":43065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169735-02!(5S)-5-hydroxy-1,7-diphenylheptan-3-one (delta mass: 166.1201 Da; putative annotation: N/A; putative formula: C8H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.289,"smiles":null,"spectrum_id":"CCMSLIB00017302162","spectrum_index":43066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 432.1064 Da; putative annotation: N/A; putative formula: C14H20N6O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.219,"smiles":null,"spectrum_id":"CCMSLIB00017302165","spectrum_index":43067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 97.0304 Da; putative annotation: N/A; putative formula: C8H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.128,"smiles":null,"spectrum_id":"CCMSLIB00017302168","spectrum_index":43068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 65.0089 Da; putative annotation: N/A; putative formula: CH-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.105,"smiles":null,"spectrum_id":"CCMSLIB00017302170","spectrum_index":43069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 500.2348 Da; putative annotation: N/A; putative formula: C21H39N6O2P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.316,"smiles":null,"spectrum_id":"CCMSLIB00017302172","spectrum_index":43070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 649.5211 Da; putative annotation: N/A; putative formula: C38H71N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":835.593,"smiles":null,"spectrum_id":"CCMSLIB00017302175","spectrum_index":43071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 38.048 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.134,"smiles":null,"spectrum_id":"CCMSLIB00017302178","spectrum_index":43072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 12.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.092,"smiles":null,"spectrum_id":"CCMSLIB00017302181","spectrum_index":43073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 165.075 Da; putative annotation: N/A; putative formula: C4H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.155,"smiles":null,"spectrum_id":"CCMSLIB00017302182","spectrum_index":43074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 91.0367 Da; putative annotation: N/A; putative formula: CH5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.079,"smiles":null,"spectrum_id":"CCMSLIB00017302185","spectrum_index":43075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 991.9763 Da; putative annotation: N/A; putative formula: C66H125N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1214.07,"smiles":null,"spectrum_id":"CCMSLIB00017302188","spectrum_index":43076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 667.8183 Da; putative annotation: N/A; putative formula: C22H20S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":821.905,"smiles":null,"spectrum_id":"CCMSLIB00017302191","spectrum_index":43077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 120.0416 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.122,"smiles":null,"spectrum_id":"CCMSLIB00017302193","spectrum_index":43078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 500.1374 Da; putative annotation: N/A; putative formula: C24H28N4O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.229,"smiles":null,"spectrum_id":"CCMSLIB00017302195","spectrum_index":43079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1,2,3,4-tetrahydroquinoline (delta mass: 58.0277 Da; putative annotation: N/A; putative formula: H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.14,"smiles":null,"spectrum_id":"CCMSLIB00017302198","spectrum_index":43080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 281.2721 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.358,"smiles":null,"spectrum_id":"CCMSLIB00017302201","spectrum_index":43081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 200.0976 Da; putative annotation: N/A; putative formula: C9H16N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.184,"smiles":null,"spectrum_id":"CCMSLIB00017302202","spectrum_index":43082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 46.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.175,"smiles":null,"spectrum_id":"CCMSLIB00017302205","spectrum_index":43083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 212.0769 Da; putative annotation: N/A; putative formula: C5H8N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.118,"smiles":null,"spectrum_id":"CCMSLIB00017302208","spectrum_index":43084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 49.0061 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.144,"smiles":null,"spectrum_id":"CCMSLIB00017302211","spectrum_index":43085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 432.2882 Da; putative annotation: N/A; putative formula: C19H40N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.369,"smiles":null,"spectrum_id":"CCMSLIB00017302214","spectrum_index":43086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 92.0988 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.222,"smiles":null,"spectrum_id":"CCMSLIB00017302215","spectrum_index":43087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 291.1968 Da; putative annotation: N/A; putative formula: C14H30NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.231,"smiles":null,"spectrum_id":"CCMSLIB00017302218","spectrum_index":43088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 18.0644 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017302221","spectrum_index":43089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoroindole-2-carboxylic acid (delta mass: 131.1009 Da; putative annotation: N/A; putative formula: CH9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.146,"smiles":null,"spectrum_id":"CCMSLIB00017302224","spectrum_index":43090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 75.0367 Da; putative annotation: N/A; putative formula: CH6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017302225","spectrum_index":43091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 128.0651 Da; putative annotation: N/A; putative formula: C7H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.198,"smiles":null,"spectrum_id":"CCMSLIB00017302228","spectrum_index":43092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 138.0671 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.343,"smiles":null,"spectrum_id":"CCMSLIB00017302231","spectrum_index":43093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 166.0632 Da; putative annotation: N/A; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.144,"smiles":null,"spectrum_id":"CCMSLIB00017302234","spectrum_index":43094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 197.0896 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.243,"smiles":null,"spectrum_id":"CCMSLIB00017302235","spectrum_index":43095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2,3-dimethyl-1H-indole (delta mass: 179.0179 Da; putative annotation: N/A; putative formula: C3H5N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.075,"smiles":null,"spectrum_id":"CCMSLIB00017302238","spectrum_index":43096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 151.0843 Da; putative annotation: N/A; putative formula: H10N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.176,"smiles":null,"spectrum_id":"CCMSLIB00017302241","spectrum_index":43097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 406.2486 Da; putative annotation: N/A; putative formula: C20H39O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.387,"smiles":null,"spectrum_id":"CCMSLIB00017302244","spectrum_index":43098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 104.0586 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.134,"smiles":null,"spectrum_id":"CCMSLIB00017302247","spectrum_index":43099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 56.0045 Da; putative annotation: N/A; putative formula: C6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.09,"smiles":null,"spectrum_id":"CCMSLIB00017302248","spectrum_index":43100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 268.107 Da; putative annotation: N/A; putative formula: C13H20N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.23,"smiles":null,"spectrum_id":"CCMSLIB00017302251","spectrum_index":43101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 218.1062 Da; putative annotation: N/A; putative formula: C12H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.229,"smiles":null,"spectrum_id":"CCMSLIB00017302254","spectrum_index":43102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Met-C4:0 (delta mass: 219.0922 Da; putative annotation: N/A; putative formula: C11H14N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.192,"smiles":null,"spectrum_id":"CCMSLIB00017302257","spectrum_index":43103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 45.8872 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.0,"smiles":null,"spectrum_id":"CCMSLIB00017302259","spectrum_index":43104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-glucooctanoic .gamma.-lactone (delta mass: 92.0052 Da; putative annotation: N/A; putative formula: C9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.081,"smiles":null,"spectrum_id":"CCMSLIB00017302261","spectrum_index":43105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 204.0784 Da; putative annotation: N/A; putative formula: C12H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.165,"smiles":null,"spectrum_id":"CCMSLIB00017302264","spectrum_index":43106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Met (delta mass: 131.0393 Da; putative annotation: L-Methionine; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.13,"smiles":null,"spectrum_id":"CCMSLIB00017302267","spectrum_index":43107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 108.0211 Da; putative annotation: 1,2,4-Benzenetriol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.092,"smiles":null,"spectrum_id":"CCMSLIB00017302269","spectrum_index":43108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 163.0633 Da; putative annotation: 3-Hydroxyphenylalanine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.134,"smiles":null,"spectrum_id":"CCMSLIB00017302272","spectrum_index":43109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 129.0427 Da; putative annotation: Massbank:PR100162 L-Glutamic acid|Glu|L-Glutamate|alpha-Glutamic acid|L-alpha-Aminoglutaric Acid|(S)-2-Aminopentanedioic acid|L-1-Aminopropane-1,3-dicarboxylic Acid|1-Aminopropane-1,3-dicarboxylic acid|Aciglut|Glusate|; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.144,"smiles":null,"spectrum_id":"CCMSLIB00017302275","spectrum_index":43110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 380.2975 Da; putative annotation: 1-Oleoyl-2-acetyl-sn-glycerol; putative formula: C23H40O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.358,"smiles":null,"spectrum_id":"CCMSLIB00017302278","spectrum_index":43111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2.alpha.-Mannobiose from NIST14 (delta mass: 302.1876 Da; putative annotation: 3-HYDROXY-4-(SUCCIN-2-YL)-CARYOLANE delta-LACTONE; putative formula: C19H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.311,"smiles":null,"spectrum_id":"CCMSLIB00017302281","spectrum_index":43112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 167.2135 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.273,"smiles":null,"spectrum_id":"CCMSLIB00017302283","spectrum_index":43113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 150.0683 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.113,"smiles":null,"spectrum_id":"CCMSLIB00017302286","spectrum_index":43114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.087,"smiles":null,"spectrum_id":"CCMSLIB00017302288","spectrum_index":43115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 245.1264 Da; putative annotation: N/A; putative formula: C11H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017302291","spectrum_index":43116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 103.1184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.22,"smiles":null,"spectrum_id":"CCMSLIB00017302294","spectrum_index":43117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 102.0834 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.326,"smiles":null,"spectrum_id":"CCMSLIB00017302296","spectrum_index":43118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:MT000129 Indolelactic acid|indolelactate (delta mass: 43.9998 Da; putative annotation: N/A; putative formula: N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.081,"smiles":null,"spectrum_id":"CCMSLIB00017302299","spectrum_index":43119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 748.4348 Da; putative annotation: N/A; putative formula: C41H60N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1075.56,"smiles":null,"spectrum_id":"CCMSLIB00017302302","spectrum_index":43120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 78.0134 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.147,"smiles":null,"spectrum_id":"CCMSLIB00017302304","spectrum_index":43121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-7-methoxy-9H-pyrido[3,4-b]indol-8-yl)-2-methyl- (delta mass: 634.192 Da; putative annotation: N/A; putative formula: C32H34N4O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1001.29,"smiles":null,"spectrum_id":"CCMSLIB00017302307","spectrum_index":43122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 190.0634 Da; putative annotation: N/A; putative formula: C4H10N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.118,"smiles":null,"spectrum_id":"CCMSLIB00017302310","spectrum_index":43123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine CollisionEnergy:102040 (delta mass: 255.2285 Da; putative annotation: N/A; putative formula: C10H25N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.325,"smiles":null,"spectrum_id":"CCMSLIB00017302312","spectrum_index":43124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 175.1209 Da; putative annotation: N/A; putative formula: C8H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.295,"smiles":null,"spectrum_id":"CCMSLIB00017302315","spectrum_index":43125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 30.9946 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.074,"smiles":null,"spectrum_id":"CCMSLIB00017302318","spectrum_index":43126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 174.0478 Da; putative annotation: N/A; putative formula: C6H12N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.171,"smiles":null,"spectrum_id":"CCMSLIB00017302321","spectrum_index":43127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 331.1912 Da; putative annotation: N/A; putative formula: C16H30NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.289,"smiles":null,"spectrum_id":"CCMSLIB00017302322","spectrum_index":43128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methoxy-2-pyridinylamine (delta mass: 192.0791 Da; putative annotation: N/A; putative formula: C11H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.15,"smiles":null,"spectrum_id":"CCMSLIB00017302325","spectrum_index":43129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 405.1438 Da; putative annotation: N/A; putative formula: C21H19N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.204,"smiles":null,"spectrum_id":"CCMSLIB00017302328","spectrum_index":43130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 211.0689 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.165,"smiles":null,"spectrum_id":"CCMSLIB00017302331","spectrum_index":43131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 207.0948 Da; putative annotation: N/A; putative formula: C9H13N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.16,"smiles":null,"spectrum_id":"CCMSLIB00017302332","spectrum_index":43132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 163.0829 Da; putative annotation: N/A; putative formula: C10H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.227,"smiles":null,"spectrum_id":"CCMSLIB00017302335","spectrum_index":43133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 481.2937 Da; putative annotation: N/A; putative formula: C28H39N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.369,"smiles":null,"spectrum_id":"CCMSLIB00017302338","spectrum_index":43134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 164.0807 Da; putative annotation: N/A; putative formula: C6H8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.177,"smiles":null,"spectrum_id":"CCMSLIB00017302341","spectrum_index":43135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 159.087 Da; putative annotation: N/A; putative formula: C3H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.189,"smiles":null,"spectrum_id":"CCMSLIB00017302343","spectrum_index":43136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 308.1537 Da; putative annotation: N/A; putative formula: C17H25O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.24,"smiles":null,"spectrum_id":"CCMSLIB00017302345","spectrum_index":43137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 647.2729 Da; putative annotation: N/A; putative formula: C36H41NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.369,"smiles":null,"spectrum_id":"CCMSLIB00017302348","spectrum_index":43138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 170.1336 Da; putative annotation: N/A; putative formula: C9H19N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.204,"smiles":null,"spectrum_id":"CCMSLIB00017302351","spectrum_index":43139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 192.1363 Da; putative annotation: N/A; putative formula: C10H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.196,"smiles":null,"spectrum_id":"CCMSLIB00017302353","spectrum_index":43140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 118.0418 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.102,"smiles":null,"spectrum_id":"CCMSLIB00017302356","spectrum_index":43141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 44.0403 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.121,"smiles":null,"spectrum_id":"CCMSLIB00017302359","spectrum_index":43142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Chloralose (delta mass: 98.0254 Da; putative annotation: N/A; putative formula: C7H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.995,"smiles":null,"spectrum_id":"CCMSLIB00017302361","spectrum_index":43143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 204.1142 Da; putative annotation: N/A; putative formula: C7H17N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.159,"smiles":null,"spectrum_id":"CCMSLIB00017302364","spectrum_index":43144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine (delta mass: 98.1527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.417,"smiles":null,"spectrum_id":"CCMSLIB00017302367","spectrum_index":43145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Norepinephrine (delta mass: 58.0417 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017302369","spectrum_index":43146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 199.236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.384,"smiles":null,"spectrum_id":"CCMSLIB00017302372","spectrum_index":43147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 250.1723 Da; putative annotation: N/A; putative formula: C19H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.259,"smiles":null,"spectrum_id":"CCMSLIB00017302374","spectrum_index":43148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 173.0477 Da; putative annotation: N/A; putative formula: C10H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.123,"smiles":null,"spectrum_id":"CCMSLIB00017302377","spectrum_index":43149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 143.0578 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017302380","spectrum_index":43150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 29.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017302382","spectrum_index":43151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-.beta.-carboline (delta mass: 76.0214 Da; putative annotation: N/A; putative formula: H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.129,"smiles":null,"spectrum_id":"CCMSLIB00017302385","spectrum_index":43152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 38.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.207,"smiles":null,"spectrum_id":"CCMSLIB00017302387","spectrum_index":43153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 90.067 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.132,"smiles":null,"spectrum_id":"CCMSLIB00017302390","spectrum_index":43154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 36.0329 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.044,"smiles":null,"spectrum_id":"CCMSLIB00017302393","spectrum_index":43155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 63.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.238,"smiles":null,"spectrum_id":"CCMSLIB00017302396","spectrum_index":43156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxybutorphanol (delta mass: 281.1352 Da; putative annotation: N/A; putative formula: C17H19N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.357,"smiles":null,"spectrum_id":"CCMSLIB00017302399","spectrum_index":43157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 620.1509 Da; putative annotation: N/A; putative formula: C29H36N2O5S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.222,"smiles":null,"spectrum_id":"CCMSLIB00017302401","spectrum_index":43158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 58.0114 Da; putative annotation: N/A; putative formula: CH3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.155,"smiles":null,"spectrum_id":"CCMSLIB00017302403","spectrum_index":43159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 59.1101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.233,"smiles":null,"spectrum_id":"CCMSLIB00017302406","spectrum_index":43160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dextrorphan (delta mass: 132.0576 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.243,"smiles":null,"spectrum_id":"CCMSLIB00017302409","spectrum_index":43161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 99.067 Da; putative annotation: N/A; putative formula: CH5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.19,"smiles":null,"spectrum_id":"CCMSLIB00017302411","spectrum_index":43162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 132.0687 Da; putative annotation: N/A; putative formula: C8H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.155,"smiles":null,"spectrum_id":"CCMSLIB00017302414","spectrum_index":43163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 193.1104 Da; putative annotation: N/A; putative formula: C11H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.197,"smiles":null,"spectrum_id":"CCMSLIB00017302417","spectrum_index":43164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311158 Methoxytyramine (delta mass: 116.0012 Da; putative annotation: N/A; putative formula: C6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.103,"smiles":null,"spectrum_id":"CCMSLIB00017302420","spectrum_index":43165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 43.042 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.097,"smiles":null,"spectrum_id":"CCMSLIB00017302422","spectrum_index":43166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 22.0207 Da; putative annotation: N/A; putative formula: C3H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017302425","spectrum_index":43167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxy-3,5-dimethoxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 31.0488 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.156,"smiles":null,"spectrum_id":"CCMSLIB00017302428","spectrum_index":43168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 149.0699 Da; putative annotation: N/A; putative formula: C6H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.271,"smiles":null,"spectrum_id":"CCMSLIB00017302431","spectrum_index":43169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM836003 Indoline|Indoline|2,3-dihydro-1H-indole (delta mass: 19.0033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.084,"smiles":null,"spectrum_id":"CCMSLIB00017302433","spectrum_index":43170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 17.0873 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.237,"smiles":null,"spectrum_id":"CCMSLIB00017302436","spectrum_index":43171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 356.1752 Da; putative annotation: N/A; putative formula: C18H29O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.262,"smiles":null,"spectrum_id":"CCMSLIB00017302439","spectrum_index":43172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 370.2429 Da; putative annotation: N/A; putative formula: C24H35OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.329,"smiles":null,"spectrum_id":"CCMSLIB00017302442","spectrum_index":43173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 445.1215 Da; putative annotation: N/A; putative formula: C16H19N11OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.307,"smiles":null,"spectrum_id":"CCMSLIB00017302443","spectrum_index":43174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 244.0885 Da; putative annotation: N/A; putative formula: C18H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.17,"smiles":null,"spectrum_id":"CCMSLIB00017302446","spectrum_index":43175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 127.1037 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.179,"smiles":null,"spectrum_id":"CCMSLIB00017302449","spectrum_index":43176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 40.0718 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.148,"smiles":null,"spectrum_id":"CCMSLIB00017302451","spectrum_index":43177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 380.0903 Da; putative annotation: N/A; putative formula: C14H16N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.161,"smiles":null,"spectrum_id":"CCMSLIB00017302454","spectrum_index":43178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 542.2213 Da; putative annotation: N/A; putative formula: C28H30N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":885.345,"smiles":null,"spectrum_id":"CCMSLIB00017302456","spectrum_index":43179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 367.7176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.841,"smiles":null,"spectrum_id":"CCMSLIB00017302459","spectrum_index":43180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 367.3225 Da; putative annotation: N/A; putative formula: C20H42N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.446,"smiles":null,"spectrum_id":"CCMSLIB00017302462","spectrum_index":43181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 202.0634 Da; putative annotation: N/A; putative formula: C5H10N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.139,"smiles":null,"spectrum_id":"CCMSLIB00017302464","spectrum_index":43182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 281.2316 Da; putative annotation: N/A; putative formula: C13H27N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.385,"smiles":null,"spectrum_id":"CCMSLIB00017302466","spectrum_index":43183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 238.0744 Da; putative annotation: N/A; putative formula: C14H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.156,"smiles":null,"spectrum_id":"CCMSLIB00017302469","spectrum_index":43184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 73.0103 Da; putative annotation: N/A; putative formula: CH3N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.053,"smiles":null,"spectrum_id":"CCMSLIB00017302472","spectrum_index":43185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 277.1523 Da; putative annotation: N/A; putative formula: C12H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.239,"smiles":null,"spectrum_id":"CCMSLIB00017302475","spectrum_index":43186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 82.0317 Da; putative annotation: N/A; putative formula: C5H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.145,"smiles":null,"spectrum_id":"CCMSLIB00017302478","spectrum_index":43187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 86.0155 Da; putative annotation: N/A; putative formula: C7H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.07,"smiles":null,"spectrum_id":"CCMSLIB00017302479","spectrum_index":43188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 156.0208 Da; putative annotation: N/A; putative formula: C10H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.175,"smiles":null,"spectrum_id":"CCMSLIB00017302482","spectrum_index":43189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 143.1587 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.349,"smiles":null,"spectrum_id":"CCMSLIB00017302485","spectrum_index":43190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 9.0117 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":121.051,"smiles":null,"spectrum_id":"CCMSLIB00017302488","spectrum_index":43191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (1S,15S,17S)-17-[(1S)-1-hydroxyethyl]-3,13-diazapentacyclo[13.3.1.0,?.0?,?.0,?]nonadeca-2(10),4,6,8-tetraene-1-carboxylate (delta mass: 161.0481 Da; putative annotation: N/A; putative formula: C9H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.25,"smiles":null,"spectrum_id":"CCMSLIB00017302490","spectrum_index":43192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 349.2104 Da; putative annotation: N/A; putative formula: C19H32N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.286,"smiles":null,"spectrum_id":"CCMSLIB00017302493","spectrum_index":43193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 44.0739 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.134,"smiles":null,"spectrum_id":"CCMSLIB00017302496","spectrum_index":43194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 320.2723 Da; putative annotation: N/A; putative formula: C21H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.343,"smiles":null,"spectrum_id":"CCMSLIB00017302498","spectrum_index":43195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 54.0195 Da; putative annotation: N/A; putative formula: C2H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017302500","spectrum_index":43196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003355 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.06,"smiles":null,"spectrum_id":"CCMSLIB00017302503","spectrum_index":43197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 364.1846 Da; putative annotation: N/A; putative formula: C18H37O-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.245,"smiles":null,"spectrum_id":"CCMSLIB00017302506","spectrum_index":43198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 349.324 Da; putative annotation: N/A; putative formula: C23H44NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.4,"smiles":null,"spectrum_id":"CCMSLIB00017302509","spectrum_index":43199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 255.1776 Da; putative annotation: N/A; putative formula: C13H25N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.254,"smiles":null,"spectrum_id":"CCMSLIB00017302511","spectrum_index":43200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 421.1735 Da; putative annotation: N/A; putative formula: C21H27NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.286,"smiles":null,"spectrum_id":"CCMSLIB00017302513","spectrum_index":43201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 256.0759 Da; putative annotation: N/A; putative formula: C14H13N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.162,"smiles":null,"spectrum_id":"CCMSLIB00017302516","spectrum_index":43202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 1031.3541 Da; putative annotation: N/A; putative formula: C51H57N3O20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1698.58,"smiles":null,"spectrum_id":"CCMSLIB00017302519","spectrum_index":43203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of n-methyl-2,4-dihydroxy-3-phenylquinoline (delta mass: 17.0347 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.137,"smiles":null,"spectrum_id":"CCMSLIB00017302522","spectrum_index":43204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 430.0466 Da; putative annotation: N/A; putative formula: C11H18N4O10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.133,"smiles":null,"spectrum_id":"CCMSLIB00017302523","spectrum_index":43205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017302526","spectrum_index":43206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 431.1444 Da; putative annotation: N/A; putative formula: C19H21N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.215,"smiles":null,"spectrum_id":"CCMSLIB00017302529","spectrum_index":43207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 77.0902 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017302532","spectrum_index":43208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 110.0154 Da; putative annotation: N/A; putative formula: C9H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017302535","spectrum_index":43209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 113.0856 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.256,"smiles":null,"spectrum_id":"CCMSLIB00017302536","spectrum_index":43210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 153.1878 Da; putative annotation: N/A; putative formula: C11H23NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.285,"smiles":null,"spectrum_id":"CCMSLIB00017302539","spectrum_index":43211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 115.0275 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.182,"smiles":null,"spectrum_id":"CCMSLIB00017302542","spectrum_index":43212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 439.348 Da; putative annotation: N/A; putative formula: C28H46N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.502,"smiles":null,"spectrum_id":"CCMSLIB00017302545","spectrum_index":43213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 525.2085 Da; putative annotation: N/A; putative formula: C23H27N9O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.321,"smiles":null,"spectrum_id":"CCMSLIB00017302548","spectrum_index":43214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 77.0462 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.112,"smiles":null,"spectrum_id":"CCMSLIB00017302549","spectrum_index":43215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 125.0841 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.186,"smiles":null,"spectrum_id":"CCMSLIB00017302552","spectrum_index":43216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285111 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 119.0464 Da; putative annotation: N/A; putative formula: C6H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.206,"smiles":null,"spectrum_id":"CCMSLIB00017302555","spectrum_index":43217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 191.0108 Da; putative annotation: N/A; putative formula: C5H10N3O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.097,"smiles":null,"spectrum_id":"CCMSLIB00017302557","spectrum_index":43218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 160.0372 Da; putative annotation: N/A; putative formula: C6H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.129,"smiles":null,"spectrum_id":"CCMSLIB00017302559","spectrum_index":43219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 226.2186 Da; putative annotation: N/A; putative formula: C15H31O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.253,"smiles":null,"spectrum_id":"CCMSLIB00017302562","spectrum_index":43220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 14.8617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.932,"smiles":null,"spectrum_id":"CCMSLIB00017302565","spectrum_index":43221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 322.2871 Da; putative annotation: N/A; putative formula: C21H38O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.373,"smiles":null,"spectrum_id":"CCMSLIB00017302568","spectrum_index":43222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380084-01_C21H30O4_Benzo[b]cyclopenta[e]pyran-8(3H)-one, 3a,5,6,7,9,9a-hexahydro-7-hydroxy-1-[(4E)-6-hydroxy-1,5-dimethyl-4-hexen-1-yl]-3a-methyl- (delta mass: 60.0189 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.241,"smiles":null,"spectrum_id":"CCMSLIB00017302569","spectrum_index":43223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 312.029 Da; putative annotation: N/A; putative formula: C10H12N6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.1,"smiles":null,"spectrum_id":"CCMSLIB00017302572","spectrum_index":43224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 163.0635 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.187,"smiles":null,"spectrum_id":"CCMSLIB00017302575","spectrum_index":43225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.102,"smiles":null,"spectrum_id":"CCMSLIB00017302578","spectrum_index":43226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 284.1052 Da; putative annotation: N/A; putative formula: C17H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.165,"smiles":null,"spectrum_id":"CCMSLIB00017302579","spectrum_index":43227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 121.0202 Da; putative annotation: N/A; putative formula: C3H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.17,"smiles":null,"spectrum_id":"CCMSLIB00017302582","spectrum_index":43228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 147.0685 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.15,"smiles":null,"spectrum_id":"CCMSLIB00017302585","spectrum_index":43229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169735-02!(5S)-5-hydroxy-1,7-diphenylheptan-3-one (delta mass: 135.054 Da; putative annotation: N/A; putative formula: C5H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.223,"smiles":null,"spectrum_id":"CCMSLIB00017302587","spectrum_index":43230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 90.0168 Da; putative annotation: N/A; putative formula: H2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.103,"smiles":null,"spectrum_id":"CCMSLIB00017302590","spectrum_index":43231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 47.0241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.1,"smiles":null,"spectrum_id":"CCMSLIB00017302592","spectrum_index":43232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 24.9977 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.062,"smiles":null,"spectrum_id":"CCMSLIB00017302595","spectrum_index":43233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 92.0466 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017302598","spectrum_index":43234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.06,"smiles":null,"spectrum_id":"CCMSLIB00017302601","spectrum_index":43235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 157.0528 Da; putative annotation: N/A; putative formula: C10H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.134,"smiles":null,"spectrum_id":"CCMSLIB00017302604","spectrum_index":43236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 87.9126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.072,"smiles":null,"spectrum_id":"CCMSLIB00017302606","spectrum_index":43237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 239.161 Da; putative annotation: N/A; putative formula: C8H17N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.284,"smiles":null,"spectrum_id":"CCMSLIB00017302608","spectrum_index":43238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 74.0365 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.117,"smiles":null,"spectrum_id":"CCMSLIB00017302611","spectrum_index":43239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 27.0829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.143,"smiles":null,"spectrum_id":"CCMSLIB00017302614","spectrum_index":43240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Azaindole (delta mass: 55.0877 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.148,"smiles":null,"spectrum_id":"CCMSLIB00017302617","spectrum_index":43241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 105.0538 Da; putative annotation: N/A; putative formula: C2H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.113,"smiles":null,"spectrum_id":"CCMSLIB00017302619","spectrum_index":43242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,4-Trifluorobutan-1-amine (delta mass: 36.0017 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.07,"smiles":null,"spectrum_id":"CCMSLIB00017302622","spectrum_index":43243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine methyl ester (delta mass: 538.2054 Da; putative annotation: N/A; putative formula: C21H31N8O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.282,"smiles":null,"spectrum_id":"CCMSLIB00017302625","spectrum_index":43244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Leu-Pro-Lys from NIST14 (delta mass: 128.0588 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.308,"smiles":null,"spectrum_id":"CCMSLIB00017302627","spectrum_index":43245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 909.6383 Da; putative annotation: N/A; putative formula: C61H79N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1072.7,"smiles":null,"spectrum_id":"CCMSLIB00017302630","spectrum_index":43246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 101.0471 Da; putative annotation: (S)-(+)-4-Amino-3-hydroxybutyric acid; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.107,"smiles":null,"spectrum_id":"CCMSLIB00017302633","spectrum_index":43247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 144.0573 Da; putative annotation: 6-Hydroxy-3,4-dihydro-1(2H)-naphthalenone; putative formula: C10H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.128,"smiles":null,"spectrum_id":"CCMSLIB00017302636","spectrum_index":43248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 262.229 Da; putative annotation: Stearolic acid; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.305,"smiles":null,"spectrum_id":"CCMSLIB00017302639","spectrum_index":43249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 310.1421 Da; putative annotation: 5-(Hydroxymethyl)-2-(propan-2-yl)phenyl .beta.-D-glucopyranoside; putative formula: C16H22O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.202,"smiles":null,"spectrum_id":"CCMSLIB00017302641","spectrum_index":43250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 210.1257 Da; putative annotation: Traumatic Acid - 40.0 eV; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.212,"smiles":null,"spectrum_id":"CCMSLIB00017302644","spectrum_index":43251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 67.0421 Da; putative annotation: 2-Pyrrolidinone; AIF; CE10; CorrDec; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017302646","spectrum_index":43252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 144.042 Da; putative annotation: N/A; putative formula: C6H8O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.107,"smiles":null,"spectrum_id":"CCMSLIB00017302649","spectrum_index":43253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ASP-PHE (delta mass: 99.0688 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.182,"smiles":null,"spectrum_id":"CCMSLIB00017302652","spectrum_index":43254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 140.0623 Da; putative annotation: N/A; putative formula: C11H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.186,"smiles":null,"spectrum_id":"CCMSLIB00017302655","spectrum_index":43255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 912.3128 Da; putative annotation: N/A; putative formula: C53H48N6O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1134.41,"smiles":null,"spectrum_id":"CCMSLIB00017302657","spectrum_index":43256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.092,"smiles":null,"spectrum_id":"CCMSLIB00017302659","spectrum_index":43257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 123.9193 Da; putative annotation: N/A; putative formula: CHOPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.974,"smiles":null,"spectrum_id":"CCMSLIB00017302662","spectrum_index":43258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine (delta mass: 141.0782 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.254,"smiles":null,"spectrum_id":"CCMSLIB00017302665","spectrum_index":43259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 197.1053 Da; putative annotation: N/A; putative formula: C10H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.181,"smiles":null,"spectrum_id":"CCMSLIB00017302668","spectrum_index":43260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 195.1489 Da; putative annotation: N/A; putative formula: C9H17N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.214,"smiles":null,"spectrum_id":"CCMSLIB00017302670","spectrum_index":43261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 255.2557 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.352,"smiles":null,"spectrum_id":"CCMSLIB00017302672","spectrum_index":43262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 168.1842 Da; putative annotation: N/A; putative formula: C12H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.269,"smiles":null,"spectrum_id":"CCMSLIB00017302675","spectrum_index":43263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 170.1096 Da; putative annotation: N/A; putative formula: C13H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.165,"smiles":null,"spectrum_id":"CCMSLIB00017302678","spectrum_index":43264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 43.0422 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.154,"smiles":null,"spectrum_id":"CCMSLIB00017302680","spectrum_index":43265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 45.0367 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.155,"smiles":null,"spectrum_id":"CCMSLIB00017302682","spectrum_index":43266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 219.0531 Da; putative annotation: N/A; putative formula: C11H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.255,"smiles":null,"spectrum_id":"CCMSLIB00017302685","spectrum_index":43267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 76.0316 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.182,"smiles":null,"spectrum_id":"CCMSLIB00017302688","spectrum_index":43268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 78.0645 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.167,"smiles":null,"spectrum_id":"CCMSLIB00017302690","spectrum_index":43269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 211.1488 Da; putative annotation: N/A; putative formula: C12H22NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.251,"smiles":null,"spectrum_id":"CCMSLIB00017302692","spectrum_index":43270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 452.2629 Da; putative annotation: N/A; putative formula: C22H44O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.328,"smiles":null,"spectrum_id":"CCMSLIB00017302695","spectrum_index":43271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chymostatinol A (delta mass: 313.1336 Da; putative annotation: N/A; putative formula: C17H20N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":909.453,"smiles":null,"spectrum_id":"CCMSLIB00017302698","spectrum_index":43272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 45.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.207,"smiles":null,"spectrum_id":"CCMSLIB00017302700","spectrum_index":43273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 94.0419 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.284,"smiles":null,"spectrum_id":"CCMSLIB00017302703","spectrum_index":43274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 261.1671 Da; putative annotation: N/A; putative formula: C15H23N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.249,"smiles":null,"spectrum_id":"CCMSLIB00017302706","spectrum_index":43275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 13.9312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.996,"smiles":null,"spectrum_id":"CCMSLIB00017302709","spectrum_index":43276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 304.1862 Da; putative annotation: N/A; putative formula: C19H28OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.272,"smiles":null,"spectrum_id":"CCMSLIB00017302711","spectrum_index":43277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 343.1117 Da; putative annotation: N/A; putative formula: C11H21NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.224,"smiles":null,"spectrum_id":"CCMSLIB00017302713","spectrum_index":43278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Thr-Lys (delta mass: 69.058 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.271,"smiles":null,"spectrum_id":"CCMSLIB00017302716","spectrum_index":43279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 238.1205 Da; putative annotation: N/A; putative formula: C13H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.191,"smiles":null,"spectrum_id":"CCMSLIB00017302719","spectrum_index":43280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 148.039 Da; putative annotation: N/A; putative formula: C6H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.11,"smiles":null,"spectrum_id":"CCMSLIB00017302721","spectrum_index":43281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 558.3559 Da; putative annotation: N/A; putative formula: C33H50O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.442,"smiles":null,"spectrum_id":"CCMSLIB00017302723","spectrum_index":43282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 212.0793 Da; putative annotation: N/A; putative formula: C9H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.176,"smiles":null,"spectrum_id":"CCMSLIB00017302726","spectrum_index":43283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 382.1136 Da; putative annotation: N/A; putative formula: C16H14N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.184,"smiles":null,"spectrum_id":"CCMSLIB00017302729","spectrum_index":43284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 577.5791 Da; putative annotation: N/A; putative formula: C38H75NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.639,"smiles":null,"spectrum_id":"CCMSLIB00017302732","spectrum_index":43285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 182.047 Da; putative annotation: N/A; putative formula: C5H7N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.129,"smiles":null,"spectrum_id":"CCMSLIB00017302734","spectrum_index":43286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 473.2978 Da; putative annotation: N/A; putative formula: C29H39N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.358,"smiles":null,"spectrum_id":"CCMSLIB00017302736","spectrum_index":43287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HYDROQUINIDINE (delta mass: 502.3099 Da; putative annotation: N/A; putative formula: C34H38N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.517,"smiles":null,"spectrum_id":"CCMSLIB00017302739","spectrum_index":43288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 572.3025 Da; putative annotation: N/A; putative formula: C22H40N10O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.467,"smiles":null,"spectrum_id":"CCMSLIB00017302742","spectrum_index":43289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 246.089 Da; putative annotation: N/A; putative formula: C14H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.176,"smiles":null,"spectrum_id":"CCMSLIB00017302744","spectrum_index":43290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 46.0993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.196,"smiles":null,"spectrum_id":"CCMSLIB00017302746","spectrum_index":43291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 233.0661 Da; putative annotation: N/A; putative formula: C8H7N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.147,"smiles":null,"spectrum_id":"CCMSLIB00017302749","spectrum_index":43292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 366.1518 Da; putative annotation: N/A; putative formula: C12H28N6OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.21,"smiles":null,"spectrum_id":"CCMSLIB00017302752","spectrum_index":43293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 419.6974 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.795,"smiles":null,"spectrum_id":"CCMSLIB00017302755","spectrum_index":43294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 277.2886 Da; putative annotation: N/A; putative formula: C18H35N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.354,"smiles":null,"spectrum_id":"CCMSLIB00017302756","spectrum_index":43295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 54.0466 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.195,"smiles":null,"spectrum_id":"CCMSLIB00017302759","spectrum_index":43296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 126.0394 Da; putative annotation: N/A; putative formula: CH2N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.115,"smiles":null,"spectrum_id":"CCMSLIB00017302762","spectrum_index":43297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpyridin-4-ylamine (delta mass: 30.0462 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.122,"smiles":null,"spectrum_id":"CCMSLIB00017302764","spectrum_index":43298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine CollisionEnergy:102040 (delta mass: 338.2607 Da; putative annotation: N/A; putative formula: C24H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.357,"smiles":null,"spectrum_id":"CCMSLIB00017302766","spectrum_index":43299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 106.973 Da; putative annotation: N/A; putative formula: H2N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.153,"smiles":null,"spectrum_id":"CCMSLIB00017302769","spectrum_index":43300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 96.019 Da; putative annotation: N/A; putative formula: CN6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.116,"smiles":null,"spectrum_id":"CCMSLIB00017302772","spectrum_index":43301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 119.0374 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017302775","spectrum_index":43302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 146.0215 Da; putative annotation: N/A; putative formula: C5H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.081,"smiles":null,"spectrum_id":"CCMSLIB00017302778","spectrum_index":43303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 209.0682 Da; putative annotation: N/A; putative formula: C4H12N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.159,"smiles":null,"spectrum_id":"CCMSLIB00017302779","spectrum_index":43304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleyl alcohol (delta mass: 69.0576 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.341,"smiles":null,"spectrum_id":"CCMSLIB00017302782","spectrum_index":43305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 99.9826 Da; putative annotation: N/A; putative formula: C2HN2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.132,"smiles":null,"spectrum_id":"CCMSLIB00017302785","spectrum_index":43306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 25.0295 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.126,"smiles":null,"spectrum_id":"CCMSLIB00017302788","spectrum_index":43307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 92.0261 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.092,"smiles":null,"spectrum_id":"CCMSLIB00017302791","spectrum_index":43308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6H-Indolo[2,3-b]quinoline (delta mass: 71.9853 Da; putative annotation: N/A; putative formula: C2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.077,"smiles":null,"spectrum_id":"CCMSLIB00017302793","spectrum_index":43309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 266.277 Da; putative annotation: N/A; putative formula: C17H34N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.348,"smiles":null,"spectrum_id":"CCMSLIB00017302795","spectrum_index":43310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 111.0324 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.187,"smiles":null,"spectrum_id":"CCMSLIB00017302798","spectrum_index":43311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxybutorphanol (delta mass: 251.1255 Da; putative annotation: N/A; putative formula: C14H22NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.347,"smiles":null,"spectrum_id":"CCMSLIB00017302801","spectrum_index":43312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 316.143 Da; putative annotation: N/A; putative formula: C18H24N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.24,"smiles":null,"spectrum_id":"CCMSLIB00017302803","spectrum_index":43313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 44.006 Da; putative annotation: N/A; putative formula: C5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.113,"smiles":null,"spectrum_id":"CCMSLIB00017302806","spectrum_index":43314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 141.0415 Da; putative annotation: N/A; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.101,"smiles":null,"spectrum_id":"CCMSLIB00017302808","spectrum_index":43315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 97.0164 Da; putative annotation: N/A; putative formula: C4H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017302811","spectrum_index":43316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 122.078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.165,"smiles":null,"spectrum_id":"CCMSLIB00017302813","spectrum_index":43317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 625.7764 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.841,"smiles":null,"spectrum_id":"CCMSLIB00017302816","spectrum_index":43318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 24.0462 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017302819","spectrum_index":43319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 31.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.296,"smiles":null,"spectrum_id":"CCMSLIB00017302821","spectrum_index":43320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palatinose (delta mass: 89.0477 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.171,"smiles":null,"spectrum_id":"CCMSLIB00017302823","spectrum_index":43321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 415.1484 Da; putative annotation: N/A; putative formula: C21H26N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.219,"smiles":null,"spectrum_id":"CCMSLIB00017302826","spectrum_index":43322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 401.1845 Da; putative annotation: N/A; putative formula: C15H27N7O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.255,"smiles":null,"spectrum_id":"CCMSLIB00017302829","spectrum_index":43323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 366.7138 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.837,"smiles":null,"spectrum_id":"CCMSLIB00017302832","spectrum_index":43324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 69.01 Da; putative annotation: N/A; putative formula: H-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017302834","spectrum_index":43325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0,.0?,?.0?,?]octadeca-7(18),8,10,15-tetraen-14-ol (delta mass: 38.9959 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.155,"smiles":null,"spectrum_id":"CCMSLIB00017302837","spectrum_index":43326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 166.0594 Da; putative annotation: N/A; putative formula: C4H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.193,"smiles":null,"spectrum_id":"CCMSLIB00017302840","spectrum_index":43327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 386.1331 Da; putative annotation: N/A; putative formula: C21H23ClN2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.245,"smiles":null,"spectrum_id":"CCMSLIB00017302842","spectrum_index":43328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of butyrylhomoserine (delta mass: 126.1038 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.211,"smiles":null,"spectrum_id":"CCMSLIB00017302845","spectrum_index":43329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 117.0274 Da; putative annotation: N/A; putative formula: C4H9NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.092,"smiles":null,"spectrum_id":"CCMSLIB00017302848","spectrum_index":43330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxyphenyl)-1H-indole-3-carbaldehyde (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.128,"smiles":null,"spectrum_id":"CCMSLIB00017302851","spectrum_index":43331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 298.0902 Da; putative annotation: N/A; putative formula: C15H16N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.224,"smiles":null,"spectrum_id":"CCMSLIB00017302853","spectrum_index":43332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 184.1006 Da; putative annotation: N/A; putative formula: C12H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.197,"smiles":null,"spectrum_id":"CCMSLIB00017302856","spectrum_index":43333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 489.3298 Da; putative annotation: N/A; putative formula: C25H47NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.401,"smiles":null,"spectrum_id":"CCMSLIB00017302859","spectrum_index":43334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 215.1738 Da; putative annotation: N/A; putative formula: C9H21N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.265,"smiles":null,"spectrum_id":"CCMSLIB00017302860","spectrum_index":43335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 35.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.301,"smiles":null,"spectrum_id":"CCMSLIB00017302863","spectrum_index":43336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 154.0763 Da; putative annotation: N/A; putative formula: C6H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.147,"smiles":null,"spectrum_id":"CCMSLIB00017302866","spectrum_index":43337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 307.1311 Da; putative annotation: N/A; putative formula: C12H18N7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.36,"smiles":null,"spectrum_id":"CCMSLIB00017302869","spectrum_index":43338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 250.1428 Da; putative annotation: N/A; putative formula: C12H18N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.224,"smiles":null,"spectrum_id":"CCMSLIB00017302872","spectrum_index":43339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 423.7396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.826,"smiles":null,"spectrum_id":"CCMSLIB00017302874","spectrum_index":43340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 216.0777 Da; putative annotation: N/A; putative formula: C7H13N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.228,"smiles":null,"spectrum_id":"CCMSLIB00017302877","spectrum_index":43341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 412.298 Da; putative annotation: N/A; putative formula: C27H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.427,"smiles":null,"spectrum_id":"CCMSLIB00017302880","spectrum_index":43342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Ethyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)acetic acid (delta mass: 42.0196 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017302883","spectrum_index":43343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 191.0582 Da; putative annotation: N/A; putative formula: C10H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.139,"smiles":null,"spectrum_id":"CCMSLIB00017302885","spectrum_index":43344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 138.0826 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.148,"smiles":null,"spectrum_id":"CCMSLIB00017302888","spectrum_index":43345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.097,"smiles":null,"spectrum_id":"CCMSLIB00017302891","spectrum_index":43346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 45.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.16,"smiles":null,"spectrum_id":"CCMSLIB00017302894","spectrum_index":43347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 141.993 Da; putative annotation: N/A; putative formula: C4H3N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.116,"smiles":null,"spectrum_id":"CCMSLIB00017302897","spectrum_index":43348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 62.0536 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.097,"smiles":null,"spectrum_id":"CCMSLIB00017302899","spectrum_index":43349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 62.0449 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.22,"smiles":null,"spectrum_id":"CCMSLIB00017302902","spectrum_index":43350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 52.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.16,"smiles":null,"spectrum_id":"CCMSLIB00017302905","spectrum_index":43351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 155.1673 Da; putative annotation: N/A; putative formula: C10H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.27,"smiles":null,"spectrum_id":"CCMSLIB00017302908","spectrum_index":43352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 17.3269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.398,"smiles":null,"spectrum_id":"CCMSLIB00017302910","spectrum_index":43353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000502 5-methoxyindole-3-carbaldehyde (delta mass: 15.4294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017302913","spectrum_index":43354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 40.0886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.169,"smiles":null,"spectrum_id":"CCMSLIB00017302916","spectrum_index":43355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 233.1357 Da; putative annotation: N/A; putative formula: C13H19N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.197,"smiles":null,"spectrum_id":"CCMSLIB00017302919","spectrum_index":43356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 76.075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.161,"smiles":null,"spectrum_id":"CCMSLIB00017302921","spectrum_index":43357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 161.0903 Da; putative annotation: N/A; putative formula: C4H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.224,"smiles":null,"spectrum_id":"CCMSLIB00017302924","spectrum_index":43358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 227.058 Da; putative annotation: N/A; putative formula: C13H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.138,"smiles":null,"spectrum_id":"CCMSLIB00017302927","spectrum_index":43359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-hydroxypyrene (delta mass: 148.0361 Da; putative annotation: N/A; putative formula: C2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.116,"smiles":null,"spectrum_id":"CCMSLIB00017302930","spectrum_index":43360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 100.0253 Da; putative annotation: N/A; putative formula: C3H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.148,"smiles":null,"spectrum_id":"CCMSLIB00017302933","spectrum_index":43361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 199.1001 Da; putative annotation: N/A; putative formula: C6H13N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.256,"smiles":null,"spectrum_id":"CCMSLIB00017302936","spectrum_index":43362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 867.4409 Da; putative annotation: N/A; putative formula: C40H73N3O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1089.54,"smiles":null,"spectrum_id":"CCMSLIB00017302939","spectrum_index":43363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 630.2757 Da; putative annotation: N/A; putative formula: C28H46N4O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.367,"smiles":null,"spectrum_id":"CCMSLIB00017302942","spectrum_index":43364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 282.0533 Da; putative annotation: N/A; putative formula: C8H16N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.177,"smiles":null,"spectrum_id":"CCMSLIB00017302945","spectrum_index":43365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 161.0687 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.192,"smiles":null,"spectrum_id":"CCMSLIB00017302948","spectrum_index":43366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 303.2912 Da; putative annotation: N/A; putative formula: C21H37N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.383,"smiles":null,"spectrum_id":"CCMSLIB00017302950","spectrum_index":43367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 90.0096 Da; putative annotation: N/A; putative formula: H3N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.08,"smiles":null,"spectrum_id":"CCMSLIB00017302953","spectrum_index":43368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy Mirtazapine (delta mass: 18.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.18,"smiles":null,"spectrum_id":"CCMSLIB00017302956","spectrum_index":43369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 163.0841 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.16,"smiles":null,"spectrum_id":"CCMSLIB00017302958","spectrum_index":43370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 27.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017302961","spectrum_index":43371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 76.051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.122,"smiles":null,"spectrum_id":"CCMSLIB00017302964","spectrum_index":43372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 17.9471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.018,"smiles":null,"spectrum_id":"CCMSLIB00017302967","spectrum_index":43373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 57.0186 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.172,"smiles":null,"spectrum_id":"CCMSLIB00017302969","spectrum_index":43374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-L-tyrosine (delta mass: 68.0621 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.154,"smiles":null,"spectrum_id":"CCMSLIB00017302972","spectrum_index":43375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 106.0746 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.086,"smiles":null,"spectrum_id":"CCMSLIB00017302974","spectrum_index":43376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 109.0528 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.118,"smiles":null,"spectrum_id":"CCMSLIB00017302977","spectrum_index":43377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 347.2236 Da; putative annotation: N/A; putative formula: C16H33N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.258,"smiles":null,"spectrum_id":"CCMSLIB00017302980","spectrum_index":43378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 95.0951 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.26,"smiles":null,"spectrum_id":"CCMSLIB00017302983","spectrum_index":43379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 89.0429 Da; putative annotation: N/A; putative formula: C2H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.129,"smiles":null,"spectrum_id":"CCMSLIB00017302985","spectrum_index":43380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-3-(4-piperidinyl)-1H-indole (delta mass: 27.9999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.129,"smiles":null,"spectrum_id":"CCMSLIB00017302987","spectrum_index":43381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 26.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.125,"smiles":null,"spectrum_id":"CCMSLIB00017302991","spectrum_index":43382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Volinanserin (delta mass: 42.0671 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.28,"smiles":null,"spectrum_id":"CCMSLIB00017302994","spectrum_index":43383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 2.0046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.086,"smiles":null,"spectrum_id":"CCMSLIB00017302996","spectrum_index":43384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 166.1182 Da; putative annotation: N/A; putative formula: C11H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.206,"smiles":null,"spectrum_id":"CCMSLIB00017302999","spectrum_index":43385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 282.1985 Da; putative annotation: N/A; putative formula: C20H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.285,"smiles":null,"spectrum_id":"CCMSLIB00017303001","spectrum_index":43386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 40.0323 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.108,"smiles":null,"spectrum_id":"CCMSLIB00017303004","spectrum_index":43387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 134.1672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017303006","spectrum_index":43388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 43.0443 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.147,"smiles":null,"spectrum_id":"CCMSLIB00017303009","spectrum_index":43389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 694.0418 Da; putative annotation: N/A; putative formula: C28H26N2O11S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.102,"smiles":null,"spectrum_id":"CCMSLIB00017303012","spectrum_index":43390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 95.0369 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.123,"smiles":null,"spectrum_id":"CCMSLIB00017303014","spectrum_index":43391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 212.1522 Da; putative annotation: N/A; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.265,"smiles":null,"spectrum_id":"CCMSLIB00017303017","spectrum_index":43392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Glu (delta mass: 99.068 Da; putative annotation: L-Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.197,"smiles":null,"spectrum_id":"CCMSLIB00017303019","spectrum_index":43393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 284.1526 Da; putative annotation: Trichostatin A; putative formula: C17H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.239,"smiles":null,"spectrum_id":"CCMSLIB00017303022","spectrum_index":43394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Val (delta mass: 99.0676 Da; putative annotation: 4-Amino-2-methylbutanoic acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.212,"smiles":null,"spectrum_id":"CCMSLIB00017303024","spectrum_index":43395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 151.063 Da; putative annotation: Noradrenaline; AIF; CE0; MS2Dec; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.134,"smiles":null,"spectrum_id":"CCMSLIB00017303027","spectrum_index":43396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 111.0933 Da; putative annotation: N/A; putative formula: C4H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.169,"smiles":null,"spectrum_id":"CCMSLIB00017303030","spectrum_index":43397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 196.0946 Da; putative annotation: N/A; putative formula: C11H18O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.218,"smiles":null,"spectrum_id":"CCMSLIB00017303032","spectrum_index":43398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of E-N-Deoxyfructosyllysine (delta mass: 238.0974 Da; putative annotation: N/A; putative formula: C9H19O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.263,"smiles":null,"spectrum_id":"CCMSLIB00017303035","spectrum_index":43399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 63.0229 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.182,"smiles":null,"spectrum_id":"CCMSLIB00017303037","spectrum_index":43400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 267.1686 Da; putative annotation: N/A; putative formula: C12H21N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.244,"smiles":null,"spectrum_id":"CCMSLIB00017303040","spectrum_index":43401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 93.058 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.155,"smiles":null,"spectrum_id":"CCMSLIB00017303043","spectrum_index":43402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 276.096 Da; putative annotation: N/A; putative formula: C10H16N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.199,"smiles":null,"spectrum_id":"CCMSLIB00017303045","spectrum_index":43403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 104.0689 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.143,"smiles":null,"spectrum_id":"CCMSLIB00017303047","spectrum_index":43404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 177.1135 Da; putative annotation: N/A; putative formula: C7H11N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.226,"smiles":null,"spectrum_id":"CCMSLIB00017303050","spectrum_index":43405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 96.0574 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.17,"smiles":null,"spectrum_id":"CCMSLIB00017303052","spectrum_index":43406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Chlorobenzyl)-2-(1H-indol-3-yl)ethanamine (delta mass: 143.0719 Da; putative annotation: N/A; putative formula: C4H10N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.187,"smiles":null,"spectrum_id":"CCMSLIB00017303055","spectrum_index":43407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 130.0419 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017303057","spectrum_index":43408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 35.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.176,"smiles":null,"spectrum_id":"CCMSLIB00017303060","spectrum_index":43409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 166.0989 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.222,"smiles":null,"spectrum_id":"CCMSLIB00017303062","spectrum_index":43410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SODIUM D-GLUCONATE (delta mass: 34.0205 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.086,"smiles":null,"spectrum_id":"CCMSLIB00017303064","spectrum_index":43411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 136.0885 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.164,"smiles":null,"spectrum_id":"CCMSLIB00017303067","spectrum_index":43412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 145.0203 Da; putative annotation: N/A; putative formula: C5H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.107,"smiles":null,"spectrum_id":"CCMSLIB00017303070","spectrum_index":43413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 61.9468 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.044,"smiles":null,"spectrum_id":"CCMSLIB00017303073","spectrum_index":43414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 439.3503 Da; putative annotation: N/A; putative formula: C19H41N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.527,"smiles":null,"spectrum_id":"CCMSLIB00017303075","spectrum_index":43415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 412.2098 Da; putative annotation: N/A; putative formula: C21H32O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.281,"smiles":null,"spectrum_id":"CCMSLIB00017303077","spectrum_index":43416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 17.44 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017303080","spectrum_index":43417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017303083","spectrum_index":43418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 104.0117 Da; putative annotation: N/A; putative formula: C4H8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.034,"smiles":null,"spectrum_id":"CCMSLIB00017303086","spectrum_index":43419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 70.5916 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.678,"smiles":null,"spectrum_id":"CCMSLIB00017303089","spectrum_index":43420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 120.0186 Da; putative annotation: N/A; putative formula: C3N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.173,"smiles":null,"spectrum_id":"CCMSLIB00017303090","spectrum_index":43421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Leu (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.281,"smiles":null,"spectrum_id":"CCMSLIB00017303093","spectrum_index":43422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 130.9441 Da; putative annotation: N/A; putative formula: C3H2NO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.004,"smiles":null,"spectrum_id":"CCMSLIB00017303096","spectrum_index":43423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-(Difluoromethylthio)phenyl)-N-methylmethanamine (delta mass: 178.1211 Da; putative annotation: N/A; putative formula: C9H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.186,"smiles":null,"spectrum_id":"CCMSLIB00017303099","spectrum_index":43424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-6-chloro-1H-indole-2-carboxylic acid (delta mass: 5.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.937,"smiles":null,"spectrum_id":"CCMSLIB00017303101","spectrum_index":43425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole - 40.0 eV (delta mass: 91.0112 Da; putative annotation: N/A; putative formula: C2H7NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.076,"smiles":null,"spectrum_id":"CCMSLIB00017303104","spectrum_index":43426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 54.0469 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017303106","spectrum_index":43427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-1H-indole-3-carbaldehyde (delta mass: 117.0866 Da; putative annotation: N/A; putative formula: H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.108,"smiles":null,"spectrum_id":"CCMSLIB00017303109","spectrum_index":43428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-His (delta mass: 228.1118 Da; putative annotation: N/A; putative formula: C11H20N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.21,"smiles":null,"spectrum_id":"CCMSLIB00017303112","spectrum_index":43429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 78.0551 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.096,"smiles":null,"spectrum_id":"CCMSLIB00017303115","spectrum_index":43430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 144.1303 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.399,"smiles":null,"spectrum_id":"CCMSLIB00017303118","spectrum_index":43431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 60.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.127,"smiles":null,"spectrum_id":"CCMSLIB00017303120","spectrum_index":43432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 497.2445 Da; putative annotation: N/A; putative formula: C27H36N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.399,"smiles":null,"spectrum_id":"CCMSLIB00017303122","spectrum_index":43433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 96.0288 Da; putative annotation: N/A; putative formula: N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.089,"smiles":null,"spectrum_id":"CCMSLIB00017303125","spectrum_index":43434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 18.0098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.065,"smiles":null,"spectrum_id":"CCMSLIB00017303128","spectrum_index":43435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 90.0836 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017303131","spectrum_index":43436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 171.1009 Da; putative annotation: N/A; putative formula: C7H13N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.208,"smiles":null,"spectrum_id":"CCMSLIB00017303134","spectrum_index":43437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 122.1161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.176,"smiles":null,"spectrum_id":"CCMSLIB00017303136","spectrum_index":43438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 549.4923 Da; putative annotation: N/A; putative formula: C38H63NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":735.564,"smiles":null,"spectrum_id":"CCMSLIB00017303138","spectrum_index":43439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 104.0355 Da; putative annotation: N/A; putative formula: C6H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.195,"smiles":null,"spectrum_id":"CCMSLIB00017303141","spectrum_index":43440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Statine (delta mass: 136.089 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.217,"smiles":null,"spectrum_id":"CCMSLIB00017303144","spectrum_index":43441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 142.0579 Da; putative annotation: N/A; putative formula: C6H10N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.17,"smiles":null,"spectrum_id":"CCMSLIB00017303147","spectrum_index":43442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aristololactam (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.087,"smiles":null,"spectrum_id":"CCMSLIB00017303150","spectrum_index":43443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 191.1156 Da; putative annotation: N/A; putative formula: C8H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.176,"smiles":null,"spectrum_id":"CCMSLIB00017303152","spectrum_index":43444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 59.0465 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.068,"smiles":null,"spectrum_id":"CCMSLIB00017303154","spectrum_index":43445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 27.9944 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.247,"smiles":null,"spectrum_id":"CCMSLIB00017303157","spectrum_index":43446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 42.0431 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.15,"smiles":null,"spectrum_id":"CCMSLIB00017303160","spectrum_index":43447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 241.1411 Da; putative annotation: N/A; putative formula: C13H24NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.217,"smiles":null,"spectrum_id":"CCMSLIB00017303163","spectrum_index":43448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 57.0489 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.137,"smiles":null,"spectrum_id":"CCMSLIB00017303165","spectrum_index":43449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 132.098 Da; putative annotation: N/A; putative formula: H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.221,"smiles":null,"spectrum_id":"CCMSLIB00017303168","spectrum_index":43450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 184.1252 Da; putative annotation: N/A; putative formula: C14H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017303171","spectrum_index":43451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 211.1202 Da; putative annotation: N/A; putative formula: C11H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.238,"smiles":null,"spectrum_id":"CCMSLIB00017303174","spectrum_index":43452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 209.0703 Da; putative annotation: N/A; putative formula: C11H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.151,"smiles":null,"spectrum_id":"CCMSLIB00017303177","spectrum_index":43453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylic acid (delta mass: 247.1689 Da; putative annotation: N/A; putative formula: C14H21N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.282,"smiles":null,"spectrum_id":"CCMSLIB00017303179","spectrum_index":43454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin D (delta mass: 154.1146 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.378,"smiles":null,"spectrum_id":"CCMSLIB00017303182","spectrum_index":43455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.112,"smiles":null,"spectrum_id":"CCMSLIB00017303185","spectrum_index":43456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 250.0416 Da; putative annotation: N/A; putative formula: C19H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.102,"smiles":null,"spectrum_id":"CCMSLIB00017303188","spectrum_index":43457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 114.1036 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017303191","spectrum_index":43458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 80.2006 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.349,"smiles":null,"spectrum_id":"CCMSLIB00017303194","spectrum_index":43459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092701 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 106.0772 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.179,"smiles":null,"spectrum_id":"CCMSLIB00017303197","spectrum_index":43460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 85.0284 Da; putative annotation: N/A; putative formula: C2H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.115,"smiles":null,"spectrum_id":"CCMSLIB00017303200","spectrum_index":43461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 297.3487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.456,"smiles":null,"spectrum_id":"CCMSLIB00017303201","spectrum_index":43462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 188.1201 Da; putative annotation: N/A; putative formula: C13H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.196,"smiles":null,"spectrum_id":"CCMSLIB00017303204","spectrum_index":43463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 272.174 Da; putative annotation: N/A; putative formula: C13H24N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.26,"smiles":null,"spectrum_id":"CCMSLIB00017303207","spectrum_index":43464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 104.0974 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.21,"smiles":null,"spectrum_id":"CCMSLIB00017303210","spectrum_index":43465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 462.2052 Da; putative annotation: N/A; putative formula: C29H34OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.328,"smiles":null,"spectrum_id":"CCMSLIB00017303211","spectrum_index":43466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hypaphorine (delta mass: 374.1857 Da; putative annotation: N/A; putative formula: C18H31O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.33,"smiles":null,"spectrum_id":"CCMSLIB00017303214","spectrum_index":43467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 186.1253 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017303217","spectrum_index":43468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 236.0833 Da; putative annotation: N/A; putative formula: C8H16N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.148,"smiles":null,"spectrum_id":"CCMSLIB00017303220","spectrum_index":43469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 232.0368 Da; putative annotation: N/A; putative formula: C12H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.096,"smiles":null,"spectrum_id":"CCMSLIB00017303222","spectrum_index":43470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MoNA:980317 2-Napthyloxyacetic acid (delta mass: 26.0157 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.086,"smiles":null,"spectrum_id":"CCMSLIB00017303224","spectrum_index":43471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 172.0215 Da; putative annotation: N/A; putative formula: C8H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.175,"smiles":null,"spectrum_id":"CCMSLIB00017303227","spectrum_index":43472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 179.0795 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.145,"smiles":null,"spectrum_id":"CCMSLIB00017303230","spectrum_index":43473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 782.3392 Da; putative annotation: N/A; putative formula: C37H55N2O14P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":989.425,"smiles":null,"spectrum_id":"CCMSLIB00017303233","spectrum_index":43474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR304150 Indole-3-acetyl-L-glutamic acid (delta mass: 304.0982 Da; putative annotation: N/A; putative formula: C13H20O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.211,"smiles":null,"spectrum_id":"CCMSLIB00017303234","spectrum_index":43475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU211802 Nordeprenyl|Desmethylselegiline|1-phenyl-N-prop-2-ynylpropan-2-amine (delta mass: 130.1248 Da; putative annotation: N/A; putative formula: C5H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.253,"smiles":null,"spectrum_id":"CCMSLIB00017303237","spectrum_index":43476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 118.0621 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.164,"smiles":null,"spectrum_id":"CCMSLIB00017303240","spectrum_index":43477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 87.0195 Da; putative annotation: N/A; putative formula: HN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.127,"smiles":null,"spectrum_id":"CCMSLIB00017303243","spectrum_index":43478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 24.0381 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.14,"smiles":null,"spectrum_id":"CCMSLIB00017303245","spectrum_index":43479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopycnarrhine (delta mass: 61.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.139,"smiles":null,"spectrum_id":"CCMSLIB00017303247","spectrum_index":43480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 97.9475 Da; putative annotation: N/A; putative formula: C3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.049,"smiles":null,"spectrum_id":"CCMSLIB00017303250","spectrum_index":43481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 100.9447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.016,"smiles":null,"spectrum_id":"CCMSLIB00017303253","spectrum_index":43482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 103.0418 Da; putative annotation: N/A; putative formula: C7H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.149,"smiles":null,"spectrum_id":"CCMSLIB00017303254","spectrum_index":43483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 23.9996 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.154,"smiles":null,"spectrum_id":"CCMSLIB00017303257","spectrum_index":43484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mer-N5075-A_35716_dereplictor_pv_5.17819e-12 (delta mass: 300.2076 Da; putative annotation: N/A; putative formula: C14H29N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.542,"smiles":null,"spectrum_id":"CCMSLIB00017303260","spectrum_index":43485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,3,5-Pentamethyl-1,2,3,8-tetrahydro-7H-pyrrolo[3,2-g]quinolin-7-one (delta mass: 159.1722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.337,"smiles":null,"spectrum_id":"CCMSLIB00017303263","spectrum_index":43486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyl-L-threonine (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.076,"smiles":null,"spectrum_id":"CCMSLIB00017303264","spectrum_index":43487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-tert-Butyl-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 17.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.18,"smiles":null,"spectrum_id":"CCMSLIB00017303267","spectrum_index":43488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 27.9961 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.088,"smiles":null,"spectrum_id":"CCMSLIB00017303270","spectrum_index":43489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 42.0316 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.18,"smiles":null,"spectrum_id":"CCMSLIB00017303273","spectrum_index":43490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,9-Tetrahydro-1H-carbazole-6-carbonitrile (delta mass: 17.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.133,"smiles":null,"spectrum_id":"CCMSLIB00017303276","spectrum_index":43491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 118.035 Da; putative annotation: N/A; putative formula: C8H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.21,"smiles":null,"spectrum_id":"CCMSLIB00017303278","spectrum_index":43492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 474.1889 Da; putative annotation: N/A; putative formula: C25H30O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.27,"smiles":null,"spectrum_id":"CCMSLIB00017303281","spectrum_index":43493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine; AIF; CE0; MS2Dec (delta mass: 46.0225 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.109,"smiles":null,"spectrum_id":"CCMSLIB00017303284","spectrum_index":43494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 176.0309 Da; putative annotation: N/A; putative formula: C10H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.102,"smiles":null,"spectrum_id":"CCMSLIB00017303286","spectrum_index":43495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 271.237 Da; putative annotation: N/A; putative formula: C13H29N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.513,"smiles":null,"spectrum_id":"CCMSLIB00017303289","spectrum_index":43496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 179.1299 Da; putative annotation: N/A; putative formula: C11H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.278,"smiles":null,"spectrum_id":"CCMSLIB00017303292","spectrum_index":43497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 435.2682 Da; putative annotation: N/A; putative formula: C20H42N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.392,"smiles":null,"spectrum_id":"CCMSLIB00017303295","spectrum_index":43498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penitremone-A (delta mass: 14.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.368,"smiles":null,"spectrum_id":"CCMSLIB00017303298","spectrum_index":43499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 183.205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.364,"smiles":null,"spectrum_id":"CCMSLIB00017303300","spectrum_index":43500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 128.0687 Da; putative annotation: N/A; putative formula: C4H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.348,"smiles":null,"spectrum_id":"CCMSLIB00017303303","spectrum_index":43501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 72.0576 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.175,"smiles":null,"spectrum_id":"CCMSLIB00017303306","spectrum_index":43502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hypaphorine (delta mass: 393.2658 Da; putative annotation: N/A; putative formula: C26H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.41,"smiles":null,"spectrum_id":"CCMSLIB00017303309","spectrum_index":43503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 64.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.201,"smiles":null,"spectrum_id":"CCMSLIB00017303312","spectrum_index":43504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 31.0786 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.165,"smiles":null,"spectrum_id":"CCMSLIB00017303314","spectrum_index":43505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 26.9875 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.116,"smiles":null,"spectrum_id":"CCMSLIB00017303316","spectrum_index":43506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.134,"smiles":null,"spectrum_id":"CCMSLIB00017303319","spectrum_index":43507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 289.3031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.478,"smiles":null,"spectrum_id":"CCMSLIB00017303322","spectrum_index":43508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4,6-Dichloro-2-methyl-1H-indol-3-yl)ethylamine (delta mass: 111.0306 Da; putative annotation: N/A; putative formula: CHN7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.076,"smiles":null,"spectrum_id":"CCMSLIB00017303323","spectrum_index":43509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 220.9125 Da; putative annotation: N/A; putative formula: CH3NO6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.924,"smiles":null,"spectrum_id":"CCMSLIB00017303326","spectrum_index":43510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 105.0437 Da; putative annotation: N/A; putative formula: C4H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.104,"smiles":null,"spectrum_id":"CCMSLIB00017303329","spectrum_index":43511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 202.081 Da; putative annotation: N/A; putative formula: C7H15N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.147,"smiles":null,"spectrum_id":"CCMSLIB00017303332","spectrum_index":43512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 176.0291 Da; putative annotation: N/A; putative formula: C2H4N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.231,"smiles":null,"spectrum_id":"CCMSLIB00017303335","spectrum_index":43513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 38.0529 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017303337","spectrum_index":43514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 159.0533 Da; putative annotation: N/A; putative formula: C6H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.145,"smiles":null,"spectrum_id":"CCMSLIB00017303340","spectrum_index":43515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 43.9901 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.081,"smiles":null,"spectrum_id":"CCMSLIB00017303343","spectrum_index":43516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 60.0962 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017303346","spectrum_index":43517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 260.104 Da; putative annotation: N/A; putative formula: C9H17N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.191,"smiles":null,"spectrum_id":"CCMSLIB00017303347","spectrum_index":43518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 190.0995 Da; putative annotation: N/A; putative formula: C12H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.18,"smiles":null,"spectrum_id":"CCMSLIB00017303350","spectrum_index":43519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 392.2332 Da; putative annotation: N/A; putative formula: C15H28N12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.372,"smiles":null,"spectrum_id":"CCMSLIB00017303353","spectrum_index":43520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 144.0285 Da; putative annotation: N/A; putative formula: C3H4N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.069,"smiles":null,"spectrum_id":"CCMSLIB00017303356","spectrum_index":43521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380136-01!1-(2,3-dihydropyrrol-1-yl)-8,9-dihydroxy-2-methyldecane-1,3-dione (delta mass: 19.0151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.201,"smiles":null,"spectrum_id":"CCMSLIB00017303359","spectrum_index":43522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 40.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.171,"smiles":null,"spectrum_id":"CCMSLIB00017303362","spectrum_index":43523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 56.0262 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017303363","spectrum_index":43524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 380.2025 Da; putative annotation: N/A; putative formula: C21H32O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.3,"smiles":null,"spectrum_id":"CCMSLIB00017303366","spectrum_index":43525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 374.2065 Da; putative annotation: N/A; putative formula: C18H26N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":967.482,"smiles":null,"spectrum_id":"CCMSLIB00017303369","spectrum_index":43526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 170.1057 Da; putative annotation: Glycyl-L-norleucine; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.276,"smiles":null,"spectrum_id":"CCMSLIB00017303372","spectrum_index":43527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 162.0538 Da; putative annotation: Spectral Match to D-(+)-Mannose from NIST14; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.151,"smiles":null,"spectrum_id":"CCMSLIB00017303374","spectrum_index":43528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 324.1058 Da; putative annotation: Maltose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.282,"smiles":null,"spectrum_id":"CCMSLIB00017303377","spectrum_index":43529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 244.1143 Da; putative annotation: 8-hydroxy-5,8a-dimethyl-3-methylidene-3a,4,4a,8,9,9a-hexahydrobenzo[f][1]benzofuran-2,7-dione; putative formula: C15H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.19,"smiles":null,"spectrum_id":"CCMSLIB00017303380","spectrum_index":43530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 147.1047 Da; putative annotation: 2-Amino-4-tert-butylphenol; putative formula: C10H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.17,"smiles":null,"spectrum_id":"CCMSLIB00017303383","spectrum_index":43531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 94.0334 Da; putative annotation: 1H-Pyrazol-3-ylboronic acid; putative formula: C3H3BN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.114,"smiles":null,"spectrum_id":"CCMSLIB00017303386","spectrum_index":43532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 132.1514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.211,"smiles":null,"spectrum_id":"CCMSLIB00017303389","spectrum_index":43533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 221.1172 Da; putative annotation: N/A; putative formula: C11H15N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.303,"smiles":null,"spectrum_id":"CCMSLIB00017303391","spectrum_index":43534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 271.0843 Da; putative annotation: N/A; putative formula: C15H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.16,"smiles":null,"spectrum_id":"CCMSLIB00017303394","spectrum_index":43535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 44.0639 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.129,"smiles":null,"spectrum_id":"CCMSLIB00017303397","spectrum_index":43536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 549.1914 Da; putative annotation: N/A; putative formula: C33H23N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.252,"smiles":null,"spectrum_id":"CCMSLIB00017303400","spectrum_index":43537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 126.0828 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.164,"smiles":null,"spectrum_id":"CCMSLIB00017303403","spectrum_index":43538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 28.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.16,"smiles":null,"spectrum_id":"CCMSLIB00017303405","spectrum_index":43539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 232.1464 Da; putative annotation: N/A; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.201,"smiles":null,"spectrum_id":"CCMSLIB00017303408","spectrum_index":43540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 158.0364 Da; putative annotation: N/A; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.118,"smiles":null,"spectrum_id":"CCMSLIB00017303411","spectrum_index":43541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 852.4514 Da; putative annotation: N/A; putative formula: C47H69N2O8PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1059.54,"smiles":null,"spectrum_id":"CCMSLIB00017303414","spectrum_index":43542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 16.9754 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.255,"smiles":null,"spectrum_id":"CCMSLIB00017303416","spectrum_index":43543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)benzamide (delta mass: 42.0006 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.134,"smiles":null,"spectrum_id":"CCMSLIB00017303419","spectrum_index":43544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 429.2262 Da; putative annotation: N/A; putative formula: C23H31N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.328,"smiles":null,"spectrum_id":"CCMSLIB00017303422","spectrum_index":43545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nornuciferidine (delta mass: 43.0427 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.186,"smiles":null,"spectrum_id":"CCMSLIB00017303425","spectrum_index":43546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 360.1004 Da; putative annotation: N/A; putative formula: C14H22N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.16,"smiles":null,"spectrum_id":"CCMSLIB00017303428","spectrum_index":43547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 68.081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.25,"smiles":null,"spectrum_id":"CCMSLIB00017303430","spectrum_index":43548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.108,"smiles":null,"spectrum_id":"CCMSLIB00017303433","spectrum_index":43549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 152.0472 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.118,"smiles":null,"spectrum_id":"CCMSLIB00017303435","spectrum_index":43550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vindoline (delta mass: 61.051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.284,"smiles":null,"spectrum_id":"CCMSLIB00017303438","spectrum_index":43551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00918 Demethoxycurcumin (delta mass: 144.0324 Da; putative annotation: N/A; putative formula: C8H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.155,"smiles":null,"spectrum_id":"CCMSLIB00017303441","spectrum_index":43552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 88.0867 Da; putative annotation: N/A; putative formula: CH8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.241,"smiles":null,"spectrum_id":"CCMSLIB00017303444","spectrum_index":43553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 54.0609 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.137,"smiles":null,"spectrum_id":"CCMSLIB00017303446","spectrum_index":43554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of S-Carboxymethyl-L-cysteine CollisionEnergy:102040 (delta mass: 165.0822 Da; putative annotation: N/A; putative formula: C8H12N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.115,"smiles":null,"spectrum_id":"CCMSLIB00017303449","spectrum_index":43555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ADENOSINE 3',5'-DIPHOSPHATE - 20.0 eV (delta mass: 132.0406 Da; putative annotation: N/A; putative formula: C9H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.077,"smiles":null,"spectrum_id":"CCMSLIB00017303451","spectrum_index":43556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 289.6791 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.765,"smiles":null,"spectrum_id":"CCMSLIB00017303454","spectrum_index":43557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin D (delta mass: 100.0674 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.253,"smiles":null,"spectrum_id":"CCMSLIB00017303457","spectrum_index":43558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 142.0992 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.217,"smiles":null,"spectrum_id":"CCMSLIB00017303460","spectrum_index":43559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 58.0206 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.134,"smiles":null,"spectrum_id":"CCMSLIB00017303463","spectrum_index":43560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 71.9956 Da; putative annotation: N/A; putative formula: CN2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.076,"smiles":null,"spectrum_id":"CCMSLIB00017303465","spectrum_index":43561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 141.0787 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.154,"smiles":null,"spectrum_id":"CCMSLIB00017303468","spectrum_index":43562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dichloro-1H-indole-2-carboxylic acid (delta mass: 113.0685 Da; putative annotation: N/A; putative formula: C3H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.046,"smiles":null,"spectrum_id":"CCMSLIB00017303471","spectrum_index":43563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 211.085 Da; putative annotation: N/A; putative formula: C11H17NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.182,"smiles":null,"spectrum_id":"CCMSLIB00017303474","spectrum_index":43564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 159.0693 Da; putative annotation: N/A; putative formula: C3H9N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.14,"smiles":null,"spectrum_id":"CCMSLIB00017303477","spectrum_index":43565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 108.0243 Da; putative annotation: N/A; putative formula: C5H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.1,"smiles":null,"spectrum_id":"CCMSLIB00017303480","spectrum_index":43566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 91.0713 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.158,"smiles":null,"spectrum_id":"CCMSLIB00017303483","spectrum_index":43567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385769-01!4-[3,5-dihydroxy-7-(4-hydroxyphenyl)heptyl]benzene-1,2-diol (delta mass: 276.1103 Da; putative annotation: N/A; putative formula: C16H21PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.28,"smiles":null,"spectrum_id":"CCMSLIB00017303486","spectrum_index":43568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 51.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017303489","spectrum_index":43569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 69.0213 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.108,"smiles":null,"spectrum_id":"CCMSLIB00017303492","spectrum_index":43570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 56.0259 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.102,"smiles":null,"spectrum_id":"CCMSLIB00017303495","spectrum_index":43571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 507.4648 Da; putative annotation: N/A; putative formula: C32H61NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.525,"smiles":null,"spectrum_id":"CCMSLIB00017303497","spectrum_index":43572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 3.0333 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":140.068,"smiles":null,"spectrum_id":"CCMSLIB00017303500","spectrum_index":43573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 71.0105 Da; putative annotation: N/A; putative formula: CHN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.06,"smiles":null,"spectrum_id":"CCMSLIB00017303503","spectrum_index":43574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 27.9968 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.13,"smiles":null,"spectrum_id":"CCMSLIB00017303505","spectrum_index":43575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU166409 Norbuprenorphine (delta mass: 342.1165 Da; putative annotation: N/A; putative formula: C15H23N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.38,"smiles":null,"spectrum_id":"CCMSLIB00017303508","spectrum_index":43576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 91.9267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.987,"smiles":null,"spectrum_id":"CCMSLIB00017303511","spectrum_index":43577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 10.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.122,"smiles":null,"spectrum_id":"CCMSLIB00017303514","spectrum_index":43578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 137.9893 Da; putative annotation: N/A; putative formula: C5H2N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.054,"smiles":null,"spectrum_id":"CCMSLIB00017303517","spectrum_index":43579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 207.111 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.223,"smiles":null,"spectrum_id":"CCMSLIB00017303519","spectrum_index":43580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 728.4992 Da; putative annotation: N/A; putative formula: C40H73O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":908.586,"smiles":null,"spectrum_id":"CCMSLIB00017303522","spectrum_index":43581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 66.5515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.737,"smiles":null,"spectrum_id":"CCMSLIB00017303525","spectrum_index":43582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 135.1113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.171,"smiles":null,"spectrum_id":"CCMSLIB00017303528","spectrum_index":43583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 711.2128 Da; putative annotation: N/A; putative formula: C52H29N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":933.31,"smiles":null,"spectrum_id":"CCMSLIB00017303531","spectrum_index":43584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 82.0787 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.202,"smiles":null,"spectrum_id":"CCMSLIB00017303532","spectrum_index":43585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3-(1H-Indol-2-yl)-2-propenoic acid (delta mass: 19.0394 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.11,"smiles":null,"spectrum_id":"CCMSLIB00017303535","spectrum_index":43586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 55.9418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.049,"smiles":null,"spectrum_id":"CCMSLIB00017303538","spectrum_index":43587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 25.9312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.038,"smiles":null,"spectrum_id":"CCMSLIB00017303541","spectrum_index":43588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.15,"smiles":null,"spectrum_id":"CCMSLIB00017303544","spectrum_index":43589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 17.9196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.0,"smiles":null,"spectrum_id":"CCMSLIB00017303546","spectrum_index":43590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 26.0002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017303548","spectrum_index":43591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corynoline (delta mass: 130.0177 Da; putative annotation: N/A; putative formula: C5H7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.167,"smiles":null,"spectrum_id":"CCMSLIB00017303551","spectrum_index":43592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017303554","spectrum_index":43593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 239.1839 Da; putative annotation: N/A; putative formula: C13H25N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.26,"smiles":null,"spectrum_id":"CCMSLIB00017303557","spectrum_index":43594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 171.0896 Da; putative annotation: N/A; putative formula: C8H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.259,"smiles":null,"spectrum_id":"CCMSLIB00017303559","spectrum_index":43595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 475.18 Da; putative annotation: N/A; putative formula: C19H29N3O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.277,"smiles":null,"spectrum_id":"CCMSLIB00017303561","spectrum_index":43596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000504 5-methoxyindole-3-carbaldehyde (delta mass: 40.0134 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.084,"smiles":null,"spectrum_id":"CCMSLIB00017303564","spectrum_index":43597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 208.1857 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.264,"smiles":null,"spectrum_id":"CCMSLIB00017303567","spectrum_index":43598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Deoxypyridoxine (delta mass: 27.9942 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.081,"smiles":null,"spectrum_id":"CCMSLIB00017303570","spectrum_index":43599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 82.052 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.132,"smiles":null,"spectrum_id":"CCMSLIB00017303571","spectrum_index":43600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 593.538 Da; putative annotation: N/A; putative formula: C37H71NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.661,"smiles":null,"spectrum_id":"CCMSLIB00017303574","spectrum_index":43601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 212.1226 Da; putative annotation: N/A; putative formula: C12H20OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.198,"smiles":null,"spectrum_id":"CCMSLIB00017303577","spectrum_index":43602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 56.0659 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.189,"smiles":null,"spectrum_id":"CCMSLIB00017303580","spectrum_index":43603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-7-methoxy-6-oxooxepino[2,3-b]chromene-5-carboxylic acid (delta mass: 27.9875 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.053,"smiles":null,"spectrum_id":"CCMSLIB00017303582","spectrum_index":43604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Pro (delta mass: 202.5687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.734,"smiles":null,"spectrum_id":"CCMSLIB00017303585","spectrum_index":43605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 262.1353 Da; putative annotation: N/A; putative formula: C11H22N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.279,"smiles":null,"spectrum_id":"CCMSLIB00017303588","spectrum_index":43606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 353.1999 Da; putative annotation: N/A; putative formula: C15H27N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.302,"smiles":null,"spectrum_id":"CCMSLIB00017303591","spectrum_index":43607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 297.1284 Da; putative annotation: N/A; putative formula: C18H20NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.282,"smiles":null,"spectrum_id":"CCMSLIB00017303593","spectrum_index":43608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 113.0827 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.18,"smiles":null,"spectrum_id":"CCMSLIB00017303596","spectrum_index":43609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 198.1046 Da; putative annotation: N/A; putative formula: C14H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017303599","spectrum_index":43610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.207,"smiles":null,"spectrum_id":"CCMSLIB00017303602","spectrum_index":43611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 182.083 Da; putative annotation: N/A; putative formula: C12H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.165,"smiles":null,"spectrum_id":"CCMSLIB00017303605","spectrum_index":43612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 159.126 Da; putative annotation: N/A; putative formula: C8H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.259,"smiles":null,"spectrum_id":"CCMSLIB00017303607","spectrum_index":43613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 155.0349 Da; putative annotation: N/A; putative formula: C6HN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.158,"smiles":null,"spectrum_id":"CCMSLIB00017303609","spectrum_index":43614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 170.109 Da; putative annotation: N/A; putative formula: C7H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.232,"smiles":null,"spectrum_id":"CCMSLIB00017303612","spectrum_index":43615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101904 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 9.0002 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.087,"smiles":null,"spectrum_id":"CCMSLIB00017303616","spectrum_index":43616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 287.1347 Da; putative annotation: N/A; putative formula: C17H21NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.247,"smiles":null,"spectrum_id":"CCMSLIB00017303618","spectrum_index":43617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 295.15 Da; putative annotation: N/A; putative formula: C10H17N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.309,"smiles":null,"spectrum_id":"CCMSLIB00017303621","spectrum_index":43618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin D (delta mass: 40.0311 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.295,"smiles":null,"spectrum_id":"CCMSLIB00017303624","spectrum_index":43619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 187.0497 Da; putative annotation: N/A; putative formula: C8H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.147,"smiles":null,"spectrum_id":"CCMSLIB00017303627","spectrum_index":43620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 517.1857 Da; putative annotation: N/A; putative formula: C29H31N3O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.26,"smiles":null,"spectrum_id":"CCMSLIB00017303629","spectrum_index":43621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 27.9105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.976,"smiles":null,"spectrum_id":"CCMSLIB00017303631","spectrum_index":43622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 133.0616 Da; putative annotation: N/A; putative formula: CH8N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.102,"smiles":null,"spectrum_id":"CCMSLIB00017303634","spectrum_index":43623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 127.1368 Da; putative annotation: N/A; putative formula: C8H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.223,"smiles":null,"spectrum_id":"CCMSLIB00017303637","spectrum_index":43624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.164,"smiles":null,"spectrum_id":"CCMSLIB00017303640","spectrum_index":43625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 247.1796 Da; putative annotation: N/A; putative formula: C13H21N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.276,"smiles":null,"spectrum_id":"CCMSLIB00017303643","spectrum_index":43626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 265.2767 Da; putative annotation: N/A; putative formula: C18H35N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.363,"smiles":null,"spectrum_id":"CCMSLIB00017303645","spectrum_index":43627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-propanoic acid (delta mass: 42.0127 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.099,"smiles":null,"spectrum_id":"CCMSLIB00017303648","spectrum_index":43628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 16.6465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.717,"smiles":null,"spectrum_id":"CCMSLIB00017303650","spectrum_index":43629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-Pro-Lys (delta mass: 129.0789 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.282,"smiles":null,"spectrum_id":"CCMSLIB00017303653","spectrum_index":43630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130142 (delta mass: 185.0451 Da; putative annotation: N/A; putative formula: C9H6F3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.158,"smiles":null,"spectrum_id":"CCMSLIB00017303656","spectrum_index":43631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-HYDROXYDOPAMINE - 20.0 eV (delta mass: 86.1819 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.263,"smiles":null,"spectrum_id":"CCMSLIB00017303659","spectrum_index":43632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 815.4847 Da; putative annotation: N/A; putative formula: C47H61N9O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1482.71,"smiles":null,"spectrum_id":"CCMSLIB00017303662","spectrum_index":43633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 183.0529 Da; putative annotation: N/A; putative formula: C8H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.129,"smiles":null,"spectrum_id":"CCMSLIB00017303665","spectrum_index":43634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxycoumarin (delta mass: 126.0316 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.071,"smiles":null,"spectrum_id":"CCMSLIB00017303666","spectrum_index":43635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 76.0393 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.084,"smiles":null,"spectrum_id":"CCMSLIB00017303669","spectrum_index":43636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 1026.7477 Da; putative annotation: N/A; putative formula: C73H102O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1531.92,"smiles":null,"spectrum_id":"CCMSLIB00017303672","spectrum_index":43637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 1039.0972 Da; putative annotation: N/A; putative formula: C48H33N9O9S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1544.27,"smiles":null,"spectrum_id":"CCMSLIB00017303675","spectrum_index":43638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 226.1315 Da; putative annotation: N/A; putative formula: C11H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.228,"smiles":null,"spectrum_id":"CCMSLIB00017303676","spectrum_index":43639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 128.1179 Da; putative annotation: N/A; putative formula: C4H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.246,"smiles":null,"spectrum_id":"CCMSLIB00017303679","spectrum_index":43640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 211.0702 Da; putative annotation: N/A; putative formula: C7H9N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.24,"smiles":null,"spectrum_id":"CCMSLIB00017303682","spectrum_index":43641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 136.0498 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.109,"smiles":null,"spectrum_id":"CCMSLIB00017303685","spectrum_index":43642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 236.9766 Da; putative annotation: N/A; putative formula: C6H7NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.063,"smiles":null,"spectrum_id":"CCMSLIB00017303688","spectrum_index":43643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 92.1009 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.192,"smiles":null,"spectrum_id":"CCMSLIB00017303689","spectrum_index":43644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 298.1778 Da; putative annotation: N/A; putative formula: C16H26O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.238,"smiles":null,"spectrum_id":"CCMSLIB00017303692","spectrum_index":43645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 18.0152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.097,"smiles":null,"spectrum_id":"CCMSLIB00017303695","spectrum_index":43646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 64.016 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017303698","spectrum_index":43647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 14.0151 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.18,"smiles":null,"spectrum_id":"CCMSLIB00017303701","spectrum_index":43648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 13.0316 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.102,"smiles":null,"spectrum_id":"CCMSLIB00017303703","spectrum_index":43649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 357.186 Da; putative annotation: N/A; putative formula: C21H28NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.34,"smiles":null,"spectrum_id":"CCMSLIB00017303706","spectrum_index":43650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 383.1486 Da; putative annotation: N/A; putative formula: C13H21N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.235,"smiles":null,"spectrum_id":"CCMSLIB00017303709","spectrum_index":43651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 335.1601 Da; putative annotation: N/A; putative formula: C16H25N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.304,"smiles":null,"spectrum_id":"CCMSLIB00017303712","spectrum_index":43652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxfendazole (delta mass: 18.0058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.081,"smiles":null,"spectrum_id":"CCMSLIB00017303714","spectrum_index":43653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 243.1248 Da; putative annotation: N/A; putative formula: C9H18N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.284,"smiles":null,"spectrum_id":"CCMSLIB00017303717","spectrum_index":43654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Diacetylchitobiose (delta mass: 275.0935 Da; putative annotation: N/A; putative formula: C12H14N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.27,"smiles":null,"spectrum_id":"CCMSLIB00017303720","spectrum_index":43655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 220.1672 Da; putative annotation: N/A; putative formula: C12H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.342,"smiles":null,"spectrum_id":"CCMSLIB00017303722","spectrum_index":43656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 284.1855 Da; putative annotation: N/A; putative formula: C14H20N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.293,"smiles":null,"spectrum_id":"CCMSLIB00017303725","spectrum_index":43657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Mannitol from NIST14 (delta mass: 240.0407 Da; putative annotation: N/A; putative formula: C8H17O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.127,"smiles":null,"spectrum_id":"CCMSLIB00017303728","spectrum_index":43658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 303.2049 Da; putative annotation: N/A; putative formula: C15H29NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.27,"smiles":null,"spectrum_id":"CCMSLIB00017303731","spectrum_index":43659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 91.187 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.363,"smiles":null,"spectrum_id":"CCMSLIB00017303734","spectrum_index":43660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 111.1047 Da; putative annotation: N/A; putative formula: C7H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.222,"smiles":null,"spectrum_id":"CCMSLIB00017303737","spectrum_index":43661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 823.2981 Da; putative annotation: N/A; putative formula: C56H38N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.358,"smiles":null,"spectrum_id":"CCMSLIB00017303740","spectrum_index":43662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 27.1514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.316,"smiles":null,"spectrum_id":"CCMSLIB00017303742","spectrum_index":43663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 83.0372 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017303745","spectrum_index":43664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 90.0469 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017303748","spectrum_index":43665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 244.0378 Da; putative annotation: N/A; putative formula: C6H8N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.182,"smiles":null,"spectrum_id":"CCMSLIB00017303751","spectrum_index":43666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 11.0159 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.118,"smiles":null,"spectrum_id":"CCMSLIB00017303754","spectrum_index":43667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenoxy-N-(2-pyridinylmethyl)benzamide (delta mass: 26.0238 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.152,"smiles":null,"spectrum_id":"CCMSLIB00017303756","spectrum_index":43668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diprotin B (delta mass: 99.0688 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.292,"smiles":null,"spectrum_id":"CCMSLIB00017303758","spectrum_index":43669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 22.906 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.933,"smiles":null,"spectrum_id":"CCMSLIB00017303761","spectrum_index":43670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 591.2745 Da; putative annotation: N/A; putative formula: C37H33N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.335,"smiles":null,"spectrum_id":"CCMSLIB00017303764","spectrum_index":43671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 174.1254 Da; putative annotation: N/A; putative formula: C9H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.264,"smiles":null,"spectrum_id":"CCMSLIB00017303767","spectrum_index":43672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 31.0477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.207,"smiles":null,"spectrum_id":"CCMSLIB00017303769","spectrum_index":43673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 84.0933 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.205,"smiles":null,"spectrum_id":"CCMSLIB00017303771","spectrum_index":43674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 2.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.161,"smiles":null,"spectrum_id":"CCMSLIB00017303774","spectrum_index":43675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 304.2389 Da; putative annotation: N/A; putative formula: C14H33N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.51,"smiles":null,"spectrum_id":"CCMSLIB00017303777","spectrum_index":43676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzimidazolinone, 1-benzyl- (delta mass: 58.0161 Da; putative annotation: N/A; putative formula: CH2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017303780","spectrum_index":43677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzimidazolinone, 1-benzyl- (delta mass: 56.001 Da; putative annotation: N/A; putative formula: CN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.103,"smiles":null,"spectrum_id":"CCMSLIB00017303781","spectrum_index":43678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-(pyridin-3-yl)quinazolin-4-amine (delta mass: 18.0063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.151,"smiles":null,"spectrum_id":"CCMSLIB00017303784","spectrum_index":43679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 104.0627 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.227,"smiles":null,"spectrum_id":"CCMSLIB00017303787","spectrum_index":43680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 184.0961 Da; putative annotation: N/A; putative formula: C7H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.187,"smiles":null,"spectrum_id":"CCMSLIB00017303790","spectrum_index":43681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 36.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.186,"smiles":null,"spectrum_id":"CCMSLIB00017303793","spectrum_index":43682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 165.0421 Da; putative annotation: N/A; putative formula: C8H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.123,"smiles":null,"spectrum_id":"CCMSLIB00017303796","spectrum_index":43683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 702.3248 Da; putative annotation: N/A; putative formula: C35H46N10O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":924.422,"smiles":null,"spectrum_id":"CCMSLIB00017303798","spectrum_index":43684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl(3-quinolinyl)methanamine (delta mass: 98.0414 Da; putative annotation: N/A; putative formula: C4H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.149,"smiles":null,"spectrum_id":"CCMSLIB00017303800","spectrum_index":43685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 60.0213 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.118,"smiles":null,"spectrum_id":"CCMSLIB00017303803","spectrum_index":43686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 45.1146 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.211,"smiles":null,"spectrum_id":"CCMSLIB00017303806","spectrum_index":43687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 20.0 eV (delta mass: 75.0482 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.139,"smiles":null,"spectrum_id":"CCMSLIB00017303808","spectrum_index":43688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 56.9984 Da; putative annotation: N/A; putative formula: C5H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.02,"smiles":null,"spectrum_id":"CCMSLIB00017303810","spectrum_index":43689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 135.0318 Da; putative annotation: 3-Hydroxyanthranilic acid; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.103,"smiles":null,"spectrum_id":"CCMSLIB00017303813","spectrum_index":43690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 279.1399 Da; putative annotation: MLS002154000-01!Hexylcaine hydrochloride532-76-3; putative formula: C16H22ClNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.2,"smiles":null,"spectrum_id":"CCMSLIB00017303816","spectrum_index":43691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000086 Harmane (delta mass: 228.1184 Da; putative annotation: Loxoprofen; putative formula: C15H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.21,"smiles":null,"spectrum_id":"CCMSLIB00017303819","spectrum_index":43692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 133.0639 Da; putative annotation: 4-Aminobenzoic acid hydrazide; putative formula: C7H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.156,"smiles":null,"spectrum_id":"CCMSLIB00017303821","spectrum_index":43693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 414.1541 Da; putative annotation: Darendoside A; putative formula: C19H26O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.278,"smiles":null,"spectrum_id":"CCMSLIB00017303823","spectrum_index":43694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 448.0917 Da; putative annotation: NCGC00385782-01!(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one; putative formula: C21H20O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":787.214,"smiles":null,"spectrum_id":"CCMSLIB00017303826","spectrum_index":43695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-3,4-(methylenedioxy)benzylamine (delta mass: 104.0258 Da; putative annotation: Benzoic acid; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.112,"smiles":null,"spectrum_id":"CCMSLIB00017303829","spectrum_index":43696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 66.055 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.17,"smiles":null,"spectrum_id":"CCMSLIB00017303831","spectrum_index":43697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 364.1874 Da; putative annotation: N/A; putative formula: C24H30O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.357,"smiles":null,"spectrum_id":"CCMSLIB00017303833","spectrum_index":43698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 26.9996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017303836","spectrum_index":43699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 305.2716 Da; putative annotation: N/A; putative formula: C20H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.358,"smiles":null,"spectrum_id":"CCMSLIB00017303839","spectrum_index":43700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 106.0784 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.368,"smiles":null,"spectrum_id":"CCMSLIB00017303841","spectrum_index":43701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 36.0197 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.169,"smiles":null,"spectrum_id":"CCMSLIB00017303843","spectrum_index":43702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meropenem (delta mass: 88.0167 Da; putative annotation: N/A; putative formula: C4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.176,"smiles":null,"spectrum_id":"CCMSLIB00017303846","spectrum_index":43703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 27.996 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.064,"smiles":null,"spectrum_id":"CCMSLIB00017303848","spectrum_index":43704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(cyclohexylmethyl)- (delta mass: 354.2148 Da; putative annotation: N/A; putative formula: C20H35OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.364,"smiles":null,"spectrum_id":"CCMSLIB00017303851","spectrum_index":43705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 353.2932 Da; putative annotation: N/A; putative formula: C21H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.33,"smiles":null,"spectrum_id":"CCMSLIB00017303853","spectrum_index":43706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2,2,2-trifluoroethanamine (delta mass: 69.9841 Da; putative annotation: N/A; putative formula: C6H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.068,"smiles":null,"spectrum_id":"CCMSLIB00017303856","spectrum_index":43707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 188.0264 Da; putative annotation: N/A; putative formula: C14H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.061,"smiles":null,"spectrum_id":"CCMSLIB00017303859","spectrum_index":43708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(9H-Carbazol-9-yl)-3-(4-chlorophenoxy)-2-propanol (delta mass: 18.0001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.11,"smiles":null,"spectrum_id":"CCMSLIB00017303862","spectrum_index":43709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1263.8742 Da; putative annotation: N/A; putative formula: C92H113NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1485.97,"smiles":null,"spectrum_id":"CCMSLIB00017303865","spectrum_index":43710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 621.2059 Da; putative annotation: N/A; putative formula: C35H27N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":982.37,"smiles":null,"spectrum_id":"CCMSLIB00017303867","spectrum_index":43711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 256.2593 Da; putative annotation: N/A; putative formula: C14H32N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.335,"smiles":null,"spectrum_id":"CCMSLIB00017303870","spectrum_index":43712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 327.3117 Da; putative annotation: N/A; putative formula: C16H37N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.456,"smiles":null,"spectrum_id":"CCMSLIB00017303873","spectrum_index":43713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 106.0789 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.348,"smiles":null,"spectrum_id":"CCMSLIB00017303875","spectrum_index":43714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 254.0193 Da; putative annotation: N/A; putative formula: C7H11O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.06,"smiles":null,"spectrum_id":"CCMSLIB00017303878","spectrum_index":43715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 509.2852 Da; putative annotation: N/A; putative formula: C24H39N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.372,"smiles":null,"spectrum_id":"CCMSLIB00017303881","spectrum_index":43716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 36.9226 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.977,"smiles":null,"spectrum_id":"CCMSLIB00017303883","spectrum_index":43717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 221.1043 Da; putative annotation: N/A; putative formula: C12H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.216,"smiles":null,"spectrum_id":"CCMSLIB00017303885","spectrum_index":43718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 41.0891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.29,"smiles":null,"spectrum_id":"CCMSLIB00017303888","spectrum_index":43719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nitrazepam (delta mass: 171.0527 Da; putative annotation: N/A; putative formula: C7H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.14,"smiles":null,"spectrum_id":"CCMSLIB00017303891","spectrum_index":43720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 261.6196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.706,"smiles":null,"spectrum_id":"CCMSLIB00017303894","spectrum_index":43721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 416.1838 Da; putative annotation: N/A; putative formula: C26H29N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.26,"smiles":null,"spectrum_id":"CCMSLIB00017303896","spectrum_index":43722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 51.0427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.129,"smiles":null,"spectrum_id":"CCMSLIB00017303898","spectrum_index":43723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 84.0241 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.184,"smiles":null,"spectrum_id":"CCMSLIB00017303901","spectrum_index":43724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 155.0834 Da; putative annotation: N/A; putative formula: C10H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.186,"smiles":null,"spectrum_id":"CCMSLIB00017303904","spectrum_index":43725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 264.1114 Da; putative annotation: N/A; putative formula: C13H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.182,"smiles":null,"spectrum_id":"CCMSLIB00017303906","spectrum_index":43726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 10.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.08,"smiles":null,"spectrum_id":"CCMSLIB00017303908","spectrum_index":43727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 563.5325 Da; putative annotation: N/A; putative formula: C37H65N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.712,"smiles":null,"spectrum_id":"CCMSLIB00017303911","spectrum_index":43728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 176.0473 Da; putative annotation: N/A; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.118,"smiles":null,"spectrum_id":"CCMSLIB00017303914","spectrum_index":43729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 84.0575 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.191,"smiles":null,"spectrum_id":"CCMSLIB00017303917","spectrum_index":43730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 218.1647 Da; putative annotation: N/A; putative formula: C11H18N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.223,"smiles":null,"spectrum_id":"CCMSLIB00017303918","spectrum_index":43731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrindole (delta mass: 71.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.27,"smiles":null,"spectrum_id":"CCMSLIB00017303921","spectrum_index":43732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 912.4061 Da; putative annotation: N/A; putative formula: C51H56N6O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1134.5,"smiles":null,"spectrum_id":"CCMSLIB00017303924","spectrum_index":43733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 82.0996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017303927","spectrum_index":43734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 102.0834 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017303930","spectrum_index":43735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 137.0921 Da; putative annotation: N/A; putative formula: C7H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.172,"smiles":null,"spectrum_id":"CCMSLIB00017303932","spectrum_index":43736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 128.0586 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.255,"smiles":null,"spectrum_id":"CCMSLIB00017303934","spectrum_index":43737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 222.1469 Da; putative annotation: N/A; putative formula: C11H18N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.207,"smiles":null,"spectrum_id":"CCMSLIB00017303937","spectrum_index":43738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 78.0579 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.217,"smiles":null,"spectrum_id":"CCMSLIB00017303940","spectrum_index":43739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 26.9978 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.105,"smiles":null,"spectrum_id":"CCMSLIB00017303943","spectrum_index":43740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 103.0378 Da; putative annotation: N/A; putative formula: C2H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.01,"smiles":null,"spectrum_id":"CCMSLIB00017303945","spectrum_index":43741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 200.0364 Da; putative annotation: N/A; putative formula: C8H5N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.143,"smiles":null,"spectrum_id":"CCMSLIB00017303947","spectrum_index":43742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Pyridinyl)ethanol (delta mass: 63.9617 Da; putative annotation: N/A; putative formula: O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.037,"smiles":null,"spectrum_id":"CCMSLIB00017303950","spectrum_index":43743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 169.1107 Da; putative annotation: N/A; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.197,"smiles":null,"spectrum_id":"CCMSLIB00017303953","spectrum_index":43744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 58.0571 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.149,"smiles":null,"spectrum_id":"CCMSLIB00017303955","spectrum_index":43745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 57.0225 Da; putative annotation: N/A; putative formula: C2H3NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.104,"smiles":null,"spectrum_id":"CCMSLIB00017303958","spectrum_index":43746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 258.2079 Da; putative annotation: N/A; putative formula: C17H26N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.287,"smiles":null,"spectrum_id":"CCMSLIB00017303961","spectrum_index":43747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2,3-Dihydro-1H-perimidin-2-yl)-1,2-benzenediol (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.118,"smiles":null,"spectrum_id":"CCMSLIB00017303964","spectrum_index":43748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Butylurea (delta mass: 89.0703 Da; putative annotation: N/A; putative formula: CH7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.173,"smiles":null,"spectrum_id":"CCMSLIB00017303967","spectrum_index":43749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 20.0191 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.095,"smiles":null,"spectrum_id":"CCMSLIB00017303968","spectrum_index":43750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 7.0084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.073,"smiles":null,"spectrum_id":"CCMSLIB00017303971","spectrum_index":43751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 356.677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.763,"smiles":null,"spectrum_id":"CCMSLIB00017303974","spectrum_index":43752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 67.0885 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.18,"smiles":null,"spectrum_id":"CCMSLIB00017303977","spectrum_index":43753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vinblastine (delta mass: 145.9268 Da; putative annotation: N/A; putative formula: C2H-2N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.354,"smiles":null,"spectrum_id":"CCMSLIB00017303979","spectrum_index":43754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 199.0832 Da; putative annotation: N/A; putative formula: C9H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.207,"smiles":null,"spectrum_id":"CCMSLIB00017303982","spectrum_index":43755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vincamine (delta mass: 39.0912 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.293,"smiles":null,"spectrum_id":"CCMSLIB00017303985","spectrum_index":43756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 153.0792 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.176,"smiles":null,"spectrum_id":"CCMSLIB00017303987","spectrum_index":43757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 99.0688 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.213,"smiles":null,"spectrum_id":"CCMSLIB00017303990","spectrum_index":43758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 220.1983 Da; putative annotation: N/A; putative formula: C4H20N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.368,"smiles":null,"spectrum_id":"CCMSLIB00017303993","spectrum_index":43759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 368.3255 Da; putative annotation: N/A; putative formula: C19H40N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.449,"smiles":null,"spectrum_id":"CCMSLIB00017303996","spectrum_index":43760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdesmethoxycurcumin (delta mass: 161.1811 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.293,"smiles":null,"spectrum_id":"CCMSLIB00017303998","spectrum_index":43761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 102.0889 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.149,"smiles":null,"spectrum_id":"CCMSLIB00017304001","spectrum_index":43762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(?)-ampicillin - 40.0 eV (delta mass: 105.0531 Da; putative annotation: N/A; putative formula: C2H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.17,"smiles":null,"spectrum_id":"CCMSLIB00017304004","spectrum_index":43763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 287.0329 Da; putative annotation: N/A; putative formula: C16H5N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.072,"smiles":null,"spectrum_id":"CCMSLIB00017304006","spectrum_index":43764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 88.0692 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.123,"smiles":null,"spectrum_id":"CCMSLIB00017304008","spectrum_index":43765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 217.1323 Da; putative annotation: N/A; putative formula: C11H23NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.198,"smiles":null,"spectrum_id":"CCMSLIB00017304011","spectrum_index":43766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 290.1641 Da; putative annotation: N/A; putative formula: C17H18N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.256,"smiles":null,"spectrum_id":"CCMSLIB00017304014","spectrum_index":43767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 370.3518 Da; putative annotation: N/A; putative formula: C18H42N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.386,"smiles":null,"spectrum_id":"CCMSLIB00017304015","spectrum_index":43768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 198.0636 Da; putative annotation: N/A; putative formula: C8H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.15,"smiles":null,"spectrum_id":"CCMSLIB00017304018","spectrum_index":43769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 207.0877 Da; putative annotation: N/A; putative formula: C7H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.267,"smiles":null,"spectrum_id":"CCMSLIB00017304021","spectrum_index":43770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 118.0423 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.097,"smiles":null,"spectrum_id":"CCMSLIB00017304024","spectrum_index":43771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 103.0631 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.17,"smiles":null,"spectrum_id":"CCMSLIB00017304026","spectrum_index":43772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 82.0268 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.186,"smiles":null,"spectrum_id":"CCMSLIB00017304028","spectrum_index":43773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.091,"smiles":null,"spectrum_id":"CCMSLIB00017304031","spectrum_index":43774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,4,5,7-Tetramethyl-6H-pyrrolo[3,4-d]pyridazin-6-yl)aniline (delta mass: 117.2247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.385,"smiles":null,"spectrum_id":"CCMSLIB00017304034","spectrum_index":43775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 94.0748 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.14,"smiles":null,"spectrum_id":"CCMSLIB00017304037","spectrum_index":43776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 90.0242 Da; putative annotation: N/A; putative formula: C3H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.072,"smiles":null,"spectrum_id":"CCMSLIB00017304038","spectrum_index":43777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-O-Cyclouridine (delta mass: 26.0353 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.102,"smiles":null,"spectrum_id":"CCMSLIB00017304041","spectrum_index":43778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 78.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.135,"smiles":null,"spectrum_id":"CCMSLIB00017304044","spectrum_index":43779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 292.1328 Da; putative annotation: N/A; putative formula: C17H16N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.23,"smiles":null,"spectrum_id":"CCMSLIB00017304046","spectrum_index":43780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 124.0665 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.242,"smiles":null,"spectrum_id":"CCMSLIB00017304049","spectrum_index":43781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 287.1877 Da; putative annotation: N/A; putative formula: C18H25NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.279,"smiles":null,"spectrum_id":"CCMSLIB00017304051","spectrum_index":43782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 129.0669 Da; putative annotation: N/A; putative formula: C3H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.169,"smiles":null,"spectrum_id":"CCMSLIB00017304054","spectrum_index":43783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 299.0939 Da; putative annotation: N/A; putative formula: C12H17N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.227,"smiles":null,"spectrum_id":"CCMSLIB00017304056","spectrum_index":43784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 165.0791 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.208,"smiles":null,"spectrum_id":"CCMSLIB00017304059","spectrum_index":43785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 97.0613 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.215,"smiles":null,"spectrum_id":"CCMSLIB00017304062","spectrum_index":43786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 280.2039 Da; putative annotation: N/A; putative formula: C17H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.296,"smiles":null,"spectrum_id":"CCMSLIB00017304065","spectrum_index":43787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 87.9785 Da; putative annotation: N/A; putative formula: C2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.101,"smiles":null,"spectrum_id":"CCMSLIB00017304068","spectrum_index":43788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 104.0273 Da; putative annotation: N/A; putative formula: H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.145,"smiles":null,"spectrum_id":"CCMSLIB00017304070","spectrum_index":43789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benz[a]anthracen-1-ol, 8-methoxy-3-methyl- (delta mass: 181.1751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.297,"smiles":null,"spectrum_id":"CCMSLIB00017304073","spectrum_index":43790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 109.0738 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.182,"smiles":null,"spectrum_id":"CCMSLIB00017304076","spectrum_index":43791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 428.1786 Da; putative annotation: N/A; putative formula: C21H33O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.249,"smiles":null,"spectrum_id":"CCMSLIB00017304079","spectrum_index":43792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-3,4-dimethyl- (delta mass: 40.0376 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.244,"smiles":null,"spectrum_id":"CCMSLIB00017304082","spectrum_index":43793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 89.0184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.12,"smiles":null,"spectrum_id":"CCMSLIB00017304084","spectrum_index":43794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 18.0437 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.198,"smiles":null,"spectrum_id":"CCMSLIB00017304087","spectrum_index":43795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 323.2828 Da; putative annotation: N/A; putative formula: C20H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.369,"smiles":null,"spectrum_id":"CCMSLIB00017304090","spectrum_index":43796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 294.0531 Da; putative annotation: N/A; putative formula: C10H18N2O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.129,"smiles":null,"spectrum_id":"CCMSLIB00017304092","spectrum_index":43797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 138.0319 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.103,"smiles":null,"spectrum_id":"CCMSLIB00017304095","spectrum_index":43798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one (delta mass: 43.9903 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.072,"smiles":null,"spectrum_id":"CCMSLIB00017304098","spectrum_index":43799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 480.3993 Da; putative annotation: N/A; putative formula: C32H53N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":811.553,"smiles":null,"spectrum_id":"CCMSLIB00017304100","spectrum_index":43800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetanine (delta mass: 47.0339 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.173,"smiles":null,"spectrum_id":"CCMSLIB00017304103","spectrum_index":43801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-UNDECEN-1-OL (delta mass: 56.0622 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.236,"smiles":null,"spectrum_id":"CCMSLIB00017304106","spectrum_index":43802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 859.5955 Da; putative annotation: N/A; putative formula: C50H73N11O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1081.69,"smiles":null,"spectrum_id":"CCMSLIB00017304109","spectrum_index":43803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 370.2897 Da; putative annotation: N/A; putative formula: C24H39N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.402,"smiles":null,"spectrum_id":"CCMSLIB00017304111","spectrum_index":43804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 72.0574 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.227,"smiles":null,"spectrum_id":"CCMSLIB00017304113","spectrum_index":43805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 109.0549 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.194,"smiles":null,"spectrum_id":"CCMSLIB00017304116","spectrum_index":43806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 254.1233 Da; putative annotation: N/A; putative formula: C8H14N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.277,"smiles":null,"spectrum_id":"CCMSLIB00017304119","spectrum_index":43807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 385.3183 Da; putative annotation: N/A; putative formula: C22H43NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.389,"smiles":null,"spectrum_id":"CCMSLIB00017304120","spectrum_index":43808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Gly-Lys (delta mass: 85.0894 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.292,"smiles":null,"spectrum_id":"CCMSLIB00017304123","spectrum_index":43809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 755.6458 Da; putative annotation: N/A; putative formula: C45H89NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":977.743,"smiles":null,"spectrum_id":"CCMSLIB00017304126","spectrum_index":43810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 302.2096 Da; putative annotation: N/A; putative formula: C16H30O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.369,"smiles":null,"spectrum_id":"CCMSLIB00017304128","spectrum_index":43811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 239.1367 Da; putative annotation: N/A; putative formula: C13H23NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.202,"smiles":null,"spectrum_id":"CCMSLIB00017304131","spectrum_index":43812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 120.0936 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.19,"smiles":null,"spectrum_id":"CCMSLIB00017304133","spectrum_index":43813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 491.1601 Da; putative annotation: N/A; putative formula: C28H31NOP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":849.361,"smiles":null,"spectrum_id":"CCMSLIB00017304136","spectrum_index":43814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylpyridine-4-carboxylic acid (delta mass: 14.0201 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.07,"smiles":null,"spectrum_id":"CCMSLIB00017304139","spectrum_index":43815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 761.297 Da; putative annotation: N/A; putative formula: C37H39N13O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.368,"smiles":null,"spectrum_id":"CCMSLIB00017304141","spectrum_index":43816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 45.035 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.22,"smiles":null,"spectrum_id":"CCMSLIB00017304143","spectrum_index":43817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 34.0133 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.084,"smiles":null,"spectrum_id":"CCMSLIB00017304146","spectrum_index":43818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 86.0364 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017304149","spectrum_index":43819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 49.0178 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.104,"smiles":null,"spectrum_id":"CCMSLIB00017304150","spectrum_index":43820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Trifluoromethyl)-1H-indole-2-carboxylic acid (delta mass: 9.9866 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.029,"smiles":null,"spectrum_id":"CCMSLIB00017304153","spectrum_index":43821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 296.1595 Da; putative annotation: N/A; putative formula: C12H20N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.282,"smiles":null,"spectrum_id":"CCMSLIB00017304156","spectrum_index":43822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 95.0307 Da; putative annotation: N/A; putative formula: C5H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.003,"smiles":null,"spectrum_id":"CCMSLIB00017304157","spectrum_index":43823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 135.0894 Da; putative annotation: N/A; putative formula: C6H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.17,"smiles":null,"spectrum_id":"CCMSLIB00017304160","spectrum_index":43824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2,3-dione (delta mass: 36.0228 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.053,"smiles":null,"spectrum_id":"CCMSLIB00017304163","spectrum_index":43825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 8.005 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017304164","spectrum_index":43826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 59.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.212,"smiles":null,"spectrum_id":"CCMSLIB00017304167","spectrum_index":43827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 117.0576 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.144,"smiles":null,"spectrum_id":"CCMSLIB00017304170","spectrum_index":43828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Bis(3-methoxyphenyl)-1H-pyrazole (delta mass: 114.0465 Da; putative annotation: N/A; putative formula: C9H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.175,"smiles":null,"spectrum_id":"CCMSLIB00017304171","spectrum_index":43829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 129.0506 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.21,"smiles":null,"spectrum_id":"CCMSLIB00017304174","spectrum_index":43830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017304177","spectrum_index":43831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU079602 Apomorphine|(6aR)-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol (delta mass: 61.995 Da; putative annotation: N/A; putative formula: H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.128,"smiles":null,"spectrum_id":"CCMSLIB00017304178","spectrum_index":43832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 10.4196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017304181","spectrum_index":43833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 544.2128 Da; putative annotation: N/A; putative formula: C31H33N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.31,"smiles":null,"spectrum_id":"CCMSLIB00017304184","spectrum_index":43834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 24.0462 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017304187","spectrum_index":43835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 19.0236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.11,"smiles":null,"spectrum_id":"CCMSLIB00017304188","spectrum_index":43836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 51.0774 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.153,"smiles":null,"spectrum_id":"CCMSLIB00017304191","spectrum_index":43837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid; AIF: CE10; MS2Dec (delta mass: 103.0308 Da; putative annotation: N/A; putative formula: CH5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.101,"smiles":null,"spectrum_id":"CCMSLIB00017304193","spectrum_index":43838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTITOL (delta mass: 38.067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017304195","spectrum_index":43839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 70.0056 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017304198","spectrum_index":43840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 126.0107 Da; putative annotation: N/A; putative formula: C9H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.05,"smiles":null,"spectrum_id":"CCMSLIB00017304201","spectrum_index":43841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinemethanol (delta mass: 29.0262 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.086,"smiles":null,"spectrum_id":"CCMSLIB00017304202","spectrum_index":43842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 16.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.057,"smiles":null,"spectrum_id":"CCMSLIB00017304205","spectrum_index":43843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 162.0915 Da; putative annotation: N/A; putative formula: C6H15N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.156,"smiles":null,"spectrum_id":"CCMSLIB00017304208","spectrum_index":43844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE40 (delta mass: 25.0032 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.1,"smiles":null,"spectrum_id":"CCMSLIB00017304209","spectrum_index":43845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 55.2709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.287,"smiles":null,"spectrum_id":"CCMSLIB00017304212","spectrum_index":43846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00109 Loline (delta mass: 43.9889 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.107,"smiles":null,"spectrum_id":"CCMSLIB00017304215","spectrum_index":43847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 224.084 Da; putative annotation: Pinostilbene; putative formula: C15H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.249,"smiles":null,"spectrum_id":"CCMSLIB00017304216","spectrum_index":43848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Asp (delta mass: 113.0848 Da; putative annotation: L-Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.162,"smiles":null,"spectrum_id":"CCMSLIB00017304219","spectrum_index":43849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 129.0419 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.186,"smiles":null,"spectrum_id":"CCMSLIB00017304222","spectrum_index":43850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 163.0632 Da; putative annotation: Massbank:CE000229 Tyrosine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.134,"smiles":null,"spectrum_id":"CCMSLIB00017304224","spectrum_index":43851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 172.0624 Da; putative annotation: 2,3-Dimethyl-7-nitro-1H-indole; putative formula: C10H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.138,"smiles":null,"spectrum_id":"CCMSLIB00017304226","spectrum_index":43852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 264.2446 Da; putative annotation: trans-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.31,"smiles":null,"spectrum_id":"CCMSLIB00017304229","spectrum_index":43853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 370.1781 Da; putative annotation: N/A; putative formula: C22H26O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.259,"smiles":null,"spectrum_id":"CCMSLIB00017304232","spectrum_index":43854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 407.2693 Da; putative annotation: N/A; putative formula: C22H38N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.439,"smiles":null,"spectrum_id":"CCMSLIB00017304233","spectrum_index":43855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 257.1023 Da; putative annotation: N/A; putative formula: C11H11N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.162,"smiles":null,"spectrum_id":"CCMSLIB00017304236","spectrum_index":43856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 413.2666 Da; putative annotation: N/A; putative formula: C24H35N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.379,"smiles":null,"spectrum_id":"CCMSLIB00017304239","spectrum_index":43857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 101.0473 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017304240","spectrum_index":43858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 85.0522 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.123,"smiles":null,"spectrum_id":"CCMSLIB00017304243","spectrum_index":43859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hypaphorine (delta mass: 58.0527 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.197,"smiles":null,"spectrum_id":"CCMSLIB00017304246","spectrum_index":43860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Chloro-6b-hydroxy-3,14b,14c-trimethyl-5-oxo-2,3,4,5,6b,7,8,8a,9,14,14b,14c,15,16-tetradecahydro-4,16a-epoxy[1]benzoxocino[7',8':6,7]indeno[1,2-b]indol-3-yl acetate (delta mass: 56.2223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.421,"smiles":null,"spectrum_id":"CCMSLIB00017304247","spectrum_index":43861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 367.3814 Da; putative annotation: N/A; putative formula: C24H49NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.457,"smiles":null,"spectrum_id":"CCMSLIB00017304250","spectrum_index":43862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 90.0339 Da; putative annotation: N/A; putative formula: C2H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.139,"smiles":null,"spectrum_id":"CCMSLIB00017304253","spectrum_index":43863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 342.193 Da; putative annotation: N/A; putative formula: C14H27N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.348,"smiles":null,"spectrum_id":"CCMSLIB00017304254","spectrum_index":43864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 113.0848 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.202,"smiles":null,"spectrum_id":"CCMSLIB00017304257","spectrum_index":43865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 132.0401 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.105,"smiles":null,"spectrum_id":"CCMSLIB00017304260","spectrum_index":43866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 797.3461 Da; putative annotation: N/A; putative formula: C43H51N5O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":948.406,"smiles":null,"spectrum_id":"CCMSLIB00017304261","spectrum_index":43867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 408.1285 Da; putative annotation: N/A; putative formula: C18H32O2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.199,"smiles":null,"spectrum_id":"CCMSLIB00017304264","spectrum_index":43868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 608.3777 Da; putative annotation: N/A; putative formula: C36H48N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.448,"smiles":null,"spectrum_id":"CCMSLIB00017304267","spectrum_index":43869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 48.0361 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.101,"smiles":null,"spectrum_id":"CCMSLIB00017304268","spectrum_index":43870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 70.0477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.212,"smiles":null,"spectrum_id":"CCMSLIB00017304271","spectrum_index":43871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol, 1-[2-(2,4-dimethylphenyl)diazenyl]- (delta mass: 147.0388 Da; putative annotation: N/A; putative formula: C4H10N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.172,"smiles":null,"spectrum_id":"CCMSLIB00017304274","spectrum_index":43872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 408.054 Da; putative annotation: N/A; putative formula: C14H16O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.119,"smiles":null,"spectrum_id":"CCMSLIB00017304276","spectrum_index":43873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 75.0557 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.163,"smiles":null,"spectrum_id":"CCMSLIB00017304278","spectrum_index":43874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 209.0689 Da; putative annotation: N/A; putative formula: C10H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.166,"smiles":null,"spectrum_id":"CCMSLIB00017304281","spectrum_index":43875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 13.0156 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017304283","spectrum_index":43876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 284.0655 Da; putative annotation: N/A; putative formula: C12H16N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.125,"smiles":null,"spectrum_id":"CCMSLIB00017304285","spectrum_index":43877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 129.0583 Da; putative annotation: N/A; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.181,"smiles":null,"spectrum_id":"CCMSLIB00017304288","spectrum_index":43878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 544.3395 Da; putative annotation: N/A; putative formula: C26H49N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":751.426,"smiles":null,"spectrum_id":"CCMSLIB00017304291","spectrum_index":43879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 176.0993 Da; putative annotation: N/A; putative formula: C15H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.159,"smiles":null,"spectrum_id":"CCMSLIB00017304292","spectrum_index":43880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 407.3714 Da; putative annotation: N/A; putative formula: C25H49N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.447,"smiles":null,"spectrum_id":"CCMSLIB00017304295","spectrum_index":43881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-mannosamine - 40.0 eV (delta mass: 900.5653 Da; putative annotation: N/A; putative formula: C57H76N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1122.66,"smiles":null,"spectrum_id":"CCMSLIB00017304298","spectrum_index":43882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 347.1715 Da; putative annotation: N/A; putative formula: C16H17N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.32,"smiles":null,"spectrum_id":"CCMSLIB00017304300","spectrum_index":43883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Leu from NIST14 (delta mass: 111.0782 Da; putative annotation: N/A; putative formula: C5H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017304302","spectrum_index":43884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 198.0369 Da; putative annotation: N/A; putative formula: C10H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.144,"smiles":null,"spectrum_id":"CCMSLIB00017304305","spectrum_index":43885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vincamine (delta mass: 55.0084 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.21,"smiles":null,"spectrum_id":"CCMSLIB00017304306","spectrum_index":43886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 66.1059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.192,"smiles":null,"spectrum_id":"CCMSLIB00017304309","spectrum_index":43887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S)-2-amino-3-(4-methoxyphenyl)propanoic acid CollisionEnergy:102040 (delta mass: 129.0433 Da; putative annotation: N/A; putative formula: C6H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.14,"smiles":null,"spectrum_id":"CCMSLIB00017304312","spectrum_index":43888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(5-Chloro-2-methyl-1H-indol-3-yl)ethanamine (delta mass: 18.0181 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.102,"smiles":null,"spectrum_id":"CCMSLIB00017304314","spectrum_index":43889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 307.1062 Da; putative annotation: N/A; putative formula: C16H21NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.177,"smiles":null,"spectrum_id":"CCMSLIB00017304317","spectrum_index":43890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl 4-amino-3-(trifluoromethyl)phenylcarbamate (delta mass: 100.0898 Da; putative annotation: N/A; putative formula: C6H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.206,"smiles":null,"spectrum_id":"CCMSLIB00017304319","spectrum_index":43891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 114.0404 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.111,"smiles":null,"spectrum_id":"CCMSLIB00017304322","spectrum_index":43892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 140.0992 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017304325","spectrum_index":43893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 260.1334 Da; putative annotation: N/A; putative formula: C16H21OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.214,"smiles":null,"spectrum_id":"CCMSLIB00017304327","spectrum_index":43894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 616.387 Da; putative annotation: N/A; putative formula: C30H56N4O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.489,"smiles":null,"spectrum_id":"CCMSLIB00017304330","spectrum_index":43895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 99.0756 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.175,"smiles":null,"spectrum_id":"CCMSLIB00017304333","spectrum_index":43896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 153.9286 Da; putative annotation: N/A; putative formula: C4H-2N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.052,"smiles":null,"spectrum_id":"CCMSLIB00017304336","spectrum_index":43897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 45.0171 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.113,"smiles":null,"spectrum_id":"CCMSLIB00017304337","spectrum_index":43898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 164.1077 Da; putative annotation: N/A; putative formula: C8H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.173,"smiles":null,"spectrum_id":"CCMSLIB00017304340","spectrum_index":43899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 28.0061 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.191,"smiles":null,"spectrum_id":"CCMSLIB00017304343","spectrum_index":43900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ASP-PHE (delta mass: 14.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.155,"smiles":null,"spectrum_id":"CCMSLIB00017304346","spectrum_index":43901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 24.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017304347","spectrum_index":43902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 195.0466 Da; putative annotation: N/A; putative formula: C8H9N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.223,"smiles":null,"spectrum_id":"CCMSLIB00017304350","spectrum_index":43903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methoxyquinoline-2-carboxylic acid CollisionEnergy:102040 (delta mass: 74.0157 Da; putative annotation: N/A; putative formula: C6H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.081,"smiles":null,"spectrum_id":"CCMSLIB00017304353","spectrum_index":43904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 85.0515 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.133,"smiles":null,"spectrum_id":"CCMSLIB00017304356","spectrum_index":43905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 65.0604 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.152,"smiles":null,"spectrum_id":"CCMSLIB00017304357","spectrum_index":43906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 159.0686 Da; putative annotation: N/A; putative formula: C10H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.139,"smiles":null,"spectrum_id":"CCMSLIB00017304360","spectrum_index":43907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 9.1087 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.174,"smiles":null,"spectrum_id":"CCMSLIB00017304363","spectrum_index":43908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 178.1371 Da; putative annotation: N/A; putative formula: C12H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.27,"smiles":null,"spectrum_id":"CCMSLIB00017304366","spectrum_index":43909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 231.0471 Da; putative annotation: N/A; putative formula: C11H9N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.144,"smiles":null,"spectrum_id":"CCMSLIB00017304369","spectrum_index":43910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 94.0089 Da; putative annotation: N/A; putative formula: C4H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.105,"smiles":null,"spectrum_id":"CCMSLIB00017304371","spectrum_index":43911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid; AIF: CE0; MS2Dec (delta mass: 377.2888 Da; putative annotation: N/A; putative formula: C18H39N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.359,"smiles":null,"spectrum_id":"CCMSLIB00017304373","spectrum_index":43912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Speciociliatine (delta mass: 17.9971 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.225,"smiles":null,"spectrum_id":"CCMSLIB00017304376","spectrum_index":43913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 11.0404 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.142,"smiles":null,"spectrum_id":"CCMSLIB00017304379","spectrum_index":43914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amoxicillin (delta mass: 66.1603 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.272,"smiles":null,"spectrum_id":"CCMSLIB00017304382","spectrum_index":43915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 90.0462 Da; putative annotation: N/A; putative formula: CH7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017304385","spectrum_index":43916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Pro (delta mass: 60.0249 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.138,"smiles":null,"spectrum_id":"CCMSLIB00017304387","spectrum_index":43917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 60.0 eV (delta mass: 195.09 Da; putative annotation: N/A; putative formula: C10H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.166,"smiles":null,"spectrum_id":"CCMSLIB00017304390","spectrum_index":43918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 85.089 Da; putative annotation: N/A; putative formula: C5H11N)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.144,"smiles":null,"spectrum_id":"CCMSLIB00017304392","spectrum_index":43919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucrose (delta mass: 485.6673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.791,"smiles":null,"spectrum_id":"CCMSLIB00017304395","spectrum_index":43920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 382.2218 Da; putative annotation: N/A; putative formula: C18H30N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.345,"smiles":null,"spectrum_id":"CCMSLIB00017304398","spectrum_index":43921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 32.0414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.128,"smiles":null,"spectrum_id":"CCMSLIB00017304401","spectrum_index":43922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 194.2327 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.318,"smiles":null,"spectrum_id":"CCMSLIB00017304402","spectrum_index":43923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephromopsic acid (delta mass: 59.0374 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.29,"smiles":null,"spectrum_id":"CCMSLIB00017304405","spectrum_index":43924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine hydrochloride (delta mass: 18.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.141,"smiles":null,"spectrum_id":"CCMSLIB00017304408","spectrum_index":43925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 196.0439 Da; putative annotation: N/A; putative formula: C13H9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.177,"smiles":null,"spectrum_id":"CCMSLIB00017304409","spectrum_index":43926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 168.1877 Da; putative annotation: N/A; putative formula: C12H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.279,"smiles":null,"spectrum_id":"CCMSLIB00017304412","spectrum_index":43927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 66.0105 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.086,"smiles":null,"spectrum_id":"CCMSLIB00017304415","spectrum_index":43928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 51.9926 Da; putative annotation: N/A; putative formula: C3O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.058,"smiles":null,"spectrum_id":"CCMSLIB00017304416","spectrum_index":43929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 340.2279 Da; putative annotation: N/A; putative formula: C18H33N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.351,"smiles":null,"spectrum_id":"CCMSLIB00017304419","spectrum_index":43930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 174.0313 Da; putative annotation: N/A; putative formula: C10H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.17,"smiles":null,"spectrum_id":"CCMSLIB00017304422","spectrum_index":43931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 142.0161 Da; putative annotation: N/A; putative formula: C2H3N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.134,"smiles":null,"spectrum_id":"CCMSLIB00017304424","spectrum_index":43932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C8:0 (delta mass: 126.9907 Da; putative annotation: N/A; putative formula: C4HNO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.203,"smiles":null,"spectrum_id":"CCMSLIB00017304426","spectrum_index":43933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 311.4727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.638,"smiles":null,"spectrum_id":"CCMSLIB00017304429","spectrum_index":43934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 199.0908 Da; putative annotation: N/A; putative formula: C13H14NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.203,"smiles":null,"spectrum_id":"CCMSLIB00017304432","spectrum_index":43935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 357.2065 Da; putative annotation: N/A; putative formula: C21H23N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.309,"smiles":null,"spectrum_id":"CCMSLIB00017304434","spectrum_index":43936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 384.2511 Da; putative annotation: N/A; putative formula: C21H36O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.322,"smiles":null,"spectrum_id":"CCMSLIB00017304436","spectrum_index":43937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylserotonin (delta mass: 139.064 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.177,"smiles":null,"spectrum_id":"CCMSLIB00017304439","spectrum_index":43938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 74.0726 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.185,"smiles":null,"spectrum_id":"CCMSLIB00017304442","spectrum_index":43939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 60.0365 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.112,"smiles":null,"spectrum_id":"CCMSLIB00017304444","spectrum_index":43940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 27.9637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.061,"smiles":null,"spectrum_id":"CCMSLIB00017304447","spectrum_index":43941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 124.1252 Da; putative annotation: N/A; putative formula: C9H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.196,"smiles":null,"spectrum_id":"CCMSLIB00017304450","spectrum_index":43942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU244306 2-Amino-9H-pyrido[2,3-b]indole (AalphaC)|2-Amino-9H-pyrido[2,3-b]indole|9H-pyrido[2,3-b]indol-2-amine (delta mass: 73.0499 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.137,"smiles":null,"spectrum_id":"CCMSLIB00017304453","spectrum_index":43943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 76.0493 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.198,"smiles":null,"spectrum_id":"CCMSLIB00017304455","spectrum_index":43944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 17.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.268,"smiles":null,"spectrum_id":"CCMSLIB00017304458","spectrum_index":43945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 109.0053 Da; putative annotation: N/A; putative formula: H4N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.108,"smiles":null,"spectrum_id":"CCMSLIB00017304461","spectrum_index":43946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 176.0111 Da; putative annotation: N/A; putative formula: C9H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.087,"smiles":null,"spectrum_id":"CCMSLIB00017304464","spectrum_index":43947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005923 Tetrahydropapaveroline|1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 125.0835 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.207,"smiles":null,"spectrum_id":"CCMSLIB00017304466","spectrum_index":43948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 93.0617 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.159,"smiles":null,"spectrum_id":"CCMSLIB00017304468","spectrum_index":43949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C4:0 (delta mass: 70.9893 Da; putative annotation: N/A; putative formula: C2H2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017304471","spectrum_index":43950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of rac-4-(Methylamino)-1-(3-pyridyl)-1-butanol (delta mass: 144.0393 Da; putative annotation: N/A; putative formula: C2H4N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.173,"smiles":null,"spectrum_id":"CCMSLIB00017304474","spectrum_index":43951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 106.0054 Da; putative annotation: N/A; putative formula: C6H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.129,"smiles":null,"spectrum_id":"CCMSLIB00017304477","spectrum_index":43952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 95.0714 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.205,"smiles":null,"spectrum_id":"CCMSLIB00017304478","spectrum_index":43953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 67.0633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.175,"smiles":null,"spectrum_id":"CCMSLIB00017304481","spectrum_index":43954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 144.0153 Da; putative annotation: N/A; putative formula: C8H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.096,"smiles":null,"spectrum_id":"CCMSLIB00017304484","spectrum_index":43955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 68.085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.15,"smiles":null,"spectrum_id":"CCMSLIB00017304487","spectrum_index":43956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 560.6007 Da; putative annotation: N/A; putative formula: C38H76N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.687,"smiles":null,"spectrum_id":"CCMSLIB00017304488","spectrum_index":43957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 549.827 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.913,"smiles":null,"spectrum_id":"CCMSLIB00017304491","spectrum_index":43958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSAMINE (delta mass: 166.0724 Da; putative annotation: N/A; putative formula: C4H6N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.159,"smiles":null,"spectrum_id":"CCMSLIB00017304494","spectrum_index":43959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10'-hydroxy-11'-methoxy-5'-methyl-5'-azaspiro[cyclohexane-1,2'-tricyclo[6.3.1.0?,]dodecane]-1'(12'),2,5,8',10'-pentaen-4-one (delta mass: 28.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.212,"smiles":null,"spectrum_id":"CCMSLIB00017304496","spectrum_index":43960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1029.5278 Da; putative annotation: N/A; putative formula: C79H67N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1210.6,"smiles":null,"spectrum_id":"CCMSLIB00017304499","spectrum_index":43961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 591.9593 Da; putative annotation: N/A; putative formula: C19H16N2O12S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":884.062,"smiles":null,"spectrum_id":"CCMSLIB00017304501","spectrum_index":43962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyldanofloxacin (delta mass: 18.1287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.269,"smiles":null,"spectrum_id":"CCMSLIB00017304504","spectrum_index":43963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 335.1725 Da; putative annotation: N/A; putative formula: C12H26N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.259,"smiles":null,"spectrum_id":"CCMSLIB00017304507","spectrum_index":43964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 9.9106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.966,"smiles":null,"spectrum_id":"CCMSLIB00017304510","spectrum_index":43965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 293.2203 Da; putative annotation: N/A; putative formula: C15H27N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.285,"smiles":null,"spectrum_id":"CCMSLIB00017304513","spectrum_index":43966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CloxacillinNa (delta mass: 282.1687 Da; putative annotation: N/A; putative formula: C15H27N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.242,"smiles":null,"spectrum_id":"CCMSLIB00017304515","spectrum_index":43967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 215.0945 Da; putative annotation: N/A; putative formula: C13H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.17,"smiles":null,"spectrum_id":"CCMSLIB00017304517","spectrum_index":43968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 786.424 Da; putative annotation: N/A; putative formula: C33H58N10O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1008.52,"smiles":null,"spectrum_id":"CCMSLIB00017304520","spectrum_index":43969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C9:0 (delta mass: 72.0726 Da; putative annotation: N/A; putative formula: C3H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.3,"smiles":null,"spectrum_id":"CCMSLIB00017304523","spectrum_index":43970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.17,"smiles":null,"spectrum_id":"CCMSLIB00017304526","spectrum_index":43971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 57.0579 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.176,"smiles":null,"spectrum_id":"CCMSLIB00017304527","spectrum_index":43972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 57.021 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.129,"smiles":null,"spectrum_id":"CCMSLIB00017304530","spectrum_index":43973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 49.0054 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017304533","spectrum_index":43974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 224.1525 Da; putative annotation: N/A; putative formula: C12H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.249,"smiles":null,"spectrum_id":"CCMSLIB00017304536","spectrum_index":43975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Ala (delta mass: 18.0097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.097,"smiles":null,"spectrum_id":"CCMSLIB00017304537","spectrum_index":43976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 92.0111 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.108,"smiles":null,"spectrum_id":"CCMSLIB00017304540","spectrum_index":43977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 105.0758 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.203,"smiles":null,"spectrum_id":"CCMSLIB00017304543","spectrum_index":43978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.128,"smiles":null,"spectrum_id":"CCMSLIB00017304546","spectrum_index":43979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 60.0866 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.108,"smiles":null,"spectrum_id":"CCMSLIB00017304548","spectrum_index":43980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 271.1569 Da; putative annotation: N/A; putative formula: C17H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.237,"smiles":null,"spectrum_id":"CCMSLIB00017304550","spectrum_index":43981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 10.0546 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.151,"smiles":null,"spectrum_id":"CCMSLIB00017304553","spectrum_index":43982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methylquinoline-2-carboxylic acid CollisionEnergy:205060 (delta mass: 58.0264 Da; putative annotation: N/A; putative formula: H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.097,"smiles":null,"spectrum_id":"CCMSLIB00017304556","spectrum_index":43983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110102 Terbutaline|5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol (delta mass: 92.0263 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.17,"smiles":null,"spectrum_id":"CCMSLIB00017304557","spectrum_index":43984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 131.0559 Da; putative annotation: N/A; putative formula: CH5N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.132,"smiles":null,"spectrum_id":"CCMSLIB00017304560","spectrum_index":43985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 26.0141 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.079,"smiles":null,"spectrum_id":"CCMSLIB00017304563","spectrum_index":43986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 336.3392 Da; putative annotation: N/A; putative formula: C23H44O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.61,"smiles":null,"spectrum_id":"CCMSLIB00017304565","spectrum_index":43987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 2.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.076,"smiles":null,"spectrum_id":"CCMSLIB00017304568","spectrum_index":43988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxy-2-methylindole-3-carboxylic acid CollisionEnergy:205060 (delta mass: 55.9901 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.056,"smiles":null,"spectrum_id":"CCMSLIB00017304571","spectrum_index":43989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Indolinone (delta mass: 135.9923 Da; putative annotation: N/A; putative formula: C3H5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.052,"smiles":null,"spectrum_id":"CCMSLIB00017304574","spectrum_index":43990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rhetsinine (delta mass: 180.0732 Da; putative annotation: N/A; putative formula: C2H4N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.213,"smiles":null,"spectrum_id":"CCMSLIB00017304576","spectrum_index":43991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017304581","spectrum_index":43992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinemethanol (delta mass: 43.0054 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.065,"smiles":null,"spectrum_id":"CCMSLIB00017304582","spectrum_index":43993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 147.068 Da; putative annotation: 4-hydroxy-4-(pyridin-2-yl)butan-2-one; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.128,"smiles":null,"spectrum_id":"CCMSLIB00017304585","spectrum_index":43994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 85.0524 Da; putative annotation: .gamma.-Aminobutyric acid; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.139,"smiles":null,"spectrum_id":"CCMSLIB00017304588","spectrum_index":43995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 148.0516 Da; putative annotation: Tropic acid; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.159,"smiles":null,"spectrum_id":"CCMSLIB00017304591","spectrum_index":43996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ASP-PHE (delta mass: 147.0684 Da; putative annotation: L-Phenylalanine; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.182,"smiles":null,"spectrum_id":"CCMSLIB00017304594","spectrum_index":43997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 280.0361 Da; putative annotation: 7-Chloro-8-methyl-2-(2-pyridinyl)-4-quinolinecarboxylic acid; putative formula: C16H9ClN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.096,"smiles":null,"spectrum_id":"CCMSLIB00017304596","spectrum_index":43998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 144.0223 Da; putative annotation: Massbank:AU231202 4-Hydroxycoumarin|4-hydroxychromen-2-one; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.093,"smiles":null,"spectrum_id":"CCMSLIB00017304598","spectrum_index":43999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 309.1187 Da; putative annotation: Massbank:PR310826 N-Fructosyl phenylalanine; putative formula: C15H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.242,"smiles":null,"spectrum_id":"CCMSLIB00017304601","spectrum_index":44000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 256.1103 Da; putative annotation: 10-Hydroxy-7,9-dimethyl-1,3,4,4a,7,7a-hexahydrobenzo[e]naphthalene-2,8,11-trione; putative formula: C16H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.181,"smiles":null,"spectrum_id":"CCMSLIB00017304604","spectrum_index":44001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine - 40.0 eV (delta mass: 112.053 Da; putative annotation: 4-Oxohexanoic acid; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017304605","spectrum_index":44002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 59.0172 Da; putative annotation: N/A; putative formula: C5HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.177,"smiles":null,"spectrum_id":"CCMSLIB00017304608","spectrum_index":44003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 199.082 Da; putative annotation: N/A; putative formula: C13H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.267,"smiles":null,"spectrum_id":"CCMSLIB00017304611","spectrum_index":44004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R)-4-Methyl-6-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one (delta mass: 362.2069 Da; putative annotation: N/A; putative formula: C25H30S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.4,"smiles":null,"spectrum_id":"CCMSLIB00017304614","spectrum_index":44005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydromorphine (delta mass: 17.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017304617","spectrum_index":44006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 291.0952 Da; putative annotation: N/A; putative formula: C11H17NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.207,"smiles":null,"spectrum_id":"CCMSLIB00017304619","spectrum_index":44007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU022001 Labetalol|2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide (delta mass: 291.1963 Da; putative annotation: N/A; putative formula: C14H30NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.382,"smiles":null,"spectrum_id":"CCMSLIB00017304621","spectrum_index":44008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-7-methoxy-9H-pyrido[3,4-b]indol-8-yl)-2-methyl- (delta mass: 237.5051 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.601,"smiles":null,"spectrum_id":"CCMSLIB00017304624","spectrum_index":44009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 249.0311 Da; putative annotation: N/A; putative formula: C8H11NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.118,"smiles":null,"spectrum_id":"CCMSLIB00017304627","spectrum_index":44010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 314.0521 Da; putative annotation: N/A; putative formula: C12H10N8O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.112,"smiles":null,"spectrum_id":"CCMSLIB00017304630","spectrum_index":44011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylnicotinic acid (delta mass: 74.0009 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.056,"smiles":null,"spectrum_id":"CCMSLIB00017304631","spectrum_index":44012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 196.0877 Da; putative annotation: N/A; putative formula: C14H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.163,"smiles":null,"spectrum_id":"CCMSLIB00017304634","spectrum_index":44013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 39.0937 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017304637","spectrum_index":44014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 130.0419 Da; putative annotation: N/A; putative formula: C9H6O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.107,"smiles":null,"spectrum_id":"CCMSLIB00017304640","spectrum_index":44015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 40.0 eV (delta mass: 207.1111 Da; putative annotation: N/A; putative formula: C8H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.187,"smiles":null,"spectrum_id":"CCMSLIB00017304643","spectrum_index":44016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 197.02 Da; putative annotation: N/A; putative formula: C6H-1N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.205,"smiles":null,"spectrum_id":"CCMSLIB00017304644","spectrum_index":44017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 424.2305 Da; putative annotation: N/A; putative formula: C32H28N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.296,"smiles":null,"spectrum_id":"CCMSLIB00017304647","spectrum_index":44018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Leu from NIST14 (delta mass: 226.1766 Da; putative annotation: N/A; putative formula: C7H18N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.326,"smiles":null,"spectrum_id":"CCMSLIB00017304650","spectrum_index":44019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 162.0469 Da; putative annotation: N/A; putative formula: C13H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.186,"smiles":null,"spectrum_id":"CCMSLIB00017304653","spectrum_index":44020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 488.2127 Da; putative annotation: N/A; putative formula: C21H36N4O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.31,"smiles":null,"spectrum_id":"CCMSLIB00017304655","spectrum_index":44021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 384.2856 Da; putative annotation: N/A; putative formula: C26H40S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.367,"smiles":null,"spectrum_id":"CCMSLIB00017304657","spectrum_index":44022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 72.0568 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.206,"smiles":null,"spectrum_id":"CCMSLIB00017304660","spectrum_index":44023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 65.0621 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.148,"smiles":null,"spectrum_id":"CCMSLIB00017304663","spectrum_index":44024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 249.1499 Da; putative annotation: N/A; putative formula: C11H24NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.29,"smiles":null,"spectrum_id":"CCMSLIB00017304664","spectrum_index":44025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 204.0787 Da; putative annotation: N/A; putative formula: C12H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.134,"smiles":null,"spectrum_id":"CCMSLIB00017304667","spectrum_index":44026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenylethylamine (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017304670","spectrum_index":44027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 127.0619 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.164,"smiles":null,"spectrum_id":"CCMSLIB00017304672","spectrum_index":44028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 474.1962 Da; putative annotation: N/A; putative formula: C19H30N4O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.293,"smiles":null,"spectrum_id":"CCMSLIB00017304674","spectrum_index":44029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 83.0373 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017304677","spectrum_index":44030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 218.0418 Da; putative annotation: N/A; putative formula: C12H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.133,"smiles":null,"spectrum_id":"CCMSLIB00017304680","spectrum_index":44031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norharmane (delta mass: 41.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.121,"smiles":null,"spectrum_id":"CCMSLIB00017304683","spectrum_index":44032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 13.0218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.108,"smiles":null,"spectrum_id":"CCMSLIB00017304686","spectrum_index":44033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PM018176 Spermidine-di-p-coumaroyl (delta mass: 79.9563 Da; putative annotation: N/A; putative formula: O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.195,"smiles":null,"spectrum_id":"CCMSLIB00017304687","spectrum_index":44034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 571.2383 Da; putative annotation: N/A; putative formula: C26H41N3O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.335,"smiles":null,"spectrum_id":"CCMSLIB00017304690","spectrum_index":44035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 378.304 Da; putative annotation: N/A; putative formula: C11H34N14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.4,"smiles":null,"spectrum_id":"CCMSLIB00017304693","spectrum_index":44036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 164.0995 Da; putative annotation: N/A; putative formula: C14H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.165,"smiles":null,"spectrum_id":"CCMSLIB00017304696","spectrum_index":44037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 24.0026 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.188,"smiles":null,"spectrum_id":"CCMSLIB00017304699","spectrum_index":44038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 262.0809 Da; putative annotation: N/A; putative formula: C10H18N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.202,"smiles":null,"spectrum_id":"CCMSLIB00017304702","spectrum_index":44039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylleucylalanylserine (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.208,"smiles":null,"spectrum_id":"CCMSLIB00017304704","spectrum_index":44040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylic acid (delta mass: 244.1209 Da; putative annotation: N/A; putative formula: C14H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.234,"smiles":null,"spectrum_id":"CCMSLIB00017304706","spectrum_index":44041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lactose from NIST14 (delta mass: 590.4335 Da; putative annotation: N/A; putative formula: C39H58O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":933.557,"smiles":null,"spectrum_id":"CCMSLIB00017304709","spectrum_index":44042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 587.2601 Da; putative annotation: N/A; putative formula: C29H41N5O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.362,"smiles":null,"spectrum_id":"CCMSLIB00017304712","spectrum_index":44043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 48.0373 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.212,"smiles":null,"spectrum_id":"CCMSLIB00017304714","spectrum_index":44044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 174.0243 Da; putative annotation: N/A; putative formula: CH2N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.065,"smiles":null,"spectrum_id":"CCMSLIB00017304716","spectrum_index":44045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 326.1111 Da; putative annotation: N/A; putative formula: C14H18N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":993.34,"smiles":null,"spectrum_id":"CCMSLIB00017304719","spectrum_index":44046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 972.3142 Da; putative annotation: N/A; putative formula: C74H40N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1315.44,"smiles":null,"spectrum_id":"CCMSLIB00017304722","spectrum_index":44047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirubactin (delta mass: 388.2252 Da; putative annotation: N/A; putative formula: C23H32O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":993.445,"smiles":null,"spectrum_id":"CCMSLIB00017304723","spectrum_index":44048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 61.0722 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.153,"smiles":null,"spectrum_id":"CCMSLIB00017304726","spectrum_index":44049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 66.0468 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.169,"smiles":null,"spectrum_id":"CCMSLIB00017304729","spectrum_index":44050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Indole-3-lactic acid from NIST14 (delta mass: 176.0826 Da; putative annotation: N/A; putative formula: C5H13N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.164,"smiles":null,"spectrum_id":"CCMSLIB00017304732","spectrum_index":44051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 410.3966 Da; putative annotation: N/A; putative formula: C20H46N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.519,"smiles":null,"spectrum_id":"CCMSLIB00017304733","spectrum_index":44052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 56.0619 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.148,"smiles":null,"spectrum_id":"CCMSLIB00017304736","spectrum_index":44053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 172.089 Da; putative annotation: N/A; putative formula: C12H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.133,"smiles":null,"spectrum_id":"CCMSLIB00017304739","spectrum_index":44054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 80.0307 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.07,"smiles":null,"spectrum_id":"CCMSLIB00017304741","spectrum_index":44055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 16.8214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.976,"smiles":null,"spectrum_id":"CCMSLIB00017304743","spectrum_index":44056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Thr (delta mass: 224.2138 Da; putative annotation: N/A; putative formula: C15H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.301,"smiles":null,"spectrum_id":"CCMSLIB00017304746","spectrum_index":44057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 158.0575 Da; putative annotation: N/A; putative formula: C7H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.133,"smiles":null,"spectrum_id":"CCMSLIB00017304749","spectrum_index":44058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT106523 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole|2-(4-methyl-1,3-thiazol-5-yl)ethanol (delta mass: 30.1012 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.149,"smiles":null,"spectrum_id":"CCMSLIB00017304750","spectrum_index":44059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 128.0658 Da; putative annotation: N/A; putative formula: C7H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.167,"smiles":null,"spectrum_id":"CCMSLIB00017304753","spectrum_index":44060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 87.0749 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.151,"smiles":null,"spectrum_id":"CCMSLIB00017304756","spectrum_index":44061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 278.0399 Da; putative annotation: N/A; putative formula: C9H6N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.216,"smiles":null,"spectrum_id":"CCMSLIB00017304758","spectrum_index":44062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 339.1449 Da; putative annotation: N/A; putative formula: C13H26NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.242,"smiles":null,"spectrum_id":"CCMSLIB00017304760","spectrum_index":44063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 74.0732 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017304763","spectrum_index":44064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 176.0834 Da; putative annotation: N/A; putative formula: C11H12O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.149,"smiles":null,"spectrum_id":"CCMSLIB00017304766","spectrum_index":44065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 100.068 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.197,"smiles":null,"spectrum_id":"CCMSLIB00017304769","spectrum_index":44066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 306.2698 Da; putative annotation: N/A; putative formula: C24H34O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.398,"smiles":null,"spectrum_id":"CCMSLIB00017304771","spectrum_index":44067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 171.0897 Da; putative annotation: N/A; putative formula: C8H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.165,"smiles":null,"spectrum_id":"CCMSLIB00017304773","spectrum_index":44068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 517.1643 Da; putative annotation: N/A; putative formula: C18H31NO16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.288,"smiles":null,"spectrum_id":"CCMSLIB00017304776","spectrum_index":44069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 263.1008 Da; putative annotation: N/A; putative formula: C13H18N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.265,"smiles":null,"spectrum_id":"CCMSLIB00017304779","spectrum_index":44070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 367.2167 Da; putative annotation: N/A; putative formula: C16H31N7O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.34,"smiles":null,"spectrum_id":"CCMSLIB00017304781","spectrum_index":44071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 729.5034 Da; putative annotation: N/A; putative formula: C32H71N7O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":909.59,"smiles":null,"spectrum_id":"CCMSLIB00017304783","spectrum_index":44072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 143.9652 Da; putative annotation: N/A; putative formula: C2HN4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.992,"smiles":null,"spectrum_id":"CCMSLIB00017304786","spectrum_index":44073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 42.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.217,"smiles":null,"spectrum_id":"CCMSLIB00017304789","spectrum_index":44074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 64.0425 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.129,"smiles":null,"spectrum_id":"CCMSLIB00017304792","spectrum_index":44075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin CollisionEnergy:205060 (delta mass: 194.0938 Da; putative annotation: N/A; putative formula: C5H15N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.206,"smiles":null,"spectrum_id":"CCMSLIB00017304794","spectrum_index":44076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 118.1145 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.264,"smiles":null,"spectrum_id":"CCMSLIB00017304796","spectrum_index":44077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 27.9984 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.061,"smiles":null,"spectrum_id":"CCMSLIB00017304799","spectrum_index":44078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 125.0474 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017304802","spectrum_index":44079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 334.1786 Da; putative annotation: N/A; putative formula: C12H26N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.249,"smiles":null,"spectrum_id":"CCMSLIB00017304805","spectrum_index":44080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 15.5562 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.627,"smiles":null,"spectrum_id":"CCMSLIB00017304807","spectrum_index":44081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 292.1521 Da; putative annotation: N/A; putative formula: C13H24O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.238,"smiles":null,"spectrum_id":"CCMSLIB00017304809","spectrum_index":44082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 308.2761 Da; putative annotation: N/A; putative formula: C19H37N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.378,"smiles":null,"spectrum_id":"CCMSLIB00017304812","spectrum_index":44083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 257.1873 Da; putative annotation: N/A; putative formula: C16H23N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.263,"smiles":null,"spectrum_id":"CCMSLIB00017304815","spectrum_index":44084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 68.9718 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.064,"smiles":null,"spectrum_id":"CCMSLIB00017304818","spectrum_index":44085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 189.0438 Da; putative annotation: N/A; putative formula: C11H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.141,"smiles":null,"spectrum_id":"CCMSLIB00017304821","spectrum_index":44086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 45.0103 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017304823","spectrum_index":44087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 1H-Indole-4-carboxaldehyde from NIST14 (delta mass: 15.04 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017304825","spectrum_index":44088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 360.0636 Da; putative annotation: N/A; putative formula: C14H20N2O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.187,"smiles":null,"spectrum_id":"CCMSLIB00017304828","spectrum_index":44089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 58.0201 Da; putative annotation: N/A; putative formula: C6H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.273,"smiles":null,"spectrum_id":"CCMSLIB00017304831","spectrum_index":44090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 556.1998 Da; putative annotation: N/A; putative formula: C35H28N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.26,"smiles":null,"spectrum_id":"CCMSLIB00017304834","spectrum_index":44091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003357 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 126.0673 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.106,"smiles":null,"spectrum_id":"CCMSLIB00017304837","spectrum_index":44092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 423.5788 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.665,"smiles":null,"spectrum_id":"CCMSLIB00017304839","spectrum_index":44093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 436.1375 Da; putative annotation: N/A; putative formula: C24H25N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.25,"smiles":null,"spectrum_id":"CCMSLIB00017304841","spectrum_index":44094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 132.0749 Da; putative annotation: N/A; putative formula: C2H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.135,"smiles":null,"spectrum_id":"CCMSLIB00017304844","spectrum_index":44095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 112.0517 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.148,"smiles":null,"spectrum_id":"CCMSLIB00017304847","spectrum_index":44096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 128.0629 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.139,"smiles":null,"spectrum_id":"CCMSLIB00017304850","spectrum_index":44097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 28.0289 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.194,"smiles":null,"spectrum_id":"CCMSLIB00017304851","spectrum_index":44098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 78.047 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.206,"smiles":null,"spectrum_id":"CCMSLIB00017304854","spectrum_index":44099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.123,"smiles":null,"spectrum_id":"CCMSLIB00017304857","spectrum_index":44100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 53.0587 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.134,"smiles":null,"spectrum_id":"CCMSLIB00017304860","spectrum_index":44101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 95.0583 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.139,"smiles":null,"spectrum_id":"CCMSLIB00017304863","spectrum_index":44102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trigonelline (delta mass: 32.0089 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.064,"smiles":null,"spectrum_id":"CCMSLIB00017304866","spectrum_index":44103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylphenol (delta mass: 46.0205 Da; putative annotation: N/A; putative formula: C5H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.096,"smiles":null,"spectrum_id":"CCMSLIB00017304868","spectrum_index":44104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 74.0453 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.107,"smiles":null,"spectrum_id":"CCMSLIB00017304871","spectrum_index":44105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 535.8118 Da; putative annotation: N/A; putative formula: C6H6O17P6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.909,"smiles":null,"spectrum_id":"CCMSLIB00017304874","spectrum_index":44106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 553.2711 Da; putative annotation: N/A; putative formula: C28H43NO8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.357,"smiles":null,"spectrum_id":"CCMSLIB00017304877","spectrum_index":44107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.138,"smiles":null,"spectrum_id":"CCMSLIB00017304879","spectrum_index":44108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 440.3111 Da; putative annotation: N/A; putative formula: C21H40N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.408,"smiles":null,"spectrum_id":"CCMSLIB00017304882","spectrum_index":44109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 28.1047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.29,"smiles":null,"spectrum_id":"CCMSLIB00017304885","spectrum_index":44110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 108.021 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.134,"smiles":null,"spectrum_id":"CCMSLIB00017304887","spectrum_index":44111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 17.0642 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.177,"smiles":null,"spectrum_id":"CCMSLIB00017304890","spectrum_index":44112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 151.1904 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.298,"smiles":null,"spectrum_id":"CCMSLIB00017304893","spectrum_index":44113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of imbricatine (delta mass: 32.0257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.122,"smiles":null,"spectrum_id":"CCMSLIB00017304896","spectrum_index":44114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 73.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.159,"smiles":null,"spectrum_id":"CCMSLIB00017304898","spectrum_index":44115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100009 (R)-(-)-Phenylephrine|Neo-Synephrine|Metasympatol|Visadron|Mesaton|Mezaton|Metaoxedrine|m-Sympatol|m-Oxedrine|(R)-(?)-1-(3-Hydroxyphenyl)-2-methylaminoethanol|L-(3-Hydroxyphenyl)-N-methylethanolamine (delta mass: 476.3233 Da; putative annotation: N/A; putative formula: C24H36N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.425,"smiles":null,"spectrum_id":"CCMSLIB00017304901","spectrum_index":44116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 364.2248 Da; putative annotation: N/A; putative formula: C24H29FN2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.295,"smiles":null,"spectrum_id":"CCMSLIB00017304904","spectrum_index":44117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 16.0854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017304907","spectrum_index":44118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 92.0248 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.254,"smiles":null,"spectrum_id":"CCMSLIB00017304910","spectrum_index":44119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 44.0288 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.115,"smiles":null,"spectrum_id":"CCMSLIB00017304912","spectrum_index":44120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 76.0675 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.294,"smiles":null,"spectrum_id":"CCMSLIB00017304916","spectrum_index":44121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 137.0478 Da; putative annotation: N/A; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.108,"smiles":null,"spectrum_id":"CCMSLIB00017304919","spectrum_index":44122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 179.0788 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.243,"smiles":null,"spectrum_id":"CCMSLIB00017304922","spectrum_index":44123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 60.0243 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.051,"smiles":null,"spectrum_id":"CCMSLIB00017304925","spectrum_index":44124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 49.0792 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.144,"smiles":null,"spectrum_id":"CCMSLIB00017304928","spectrum_index":44125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 164.0483 Da; putative annotation: N/A; putative formula: C10H4N4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.113,"smiles":null,"spectrum_id":"CCMSLIB00017304931","spectrum_index":44126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 139.0676 Da; putative annotation: N/A; putative formula: C6H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.156,"smiles":null,"spectrum_id":"CCMSLIB00017304934","spectrum_index":44127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017304937","spectrum_index":44128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 81.9375 Da; putative annotation: N/A; putative formula: C3H-2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.013,"smiles":null,"spectrum_id":"CCMSLIB00017304940","spectrum_index":44129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-N-phenyl-1H-indole-2-carboxamide (delta mass: 67.0848 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.203,"smiles":null,"spectrum_id":"CCMSLIB00017304943","spectrum_index":44130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 94.078 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.165,"smiles":null,"spectrum_id":"CCMSLIB00017304946","spectrum_index":44131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 121.0452 Da; putative annotation: N/A; putative formula: C7H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.173,"smiles":null,"spectrum_id":"CCMSLIB00017304948","spectrum_index":44132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Hydroxybenzoylecgonine (delta mass: 107.0774 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.211,"smiles":null,"spectrum_id":"CCMSLIB00017304951","spectrum_index":44133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Leu from NIST14 (delta mass: 226.17 Da; putative annotation: Ile-Leu; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.34,"smiles":null,"spectrum_id":"CCMSLIB00017304954","spectrum_index":44134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 115.0082 Da; putative annotation: 1,3-Thiazolidine-4-carboxylic acid; putative formula: C4H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.068,"smiles":null,"spectrum_id":"CCMSLIB00017304957","spectrum_index":44135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 432.0685 Da; putative annotation: Massbank:PR101028 Myricetin-3-Xyloside|Myrc-3-Xyl; putative formula: C20H16O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.129,"smiles":null,"spectrum_id":"CCMSLIB00017304959","spectrum_index":44136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 173.1203 Da; putative annotation: 4-Ethylmethcathinone; putative formula: C12H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.269,"smiles":null,"spectrum_id":"CCMSLIB00017304961","spectrum_index":44137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 128.0474 Da; putative annotation: Adipic acid; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.123,"smiles":null,"spectrum_id":"CCMSLIB00017304964","spectrum_index":44138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000277 Viridicatin|3-hydroxy-4-phenyl-1H-quinolin-2-one (delta mass: 143.0577 Da; putative annotation: Acetyl-L-threonine; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.144,"smiles":null,"spectrum_id":"CCMSLIB00017304967","spectrum_index":44139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 174.0679 Da; putative annotation: Dehydrozingerone; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.128,"smiles":null,"spectrum_id":"CCMSLIB00017304970","spectrum_index":44140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 120.0569 Da; putative annotation: 2-Hydroxyphenethyl alcohol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017304973","spectrum_index":44141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 186.0637 Da; putative annotation: Asp-Ala; putative formula: C7H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.15,"smiles":null,"spectrum_id":"CCMSLIB00017304976","spectrum_index":44142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 250.1567 Da; putative annotation: 1(4H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-4,6-dihydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-; putative formula: C15H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.237,"smiles":null,"spectrum_id":"CCMSLIB00017304978","spectrum_index":44143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 241.1478 Da; putative annotation: N/A; putative formula: C9H19N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.249,"smiles":null,"spectrum_id":"CCMSLIB00017304981","spectrum_index":44144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lotusine (delta mass: 308.0956 Da; putative annotation: N/A; putative formula: C14H12N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.271,"smiles":null,"spectrum_id":"CCMSLIB00017304983","spectrum_index":44145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 409.2836 Da; putative annotation: N/A; putative formula: C24H43NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.453,"smiles":null,"spectrum_id":"CCMSLIB00017304986","spectrum_index":44146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 176.1746 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.22,"smiles":null,"spectrum_id":"CCMSLIB00017304989","spectrum_index":44147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 166.078 Da; putative annotation: N/A; putative formula: C13H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.202,"smiles":null,"spectrum_id":"CCMSLIB00017304992","spectrum_index":44148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 40.0295 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.235,"smiles":null,"spectrum_id":"CCMSLIB00017304995","spectrum_index":44149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 257.1048 Da; putative annotation: N/A; putative formula: C15H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.181,"smiles":null,"spectrum_id":"CCMSLIB00017304997","spectrum_index":44150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.216,"smiles":null,"spectrum_id":"CCMSLIB00017305000","spectrum_index":44151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 663.3058 Da; putative annotation: N/A; putative formula: C38H41N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.428,"smiles":null,"spectrum_id":"CCMSLIB00017305003","spectrum_index":44152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310797 Pyridoxine + O-Hex (delta mass: 91.0422 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.176,"smiles":null,"spectrum_id":"CCMSLIB00017305006","spectrum_index":44153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 26.9983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.07,"smiles":null,"spectrum_id":"CCMSLIB00017305009","spectrum_index":44154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 146.1666 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.247,"smiles":null,"spectrum_id":"CCMSLIB00017305011","spectrum_index":44155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 909.4188 Da; putative annotation: N/A; putative formula: C51H51N13O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1072.48,"smiles":null,"spectrum_id":"CCMSLIB00017305014","spectrum_index":44156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 545.2103 Da; putative annotation: N/A; putative formula: C37H27N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.344,"smiles":null,"spectrum_id":"CCMSLIB00017305017","spectrum_index":44157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 805.4259 Da; putative annotation: N/A; putative formula: C56H51N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":998.497,"smiles":null,"spectrum_id":"CCMSLIB00017305019","spectrum_index":44158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 192.1344 Da; putative annotation: N/A; putative formula: C13H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.262,"smiles":null,"spectrum_id":"CCMSLIB00017305022","spectrum_index":44159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 82.0307 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.165,"smiles":null,"spectrum_id":"CCMSLIB00017305025","spectrum_index":44160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 138.0317 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.092,"smiles":null,"spectrum_id":"CCMSLIB00017305028","spectrum_index":44161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin E (delta mass: 18.0256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.216,"smiles":null,"spectrum_id":"CCMSLIB00017305030","spectrum_index":44162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Acetyl-L-serine (delta mass: 14.0152 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.076,"smiles":null,"spectrum_id":"CCMSLIB00017305033","spectrum_index":44163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 21.9669 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.032,"smiles":null,"spectrum_id":"CCMSLIB00017305036","spectrum_index":44164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 282.2572 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.339,"smiles":null,"spectrum_id":"CCMSLIB00017305039","spectrum_index":44165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 3.0535 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.187,"smiles":null,"spectrum_id":"CCMSLIB00017305041","spectrum_index":44166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 91.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.239,"smiles":null,"spectrum_id":"CCMSLIB00017305044","spectrum_index":44167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 132.0211 Da; putative annotation: N/A; putative formula: C8H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.113,"smiles":null,"spectrum_id":"CCMSLIB00017305047","spectrum_index":44168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tobramycin (delta mass: 132.0849 Da; putative annotation: N/A; putative formula: C4H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.351,"smiles":null,"spectrum_id":"CCMSLIB00017305050","spectrum_index":44169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 13.9784 Da; putative annotation: N/A; putative formula: H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.117,"smiles":null,"spectrum_id":"CCMSLIB00017305053","spectrum_index":44170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 83.0366 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.097,"smiles":null,"spectrum_id":"CCMSLIB00017305055","spectrum_index":44171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 577.9166 Da; putative annotation: N/A; putative formula: C6H20N2O17P6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.977,"smiles":null,"spectrum_id":"CCMSLIB00017305059","spectrum_index":44172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01040 Hexahydrocurcumin (delta mass: 113.0661 Da; putative annotation: N/A; putative formula: C6H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.246,"smiles":null,"spectrum_id":"CCMSLIB00017305062","spectrum_index":44173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100300 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole (delta mass: 10.9944 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.042,"smiles":null,"spectrum_id":"CCMSLIB00017305065","spectrum_index":44174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 460.2076 Da; putative annotation: N/A; putative formula: C22H40N2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.336,"smiles":null,"spectrum_id":"CCMSLIB00017305067","spectrum_index":44175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olaquindox (delta mass: 42.0058 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.104,"smiles":null,"spectrum_id":"CCMSLIB00017305070","spectrum_index":44176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 38.0287 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.183,"smiles":null,"spectrum_id":"CCMSLIB00017305073","spectrum_index":44177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 50.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.211,"smiles":null,"spectrum_id":"CCMSLIB00017305076","spectrum_index":44178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 179.1247 Da; putative annotation: N/A; putative formula: C11H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.247,"smiles":null,"spectrum_id":"CCMSLIB00017305079","spectrum_index":44179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 289.2035 Da; putative annotation: N/A; putative formula: C12H28N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.295,"smiles":null,"spectrum_id":"CCMSLIB00017305081","spectrum_index":44180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 110.084 Da; putative annotation: N/A; putative formula: C6H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.211,"smiles":null,"spectrum_id":"CCMSLIB00017305083","spectrum_index":44181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 733.4493 Da; putative annotation: N/A; putative formula: C51H59NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.52,"smiles":null,"spectrum_id":"CCMSLIB00017305086","spectrum_index":44182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 405.1965 Da; putative annotation: N/A; putative formula: C24H28N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.309,"smiles":null,"spectrum_id":"CCMSLIB00017305089","spectrum_index":44183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 27.1084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.21,"smiles":null,"spectrum_id":"CCMSLIB00017305092","spectrum_index":44184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetraethylenepentamine (delta mass: 237.1021 Da; putative annotation: N/A; putative formula: C13H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.305,"smiles":null,"spectrum_id":"CCMSLIB00017305095","spectrum_index":44185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 160.0955 Da; putative annotation: N/A; putative formula: C5H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.138,"smiles":null,"spectrum_id":"CCMSLIB00017305098","spectrum_index":44186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol, 1-[2-(2,4-dimethylphenyl)diazenyl]- (delta mass: 490.188 Da; putative annotation: N/A; putative formula: C23H38O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":767.321,"smiles":null,"spectrum_id":"CCMSLIB00017305100","spectrum_index":44187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL - 40.0 eV (delta mass: 217.0577 Da; putative annotation: N/A; putative formula: C12H13NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.149,"smiles":null,"spectrum_id":"CCMSLIB00017305102","spectrum_index":44188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 7-fluoro-3-methyl-1H-indole-2-carboxylate (delta mass: 44.0828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.16,"smiles":null,"spectrum_id":"CCMSLIB00017305105","spectrum_index":44189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 166.1242 Da; putative annotation: N/A; putative formula: C8H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.159,"smiles":null,"spectrum_id":"CCMSLIB00017305108","spectrum_index":44190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-[(diethylamino)methyl]-1H-indole-2-carboxylate (delta mass: 90.1164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.292,"smiles":null,"spectrum_id":"CCMSLIB00017305110","spectrum_index":44191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 138.0831 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.148,"smiles":null,"spectrum_id":"CCMSLIB00017305113","spectrum_index":44192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 27.0072 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.161,"smiles":null,"spectrum_id":"CCMSLIB00017305115","spectrum_index":44193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 254.1151 Da; putative annotation: N/A; putative formula: C13H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.264,"smiles":null,"spectrum_id":"CCMSLIB00017305118","spectrum_index":44194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 43.0308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017305121","spectrum_index":44195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 219.1479 Da; putative annotation: N/A; putative formula: C11H17N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.239,"smiles":null,"spectrum_id":"CCMSLIB00017305123","spectrum_index":44196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 244.1872 Da; putative annotation: N/A; putative formula: C14H30O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.289,"smiles":null,"spectrum_id":"CCMSLIB00017305126","spectrum_index":44197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 150.0471 Da; putative annotation: N/A; putative formula: C12H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.123,"smiles":null,"spectrum_id":"CCMSLIB00017305129","spectrum_index":44198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 49.9913 Da; putative annotation: N/A; putative formula: C2H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.067,"smiles":null,"spectrum_id":"CCMSLIB00017305132","spectrum_index":44199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 66.0848 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.15,"smiles":null,"spectrum_id":"CCMSLIB00017305134","spectrum_index":44200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 179.513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.678,"smiles":null,"spectrum_id":"CCMSLIB00017305136","spectrum_index":44201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 198.1043 Da; putative annotation: N/A; putative formula: C14H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017305139","spectrum_index":44202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 205.9693 Da; putative annotation: N/A; putative formula: C5H2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.029,"smiles":null,"spectrum_id":"CCMSLIB00017305142","spectrum_index":44203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 25.0309 Da; putative annotation: N/A; putative formula: C2H3NO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.112,"smiles":null,"spectrum_id":"CCMSLIB00017305145","spectrum_index":44204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 159.1625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.265,"smiles":null,"spectrum_id":"CCMSLIB00017305148","spectrum_index":44205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 85.0528 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017305150","spectrum_index":44206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 49.114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.211,"smiles":null,"spectrum_id":"CCMSLIB00017305152","spectrum_index":44207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 586.2948 Da; putative annotation: N/A; putative formula: C24H46N2O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":871.431,"smiles":null,"spectrum_id":"CCMSLIB00017305155","spectrum_index":44208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-.beta.-D-ribofuranosyl-1H-imidazole-4-carboxamide (delta mass: 341.1253 Da; putative annotation: N/A; putative formula: C13H20N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.229,"smiles":null,"spectrum_id":"CCMSLIB00017305158","spectrum_index":44209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 324.1061 Da; putative annotation: N/A; putative formula: C15H21N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.203,"smiles":null,"spectrum_id":"CCMSLIB00017305161","spectrum_index":44210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.055,"smiles":null,"spectrum_id":"CCMSLIB00017305164","spectrum_index":44211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 104.0629 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.222,"smiles":null,"spectrum_id":"CCMSLIB00017305167","spectrum_index":44212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 291.2885 Da; putative annotation: N/A; putative formula: C20H37N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.391,"smiles":null,"spectrum_id":"CCMSLIB00017305170","spectrum_index":44213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-1-(6-methoxy-1H-indol-3-yl)ethanone (delta mass: 74.0237 Da; putative annotation: N/A; putative formula: H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.071,"smiles":null,"spectrum_id":"CCMSLIB00017305172","spectrum_index":44214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 162.0559 Da; putative annotation: N/A; putative formula: C5H11N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.161,"smiles":null,"spectrum_id":"CCMSLIB00017305174","spectrum_index":44215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine D (delta mass: 161.054 Da; putative annotation: N/A; putative formula: C5H12N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.235,"smiles":null,"spectrum_id":"CCMSLIB00017305177","spectrum_index":44216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 339.1165 Da; putative annotation: N/A; putative formula: C12H21NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.187,"smiles":null,"spectrum_id":"CCMSLIB00017305180","spectrum_index":44217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 36.0217 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.176,"smiles":null,"spectrum_id":"CCMSLIB00017305183","spectrum_index":44218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Phosphogluconic acid (delta mass: 9.9825 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.014,"smiles":null,"spectrum_id":"CCMSLIB00017305186","spectrum_index":44219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 125.1301 Da; putative annotation: N/A; putative formula: C7H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.227,"smiles":null,"spectrum_id":"CCMSLIB00017305188","spectrum_index":44220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 45.0215 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.081,"smiles":null,"spectrum_id":"CCMSLIB00017305190","spectrum_index":44221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 253.0952 Da; putative annotation: N/A; putative formula: C12H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.181,"smiles":null,"spectrum_id":"CCMSLIB00017305193","spectrum_index":44222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 672.3502 Da; putative annotation: N/A; putative formula: C31H53N4O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.437,"smiles":null,"spectrum_id":"CCMSLIB00017305196","spectrum_index":44223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 432.0903 Da; putative annotation: N/A; putative formula: C17H20O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.224,"smiles":null,"spectrum_id":"CCMSLIB00017305198","spectrum_index":44224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 249.0891 Da; putative annotation: N/A; putative formula: C7H15N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.201,"smiles":null,"spectrum_id":"CCMSLIB00017305201","spectrum_index":44225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 32.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017305203","spectrum_index":44226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 441.1852 Da; putative annotation: N/A; putative formula: C20H32N3O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.256,"smiles":null,"spectrum_id":"CCMSLIB00017305206","spectrum_index":44227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 10.1181 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.123,"smiles":null,"spectrum_id":"CCMSLIB00017305209","spectrum_index":44228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 176.0314 Da; putative annotation: N/A; putative formula: C10H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.175,"smiles":null,"spectrum_id":"CCMSLIB00017305212","spectrum_index":44229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ACETAMIDE - 20.0 eV (delta mass: 71.0818 Da; putative annotation: N/A; putative formula: C3H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.168,"smiles":null,"spectrum_id":"CCMSLIB00017305215","spectrum_index":44230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 324.1212 Da; putative annotation: N/A; putative formula: C19H21N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.291,"smiles":null,"spectrum_id":"CCMSLIB00017305218","spectrum_index":44231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 289.1157 Da; putative annotation: N/A; putative formula: C12H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.213,"smiles":null,"spectrum_id":"CCMSLIB00017305220","spectrum_index":44232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 28.0317 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.118,"smiles":null,"spectrum_id":"CCMSLIB00017305223","spectrum_index":44233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 1027.2651 Da; putative annotation: N/A; putative formula: C46H53N5O16S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1532.44,"smiles":null,"spectrum_id":"CCMSLIB00017305226","spectrum_index":44234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 142.0991 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.268,"smiles":null,"spectrum_id":"CCMSLIB00017305229","spectrum_index":44235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aristolactam (delta mass: 47.0454 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.121,"smiles":null,"spectrum_id":"CCMSLIB00017305231","spectrum_index":44236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 206.1416 Da; putative annotation: N/A; putative formula: C12H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.295,"smiles":null,"spectrum_id":"CCMSLIB00017305234","spectrum_index":44237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 183.087 Da; putative annotation: N/A; putative formula: C5H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.173,"smiles":null,"spectrum_id":"CCMSLIB00017305237","spectrum_index":44238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 93.043 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.167,"smiles":null,"spectrum_id":"CCMSLIB00017305240","spectrum_index":44239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltryptophan (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.118,"smiles":null,"spectrum_id":"CCMSLIB00017305242","spectrum_index":44240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetylcitrulline (delta mass: 73.0164 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.13,"smiles":null,"spectrum_id":"CCMSLIB00017305245","spectrum_index":44241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Hydroxy-L-proline (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.066,"smiles":null,"spectrum_id":"CCMSLIB00017305247","spectrum_index":44242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 927.3088 Da; putative annotation: N/A; putative formula: C46H50N5O14P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1270.43,"smiles":null,"spectrum_id":"CCMSLIB00017305250","spectrum_index":44243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 778.4504 Da; putative annotation: N/A; putative formula: C42H66O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":985.537,"smiles":null,"spectrum_id":"CCMSLIB00017305253","spectrum_index":44244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 209.1774 Da; putative annotation: N/A; putative formula: C13H23NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.248,"smiles":null,"spectrum_id":"CCMSLIB00017305255","spectrum_index":44245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aspartame (delta mass: 85.0891 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.218,"smiles":null,"spectrum_id":"CCMSLIB00017305258","spectrum_index":44246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 339.1087 Da; putative annotation: N/A; putative formula: C12H22NO8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":844.285,"smiles":null,"spectrum_id":"CCMSLIB00017305260","spectrum_index":44247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 42.0467 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.221,"smiles":null,"spectrum_id":"CCMSLIB00017305262","spectrum_index":44248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 58.04 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.152,"smiles":null,"spectrum_id":"CCMSLIB00017305265","spectrum_index":44249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 104.0614 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.137,"smiles":null,"spectrum_id":"CCMSLIB00017305268","spectrum_index":44250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 901.0628 Da; putative annotation: N/A; putative formula: C39H35NO14S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1123.16,"smiles":null,"spectrum_id":"CCMSLIB00017305270","spectrum_index":44251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.091,"smiles":null,"spectrum_id":"CCMSLIB00017305273","spectrum_index":44252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 118.0365 Da; putative annotation: N/A; putative formula: C5H11O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.122,"smiles":null,"spectrum_id":"CCMSLIB00017305276","spectrum_index":44253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 74.1083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.174,"smiles":null,"spectrum_id":"CCMSLIB00017305278","spectrum_index":44254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 583.1473 Da; putative annotation: N/A; putative formula: C24H29N3O12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.27,"smiles":null,"spectrum_id":"CCMSLIB00017305281","spectrum_index":44255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 99.0471 Da; putative annotation: N/A; putative formula: C8H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.123,"smiles":null,"spectrum_id":"CCMSLIB00017305284","spectrum_index":44256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 205.1316 Da; putative annotation: N/A; putative formula: C9H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.202,"smiles":null,"spectrum_id":"CCMSLIB00017305287","spectrum_index":44257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 106.0416 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017305289","spectrum_index":44258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.279,"smiles":null,"spectrum_id":"CCMSLIB00017305292","spectrum_index":44259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 226.1425 Da; putative annotation: N/A; putative formula: C10H18N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.217,"smiles":null,"spectrum_id":"CCMSLIB00017305295","spectrum_index":44260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrindole (delta mass: 467.2619 Da; putative annotation: N/A; putative formula: C25H42NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.464,"smiles":null,"spectrum_id":"CCMSLIB00017305297","spectrum_index":44261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 555.215 Da; putative annotation: N/A; putative formula: C26H39NO8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.286,"smiles":null,"spectrum_id":"CCMSLIB00017305300","spectrum_index":44262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 249.1368 Da; putative annotation: N/A; putative formula: C14H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.234,"smiles":null,"spectrum_id":"CCMSLIB00017305303","spectrum_index":44263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 296.8267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.902,"smiles":null,"spectrum_id":"CCMSLIB00017305305","spectrum_index":44264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 293.8152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.875,"smiles":null,"spectrum_id":"CCMSLIB00017305308","spectrum_index":44265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 32.0992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.243,"smiles":null,"spectrum_id":"CCMSLIB00017305310","spectrum_index":44266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 90.0815 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.152,"smiles":null,"spectrum_id":"CCMSLIB00017305313","spectrum_index":44267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 18.3714 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.5,"smiles":null,"spectrum_id":"CCMSLIB00017305316","spectrum_index":44268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101905 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 11.0141 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.1,"smiles":null,"spectrum_id":"CCMSLIB00017305318","spectrum_index":44269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 129.0419 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.212,"smiles":null,"spectrum_id":"CCMSLIB00017305321","spectrum_index":44270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 70.9751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.134,"smiles":null,"spectrum_id":"CCMSLIB00017305324","spectrum_index":44271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 176.1156 Da; putative annotation: N/A; putative formula: C7H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.264,"smiles":null,"spectrum_id":"CCMSLIB00017305327","spectrum_index":44272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 33.0602 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.136,"smiles":null,"spectrum_id":"CCMSLIB00017305329","spectrum_index":44273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 407.1369 Da; putative annotation: N/A; putative formula: C23H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.239,"smiles":null,"spectrum_id":"CCMSLIB00017305332","spectrum_index":44274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxy-3,5-dimethoxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 64.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.16,"smiles":null,"spectrum_id":"CCMSLIB00017305335","spectrum_index":44275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 574.0802 Da; putative annotation: N/A; putative formula: C20H18N10O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.14,"smiles":null,"spectrum_id":"CCMSLIB00017305338","spectrum_index":44276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 249.0846 Da; putative annotation: (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol; putative formula: C10H11N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.166,"smiles":null,"spectrum_id":"CCMSLIB00017305341","spectrum_index":44277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 268.0375 Da; putative annotation: Citreorosein; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.098,"smiles":null,"spectrum_id":"CCMSLIB00017305343","spectrum_index":44278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 162.0525 Da; putative annotation: theobromine; putative formula: C7H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.15,"smiles":null,"spectrum_id":"CCMSLIB00017305346","spectrum_index":44279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(4-Chlorophenyl)-5-nitro-2-piperidinone (delta mass: 264.1109 Da; putative annotation: 2-(4-tert-Butylbenzoyl)benzoic acid; putative formula: C18H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.164,"smiles":null,"spectrum_id":"CCMSLIB00017305349","spectrum_index":44280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 118.0418 Da; putative annotation: PHENYLACETIC ACID; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017305352","spectrum_index":44281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 174.0679 Da; putative annotation: Dehydrozingerone; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.144,"smiles":null,"spectrum_id":"CCMSLIB00017305354","spectrum_index":44282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 498.3194 Da; putative annotation: 3-(.beta.-D-Galactopyranosyloxy)-2-hydroxypropyl (9Z,12Z)-octadeca-9,12-dienoate; putative formula: C27H46O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.38,"smiles":null,"spectrum_id":"CCMSLIB00017305358","spectrum_index":44283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 598.2788 Da; putative annotation: N/A; putative formula: C34H46O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.37,"smiles":null,"spectrum_id":"CCMSLIB00017305360","spectrum_index":44284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 45.0341 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.219,"smiles":null,"spectrum_id":"CCMSLIB00017305363","spectrum_index":44285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 119.0373 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.161,"smiles":null,"spectrum_id":"CCMSLIB00017305366","spectrum_index":44286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 271.2149 Da; putative annotation: N/A; putative formula: C15H29NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.252,"smiles":null,"spectrum_id":"CCMSLIB00017305368","spectrum_index":44287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 450.1162 Da; putative annotation: N/A; putative formula: C21H22O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.228,"smiles":null,"spectrum_id":"CCMSLIB00017305371","spectrum_index":44288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 619.1532 Da; putative annotation: N/A; putative formula: C26H25N11O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":958.276,"smiles":null,"spectrum_id":"CCMSLIB00017305374","spectrum_index":44289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380297-01_C12H17NO4_1,3-Dioxolo[4,5-c]pyridin-4(5H)-one, 2-(1-hydroxy-3-methylbutyl)-6-methyl- (delta mass: 239.1158 Da; putative annotation: N/A; putative formula: C12H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.239,"smiles":null,"spectrum_id":"CCMSLIB00017305376","spectrum_index":44290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 190.2299 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.316,"smiles":null,"spectrum_id":"CCMSLIB00017305379","spectrum_index":44291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 150.0691 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.203,"smiles":null,"spectrum_id":"CCMSLIB00017305382","spectrum_index":44292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 24.9992 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.122,"smiles":null,"spectrum_id":"CCMSLIB00017305384","spectrum_index":44293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Crotonoside (delta mass: 18.0011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.1,"smiles":null,"spectrum_id":"CCMSLIB00017305387","spectrum_index":44294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 46.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.122,"smiles":null,"spectrum_id":"CCMSLIB00017305390","spectrum_index":44295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of vincamine (delta mass: 62.9698 Da; putative annotation: N/A; putative formula: H2NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.171,"smiles":null,"spectrum_id":"CCMSLIB00017305392","spectrum_index":44296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 64.0313 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.071,"smiles":null,"spectrum_id":"CCMSLIB00017305395","spectrum_index":44297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 324.2941 Da; putative annotation: N/A; putative formula: C21H41P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.329,"smiles":null,"spectrum_id":"CCMSLIB00017305398","spectrum_index":44298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 72.021 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.129,"smiles":null,"spectrum_id":"CCMSLIB00017305401","spectrum_index":44299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 479.2917 Da; putative annotation: N/A; putative formula: C23H45NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":984.468,"smiles":null,"spectrum_id":"CCMSLIB00017305402","spectrum_index":44300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 449.195 Da; putative annotation: N/A; putative formula: C25H27N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.318,"smiles":null,"spectrum_id":"CCMSLIB00017305405","spectrum_index":44301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-2-carbaldehyde (delta mass: 49.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.108,"smiles":null,"spectrum_id":"CCMSLIB00017305408","spectrum_index":44302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 84.0461 Da; putative annotation: N/A; putative formula: C2H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017305411","spectrum_index":44303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 19.004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.117,"smiles":null,"spectrum_id":"CCMSLIB00017305413","spectrum_index":44304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 250.0064 Da; putative annotation: N/A; putative formula: C8H11O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.098,"smiles":null,"spectrum_id":"CCMSLIB00017305416","spectrum_index":44305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 738.4458 Da; putative annotation: N/A; putative formula: C42H62N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.542,"smiles":null,"spectrum_id":"CCMSLIB00017305419","spectrum_index":44306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 515.4538 Da; putative annotation: N/A; putative formula: C27H53N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.524,"smiles":null,"spectrum_id":"CCMSLIB00017305422","spectrum_index":44307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 75.0682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.113,"smiles":null,"spectrum_id":"CCMSLIB00017305424","spectrum_index":44308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 809.4229 Da; putative annotation: N/A; putative formula: C40H64N3O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.483,"smiles":null,"spectrum_id":"CCMSLIB00017305427","spectrum_index":44309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 87.0491 Da; putative annotation: N/A; putative formula: C4H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.135,"smiles":null,"spectrum_id":"CCMSLIB00017305430","spectrum_index":44310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of adrenaline - 30.0 eV (delta mass: 146.0362 Da; putative annotation: N/A; putative formula: C3H7N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.133,"smiles":null,"spectrum_id":"CCMSLIB00017305433","spectrum_index":44311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 19.0119 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.14,"smiles":null,"spectrum_id":"CCMSLIB00017305435","spectrum_index":44312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 401.0824 Da; putative annotation: N/A; putative formula: C16H16N7O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.211,"smiles":null,"spectrum_id":"CCMSLIB00017305438","spectrum_index":44313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 185.0836 Da; putative annotation: N/A; putative formula: C12H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.159,"smiles":null,"spectrum_id":"CCMSLIB00017305441","spectrum_index":44314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 8.0894 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.187,"smiles":null,"spectrum_id":"CCMSLIB00017305443","spectrum_index":44315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 227.1925 Da; putative annotation: N/A; putative formula: C12H26N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.284,"smiles":null,"spectrum_id":"CCMSLIB00017305446","spectrum_index":44316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 108.0211 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.092,"smiles":null,"spectrum_id":"CCMSLIB00017305448","spectrum_index":44317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 48.0367 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.279,"smiles":null,"spectrum_id":"CCMSLIB00017305451","spectrum_index":44318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 300.2276 Da; putative annotation: N/A; putative formula: C21H32O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.329,"smiles":null,"spectrum_id":"CCMSLIB00017305454","spectrum_index":44319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 101.0478 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017305456","spectrum_index":44320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 170.0351 Da; putative annotation: N/A; putative formula: C5H7N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.116,"smiles":null,"spectrum_id":"CCMSLIB00017305458","spectrum_index":44321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 492.4012 Da; putative annotation: N/A; putative formula: C24H48N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.473,"smiles":null,"spectrum_id":"CCMSLIB00017305461","spectrum_index":44322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 938.5939 Da; putative annotation: N/A; putative formula: C47H82N6O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1076.69,"smiles":null,"spectrum_id":"CCMSLIB00017305464","spectrum_index":44323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 112.0675 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017305467","spectrum_index":44324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 120.0576 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.155,"smiles":null,"spectrum_id":"CCMSLIB00017305470","spectrum_index":44325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 173.0511 Da; putative annotation: N/A; putative formula: C7H11NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.169,"smiles":null,"spectrum_id":"CCMSLIB00017305472","spectrum_index":44326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 60.0883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.16,"smiles":null,"spectrum_id":"CCMSLIB00017305475","spectrum_index":44327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 172.1585 Da; putative annotation: N/A; putative formula: C9H20N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.286,"smiles":null,"spectrum_id":"CCMSLIB00017305477","spectrum_index":44328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tryptophol (delta mass: 27.9487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.04,"smiles":null,"spectrum_id":"CCMSLIB00017305480","spectrum_index":44329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 193.0643 Da; putative annotation: N/A; putative formula: C12H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.192,"smiles":null,"spectrum_id":"CCMSLIB00017305483","spectrum_index":44330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 126.9173 Da; putative annotation: N/A; putative formula: H2NO-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.998,"smiles":null,"spectrum_id":"CCMSLIB00017305486","spectrum_index":44331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 14.9838 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.08,"smiles":null,"spectrum_id":"CCMSLIB00017305488","spectrum_index":44332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 208.9535 Da; putative annotation: N/A; putative formula: C7H3N3O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.05,"smiles":null,"spectrum_id":"CCMSLIB00017305490","spectrum_index":44333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 30.0 eV (delta mass: 102.0468 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.159,"smiles":null,"spectrum_id":"CCMSLIB00017305493","spectrum_index":44334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 26.0649 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.151,"smiles":null,"spectrum_id":"CCMSLIB00017305496","spectrum_index":44335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 201.9199 Da; putative annotation: N/A; putative formula: C2H6N2O-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.0,"smiles":null,"spectrum_id":"CCMSLIB00017305499","spectrum_index":44336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 25.0157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.087,"smiles":null,"spectrum_id":"CCMSLIB00017305500","spectrum_index":44337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 90.0839 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.326,"smiles":null,"spectrum_id":"CCMSLIB00017305503","spectrum_index":44338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 147.0565 Da; putative annotation: N/A; putative formula: C4H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.233,"smiles":null,"spectrum_id":"CCMSLIB00017305506","spectrum_index":44339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 504.3535 Da; putative annotation: N/A; putative formula: C25H44N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.466,"smiles":null,"spectrum_id":"CCMSLIB00017305509","spectrum_index":44340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carboxylic acid, ethyl ester (delta mass: 125.0516 Da; putative annotation: N/A; putative formula: C5H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.138,"smiles":null,"spectrum_id":"CCMSLIB00017305512","spectrum_index":44341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 98.1469 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.317,"smiles":null,"spectrum_id":"CCMSLIB00017305514","spectrum_index":44342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 116.07 Da; putative annotation: N/A; putative formula: C3H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.173,"smiles":null,"spectrum_id":"CCMSLIB00017305516","spectrum_index":44343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130086 (delta mass: 35.0654 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.236,"smiles":null,"spectrum_id":"CCMSLIB00017305519","spectrum_index":44344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 226.2082 Da; putative annotation: N/A; putative formula: C18H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.279,"smiles":null,"spectrum_id":"CCMSLIB00017305522","spectrum_index":44345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 226.0993 Da; putative annotation: N/A; putative formula: C15H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017305525","spectrum_index":44346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.207,"smiles":null,"spectrum_id":"CCMSLIB00017305528","spectrum_index":44347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 317.1461 Da; putative annotation: N/A; putative formula: C11H15N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.258,"smiles":null,"spectrum_id":"CCMSLIB00017305529","spectrum_index":44348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 38.0005 Da; putative annotation: N/A; putative formula: H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.097,"smiles":null,"spectrum_id":"CCMSLIB00017305532","spectrum_index":44349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 103.0074 Da; putative annotation: N/A; putative formula: C6HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.134,"smiles":null,"spectrum_id":"CCMSLIB00017305535","spectrum_index":44350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 86.0254 Da; putative annotation: N/A; putative formula: C6H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017305538","spectrum_index":44351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 157.0378 Da; putative annotation: N/A; putative formula: C6H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.129,"smiles":null,"spectrum_id":"CCMSLIB00017305540","spectrum_index":44352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 120.0402 Da; putative annotation: N/A; putative formula: C8H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.116,"smiles":null,"spectrum_id":"CCMSLIB00017305543","spectrum_index":44353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.175,"smiles":null,"spectrum_id":"CCMSLIB00017305546","spectrum_index":44354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01041 Hexahydrocurcumin (delta mass: 145.058 Da; putative annotation: N/A; putative formula: C6H13NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.238,"smiles":null,"spectrum_id":"CCMSLIB00017305549","spectrum_index":44355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 63.9148 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.98,"smiles":null,"spectrum_id":"CCMSLIB00017305552","spectrum_index":44356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-5-(3,3-dimethylguanidine-1-yl)pentanoic acid (delta mass: 60.0314 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.15,"smiles":null,"spectrum_id":"CCMSLIB00017305554","spectrum_index":44357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 222.2164 Da; putative annotation: N/A; putative formula: C13H26N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.386,"smiles":null,"spectrum_id":"CCMSLIB00017305557","spectrum_index":44358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 190.0264 Da; putative annotation: N/A; putative formula: C10H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.086,"smiles":null,"spectrum_id":"CCMSLIB00017305560","spectrum_index":44359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 259.1651 Da; putative annotation: N/A; putative formula: C10H21N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.262,"smiles":null,"spectrum_id":"CCMSLIB00017305563","spectrum_index":44360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 131.0976 Da; putative annotation: N/A; putative formula: C5H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.157,"smiles":null,"spectrum_id":"CCMSLIB00017305565","spectrum_index":44361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 117.0964 Da; putative annotation: N/A; putative formula: C9H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.139,"smiles":null,"spectrum_id":"CCMSLIB00017305568","spectrum_index":44362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 86.0588 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.16,"smiles":null,"spectrum_id":"CCMSLIB00017305571","spectrum_index":44363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethylselegiline (delta mass: 202.1579 Da; putative annotation: N/A; putative formula: C12H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.286,"smiles":null,"spectrum_id":"CCMSLIB00017305574","spectrum_index":44364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 57.9711 Da; putative annotation: N/A; putative formula: H-1N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.125,"smiles":null,"spectrum_id":"CCMSLIB00017305577","spectrum_index":44365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 95.037 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.15,"smiles":null,"spectrum_id":"CCMSLIB00017305580","spectrum_index":44366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 156.1203 Da; putative annotation: N/A; putative formula: C8H17N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.217,"smiles":null,"spectrum_id":"CCMSLIB00017305583","spectrum_index":44367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 315.09 Da; putative annotation: N/A; putative formula: C12H19N3O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.187,"smiles":null,"spectrum_id":"CCMSLIB00017305585","spectrum_index":44368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 125.0477 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.134,"smiles":null,"spectrum_id":"CCMSLIB00017305588","spectrum_index":44369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(4-Chlorophenyl)-5-nitro-2-piperidinone (delta mass: 264.1069 Da; putative annotation: N/A; putative formula: C8H16N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.16,"smiles":null,"spectrum_id":"CCMSLIB00017305591","spectrum_index":44370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 86.0613 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.121,"smiles":null,"spectrum_id":"CCMSLIB00017305594","spectrum_index":44371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 225.2857 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.445,"smiles":null,"spectrum_id":"CCMSLIB00017305597","spectrum_index":44372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 418.0738 Da; putative annotation: N/A; putative formula: C10H19N4O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":787.207,"smiles":null,"spectrum_id":"CCMSLIB00017305600","spectrum_index":44373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[4-(2-Chlorophenyl)-1H-pyrazol-1-yl]piperidine (delta mass: 63.0498 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.16,"smiles":null,"spectrum_id":"CCMSLIB00017305603","spectrum_index":44374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 49.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.092,"smiles":null,"spectrum_id":"CCMSLIB00017305605","spectrum_index":44375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 66.0385 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.203,"smiles":null,"spectrum_id":"CCMSLIB00017305608","spectrum_index":44376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 278.2251 Da; putative annotation: N/A; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.307,"smiles":null,"spectrum_id":"CCMSLIB00017305610","spectrum_index":44377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 63.0695 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.224,"smiles":null,"spectrum_id":"CCMSLIB00017305613","spectrum_index":44378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 103.2003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.222,"smiles":null,"spectrum_id":"CCMSLIB00017305615","spectrum_index":44379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6'-Sialyl-N-acetyllactosamine (delta mass: 418.2357 Da; putative annotation: N/A; putative formula: C24H34O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1093.48,"smiles":null,"spectrum_id":"CCMSLIB00017305618","spectrum_index":44380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 259.0946 Da; putative annotation: N/A; putative formula: C15H18NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.181,"smiles":null,"spectrum_id":"CCMSLIB00017305620","spectrum_index":44381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 140.0469 Da; putative annotation: N/A; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.112,"smiles":null,"spectrum_id":"CCMSLIB00017305623","spectrum_index":44382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 108.0484 Da; putative annotation: N/A; putative formula: C7H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.15,"smiles":null,"spectrum_id":"CCMSLIB00017305626","spectrum_index":44383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 43.9898 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.112,"smiles":null,"spectrum_id":"CCMSLIB00017305629","spectrum_index":44384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 56.0764 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.147,"smiles":null,"spectrum_id":"CCMSLIB00017305631","spectrum_index":44385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Keto-L-gulonic acid (delta mass: 135.1032 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.153,"smiles":null,"spectrum_id":"CCMSLIB00017305634","spectrum_index":44386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 395.1401 Da; putative annotation: N/A; putative formula: C21H22N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.221,"smiles":null,"spectrum_id":"CCMSLIB00017305637","spectrum_index":44387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 138.0684 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.154,"smiles":null,"spectrum_id":"CCMSLIB00017305639","spectrum_index":44388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 36.9953 Da; putative annotation: N/A; putative formula: C2H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.076,"smiles":null,"spectrum_id":"CCMSLIB00017305642","spectrum_index":44389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chymostatin B (delta mass: 32.0227 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.326,"smiles":null,"spectrum_id":"CCMSLIB00017305645","spectrum_index":44390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 84.0355 Da; putative annotation: N/A; putative formula: C8H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.191,"smiles":null,"spectrum_id":"CCMSLIB00017305648","spectrum_index":44391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 321.9793 Da; putative annotation: D-myo-Inositol-1,5-diphosphate; putative formula: C6H12O11P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.016,"smiles":null,"spectrum_id":"CCMSLIB00017305650","spectrum_index":44392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ACETYL ARGININE - 40.0 eV (delta mass: 97.0531 Da; putative annotation: PROLINE; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.183,"smiles":null,"spectrum_id":"CCMSLIB00017305653","spectrum_index":44393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 20.0 eV (delta mass: 242.0198 Da; putative annotation: D-Glucose 6-phosphate; putative formula: C6H11O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.057,"smiles":null,"spectrum_id":"CCMSLIB00017305656","spectrum_index":44394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 183.0897 Da; putative annotation: N2-Benzyl-1,3,5-triazine-2,4-diamine; putative formula: C10H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.165,"smiles":null,"spectrum_id":"CCMSLIB00017305659","spectrum_index":44395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Leu-Pro from NIST14 (delta mass: 113.0846 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.239,"smiles":null,"spectrum_id":"CCMSLIB00017305662","spectrum_index":44396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 98.0736 Da; putative annotation: 4-Methylvaleric acid; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.217,"smiles":null,"spectrum_id":"CCMSLIB00017305664","spectrum_index":44397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 303.0971 Da; putative annotation: N/A; putative formula: C13H13N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.194,"smiles":null,"spectrum_id":"CCMSLIB00017305666","spectrum_index":44398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 353.2229 Da; putative annotation: N/A; putative formula: C18H32N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.393,"smiles":null,"spectrum_id":"CCMSLIB00017305669","spectrum_index":44399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 252.1396 Da; putative annotation: N/A; putative formula: C13H21N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.21,"smiles":null,"spectrum_id":"CCMSLIB00017305672","spectrum_index":44400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 178.1175 Da; putative annotation: N/A; putative formula: C12H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.282,"smiles":null,"spectrum_id":"CCMSLIB00017305675","spectrum_index":44401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amlexanox (delta mass: 172.0805 Da; putative annotation: N/A; putative formula: C12H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.183,"smiles":null,"spectrum_id":"CCMSLIB00017305677","spectrum_index":44402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 4.9975 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.031,"smiles":null,"spectrum_id":"CCMSLIB00017305679","spectrum_index":44403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MELIBIOSE (delta mass: 140.0623 Da; putative annotation: N/A; putative formula: C11H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.186,"smiles":null,"spectrum_id":"CCMSLIB00017305682","spectrum_index":44404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 565.2763 Da; putative annotation: N/A; putative formula: C35H39N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.388,"smiles":null,"spectrum_id":"CCMSLIB00017305685","spectrum_index":44405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 249.1102 Da; putative annotation: N/A; putative formula: C6H16N7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.212,"smiles":null,"spectrum_id":"CCMSLIB00017305688","spectrum_index":44406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300087 Kopsinoline (delta mass: 429.2913 Da; putative annotation: N/A; putative formula: C23H43NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.493,"smiles":null,"spectrum_id":"CCMSLIB00017305691","spectrum_index":44407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 133.1103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.213,"smiles":null,"spectrum_id":"CCMSLIB00017305693","spectrum_index":44408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxaldehyde (delta mass: 8.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.085,"smiles":null,"spectrum_id":"CCMSLIB00017305695","spectrum_index":44409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 52.0306 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.106,"smiles":null,"spectrum_id":"CCMSLIB00017305698","spectrum_index":44410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 178.1204 Da; putative annotation: N/A; putative formula: C9H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.295,"smiles":null,"spectrum_id":"CCMSLIB00017305701","spectrum_index":44411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 101.0627 Da; putative annotation: N/A; putative formula: C8H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.138,"smiles":null,"spectrum_id":"CCMSLIB00017305704","spectrum_index":44412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 205.1092 Da; putative annotation: N/A; putative formula: C12H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.188,"smiles":null,"spectrum_id":"CCMSLIB00017305707","spectrum_index":44413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Kynurenine (delta mass: 186.0984 Da; putative annotation: N/A; putative formula: C4H10N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.19,"smiles":null,"spectrum_id":"CCMSLIB00017305709","spectrum_index":44414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 76.0377 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.117,"smiles":null,"spectrum_id":"CCMSLIB00017305711","spectrum_index":44415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyltryptamine (delta mass: 105.0673 Da; putative annotation: N/A; putative formula: C6H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.206,"smiles":null,"spectrum_id":"CCMSLIB00017305714","spectrum_index":44416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCURONOLACTONE (delta mass: 51.9895 Da; putative annotation: N/A; putative formula: C3HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.039,"smiles":null,"spectrum_id":"CCMSLIB00017305717","spectrum_index":44417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-ylmethylene)malononitrile (delta mass: 9.997 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.068,"smiles":null,"spectrum_id":"CCMSLIB00017305720","spectrum_index":44418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 70.0854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.192,"smiles":null,"spectrum_id":"CCMSLIB00017305722","spectrum_index":44419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 502.2273 Da; putative annotation: N/A; putative formula: C31H35O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.325,"smiles":null,"spectrum_id":"CCMSLIB00017305725","spectrum_index":44420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 281.252 Da; putative annotation: N/A; putative formula: C21H31NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.338,"smiles":null,"spectrum_id":"CCMSLIB00017305728","spectrum_index":44421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 689.2727 Da; putative annotation: N/A; putative formula: C34H40N7O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":896.359,"smiles":null,"spectrum_id":"CCMSLIB00017305731","spectrum_index":44422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethoxy-1-propanol (delta mass: 29.0 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.091,"smiles":null,"spectrum_id":"CCMSLIB00017305732","spectrum_index":44423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-phenylalanine (L-DOPA); AIF; CE0; MS2Dec (delta mass: 175.1577 Da; putative annotation: N/A; putative formula: C5H17N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.234,"smiles":null,"spectrum_id":"CCMSLIB00017305735","spectrum_index":44424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 71.1518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.233,"smiles":null,"spectrum_id":"CCMSLIB00017305738","spectrum_index":44425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 104.0645 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.151,"smiles":null,"spectrum_id":"CCMSLIB00017305741","spectrum_index":44426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 52.9907 Da; putative annotation: N/A; putative formula: C2H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.093,"smiles":null,"spectrum_id":"CCMSLIB00017305744","spectrum_index":44427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA270101 10,11-trans-Dihydroxy-10,11-dihydrocarbamazepine|(5S,6S)-5,6-bis(oxidanyl)-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 60.1769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.285,"smiles":null,"spectrum_id":"CCMSLIB00017305746","spectrum_index":44428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thiodiglycol (delta mass: 82.0957 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.143,"smiles":null,"spectrum_id":"CCMSLIB00017305748","spectrum_index":44429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 168.0417 Da; putative annotation: N/A; putative formula: C2H9N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.165,"smiles":null,"spectrum_id":"CCMSLIB00017305751","spectrum_index":44430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 66.0832 Da; putative annotation: N/A; putative formula: C6H10O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017305754","spectrum_index":44431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-hydroxyquinoline (delta mass: 70.9965 Da; putative annotation: N/A; putative formula: CHN3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.057,"smiles":null,"spectrum_id":"CCMSLIB00017305757","spectrum_index":44432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 439.2117 Da; putative annotation: N/A; putative formula: C25H33N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.308,"smiles":null,"spectrum_id":"CCMSLIB00017305760","spectrum_index":44433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 278.165 Da; putative annotation: N/A; putative formula: C13H27O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.277,"smiles":null,"spectrum_id":"CCMSLIB00017305763","spectrum_index":44434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 124.0675 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.138,"smiles":null,"spectrum_id":"CCMSLIB00017305766","spectrum_index":44435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 45.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.114,"smiles":null,"spectrum_id":"CCMSLIB00017305769","spectrum_index":44436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 72.9994 Da; putative annotation: N/A; putative formula: C2H3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.081,"smiles":null,"spectrum_id":"CCMSLIB00017305770","spectrum_index":44437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 28.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.154,"smiles":null,"spectrum_id":"CCMSLIB00017305773","spectrum_index":44438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 93.0426 Da; putative annotation: N/A; putative formula: C3H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017305776","spectrum_index":44439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 55.0305 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.132,"smiles":null,"spectrum_id":"CCMSLIB00017305779","spectrum_index":44440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 69.1628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.243,"smiles":null,"spectrum_id":"CCMSLIB00017305781","spectrum_index":44441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 119.0664 Da; putative annotation: N/A; putative formula: C3H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.106,"smiles":null,"spectrum_id":"CCMSLIB00017305784","spectrum_index":44442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 86.048 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.177,"smiles":null,"spectrum_id":"CCMSLIB00017305787","spectrum_index":44443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 104.047 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017305790","spectrum_index":44444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 147.5956 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.651,"smiles":null,"spectrum_id":"CCMSLIB00017305793","spectrum_index":44445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Difluoro-1H-indole-2-carboxylic acid (delta mass: 27.9905 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.027,"smiles":null,"spectrum_id":"CCMSLIB00017305796","spectrum_index":44446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 563.367 Da; putative annotation: N/A; putative formula: C28H53NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.432,"smiles":null,"spectrum_id":"CCMSLIB00017305798","spectrum_index":44447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 103.0998 Da; putative annotation: N/A; putative formula: CH9N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.202,"smiles":null,"spectrum_id":"CCMSLIB00017305801","spectrum_index":44448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 278.142 Da; putative annotation: N/A; putative formula: C18H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.244,"smiles":null,"spectrum_id":"CCMSLIB00017305804","spectrum_index":44449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 42.1041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.159,"smiles":null,"spectrum_id":"CCMSLIB00017305806","spectrum_index":44450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 164.0941 Da; putative annotation: N/A; putative formula: C9H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.165,"smiles":null,"spectrum_id":"CCMSLIB00017305809","spectrum_index":44451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 159.0866 Da; putative annotation: N/A; putative formula: C3H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.167,"smiles":null,"spectrum_id":"CCMSLIB00017305812","spectrum_index":44452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 152.1541 Da; putative annotation: N/A; putative formula: C11H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.241,"smiles":null,"spectrum_id":"CCMSLIB00017305815","spectrum_index":44453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 488.728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.814,"smiles":null,"spectrum_id":"CCMSLIB00017305818","spectrum_index":44454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 11.0185 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.121,"smiles":null,"spectrum_id":"CCMSLIB00017305819","spectrum_index":44455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 16.9789 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017305822","spectrum_index":44456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 165.1001 Da; putative annotation: N/A; putative formula: C7H11N5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.165,"smiles":null,"spectrum_id":"CCMSLIB00017305825","spectrum_index":44457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 226.9581 Da; putative annotation: N/A; putative formula: C4H9NO2P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.076,"smiles":null,"spectrum_id":"CCMSLIB00017305828","spectrum_index":44458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 182.0693 Da; putative annotation: N/A; putative formula: C8H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.129,"smiles":null,"spectrum_id":"CCMSLIB00017305830","spectrum_index":44459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 171.0328 Da; putative annotation: N/A; putative formula: C3H5N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.119,"smiles":null,"spectrum_id":"CCMSLIB00017305834","spectrum_index":44460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucrose (delta mass: 557.0808 Da; putative annotation: N/A; putative formula: C18H27N3O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.204,"smiles":null,"spectrum_id":"CCMSLIB00017305835","spectrum_index":44461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 42.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.238,"smiles":null,"spectrum_id":"CCMSLIB00017305838","spectrum_index":44462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 40.0404 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.081,"smiles":null,"spectrum_id":"CCMSLIB00017305841","spectrum_index":44463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 136.0496 Da; putative annotation: N/A; putative formula: C4H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.12,"smiles":null,"spectrum_id":"CCMSLIB00017305844","spectrum_index":44464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 86.0716 Da; putative annotation: N/A; putative formula: CH6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.18,"smiles":null,"spectrum_id":"CCMSLIB00017305846","spectrum_index":44465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 34.0207 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.076,"smiles":null,"spectrum_id":"CCMSLIB00017305850","spectrum_index":44466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 108.0211 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.15,"smiles":null,"spectrum_id":"CCMSLIB00017305851","spectrum_index":44467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 213.2495 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.398,"smiles":null,"spectrum_id":"CCMSLIB00017305854","spectrum_index":44468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alosetron??monohydrochloride (delta mass: 80.0326 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.188,"smiles":null,"spectrum_id":"CCMSLIB00017305857","spectrum_index":44469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 626.1491 Da; putative annotation: N/A; putative formula: C28H34O12S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":934.335,"smiles":null,"spectrum_id":"CCMSLIB00017305860","spectrum_index":44470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 178.0218 Da; putative annotation: N/A; putative formula: C6H11O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.181,"smiles":null,"spectrum_id":"CCMSLIB00017305863","spectrum_index":44471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 314.2257 Da; putative annotation: N/A; putative formula: C14H30N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.349,"smiles":null,"spectrum_id":"CCMSLIB00017305864","spectrum_index":44472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 571.2476 Da; putative annotation: N/A; putative formula: C23H41NO15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.334,"smiles":null,"spectrum_id":"CCMSLIB00017305867","spectrum_index":44473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 83.0371 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.16,"smiles":null,"spectrum_id":"CCMSLIB00017305870","spectrum_index":44474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 43.9895 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.081,"smiles":null,"spectrum_id":"CCMSLIB00017305873","spectrum_index":44475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 193.0589 Da; putative annotation: N/A; putative formula: C6H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.129,"smiles":null,"spectrum_id":"CCMSLIB00017305876","spectrum_index":44476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(Cyclopropylmethyl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide (delta mass: 115.0735 Da; putative annotation: N/A; putative formula: C4H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.26,"smiles":null,"spectrum_id":"CCMSLIB00017305879","spectrum_index":44477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Octopamine from NIST14 (delta mass: 93.0654 Da; putative annotation: N/A; putative formula: C5H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.152,"smiles":null,"spectrum_id":"CCMSLIB00017305881","spectrum_index":44478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 59.0281 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.162,"smiles":null,"spectrum_id":"CCMSLIB00017305883","spectrum_index":44479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 72.04 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.126,"smiles":null,"spectrum_id":"CCMSLIB00017305886","spectrum_index":44480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 870.7898 Da; putative annotation: N/A; putative formula: C53H106O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1538.02,"smiles":null,"spectrum_id":"CCMSLIB00017305889","spectrum_index":44481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 243.0944 Da; putative annotation: N/A; putative formula: C12H13N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.196,"smiles":null,"spectrum_id":"CCMSLIB00017305892","spectrum_index":44482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 144.1504 Da; putative annotation: N/A; putative formula: C5H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.304,"smiles":null,"spectrum_id":"CCMSLIB00017305895","spectrum_index":44483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 761.2499 Da; putative annotation: N/A; putative formula: C53H35N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1071.36,"smiles":null,"spectrum_id":"CCMSLIB00017305897","spectrum_index":44484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GALACTOSAMINE (delta mass: 9.0048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.091,"smiles":null,"spectrum_id":"CCMSLIB00017305900","spectrum_index":44485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 301.116 Da; putative annotation: N/A; putative formula: C13H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.187,"smiles":null,"spectrum_id":"CCMSLIB00017305902","spectrum_index":44486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 57.0214 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.102,"smiles":null,"spectrum_id":"CCMSLIB00017305905","spectrum_index":44487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002276 (+)-Chelidonine|Chelidonine|(1S,12S,13R)-24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol (delta mass: 129.08 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.214,"smiles":null,"spectrum_id":"CCMSLIB00017305908","spectrum_index":44488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 540.4522 Da; putative annotation: N/A; putative formula: C32H56N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":835.585,"smiles":null,"spectrum_id":"CCMSLIB00017305911","spectrum_index":44489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 131.0313 Da; putative annotation: N/A; putative formula: C5H10NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.103,"smiles":null,"spectrum_id":"CCMSLIB00017305913","spectrum_index":44490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 867.7766 Da; putative annotation: N/A; putative formula: C51H97N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1089.87,"smiles":null,"spectrum_id":"CCMSLIB00017305916","spectrum_index":44491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 716.3062 Da; putative annotation: N/A; putative formula: C49H49O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":938.403,"smiles":null,"spectrum_id":"CCMSLIB00017305919","spectrum_index":44492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lactulose from NIST14 (delta mass: 318.256 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.38,"smiles":null,"spectrum_id":"CCMSLIB00017305921","spectrum_index":44493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 140.1194 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.273,"smiles":null,"spectrum_id":"CCMSLIB00017305924","spectrum_index":44494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 574.3143 Da; putative annotation: N/A; putative formula: C32H46O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.401,"smiles":null,"spectrum_id":"CCMSLIB00017305927","spectrum_index":44495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 109.0528 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.17,"smiles":null,"spectrum_id":"CCMSLIB00017305930","spectrum_index":44496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 119.0459 Da; putative annotation: N/A; putative formula: CH5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.132,"smiles":null,"spectrum_id":"CCMSLIB00017305932","spectrum_index":44497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 136.0526 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017305934","spectrum_index":44498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 68.0377 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.114,"smiles":null,"spectrum_id":"CCMSLIB00017305937","spectrum_index":44499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310824 N-Fructosyl isoleucine (delta mass: 162.0485 Da; putative annotation: N/A; putative formula: C4H11N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.203,"smiles":null,"spectrum_id":"CCMSLIB00017305940","spectrum_index":44500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 991.8849 Da; putative annotation: N/A; putative formula: C53H105N19O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1213.98,"smiles":null,"spectrum_id":"CCMSLIB00017305943","spectrum_index":44501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 42.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017305946","spectrum_index":44502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381375-01!(6E)-heptadeca-6,16-diene-1,2,4-triol [IIN-based: Match] (delta mass: 104.0627 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017305948","spectrum_index":44503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 286.2143 Da; putative annotation: N/A; putative formula: C16H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.321,"smiles":null,"spectrum_id":"CCMSLIB00017305950","spectrum_index":44504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 286.0822 Da; putative annotation: N/A; putative formula: C9H19O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.158,"smiles":null,"spectrum_id":"CCMSLIB00017305953","spectrum_index":44505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ETHYL 3-INDOLEACETATE - 20.0 eV (delta mass: 235.1216 Da; putative annotation: N/A; putative formula: C14H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.224,"smiles":null,"spectrum_id":"CCMSLIB00017305956","spectrum_index":44506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 132.0447 Da; putative annotation: N/A; putative formula: C4H9N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.05,"smiles":null,"spectrum_id":"CCMSLIB00017305959","spectrum_index":44507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 76.0063 Da; putative annotation: N/A; putative formula: C4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.118,"smiles":null,"spectrum_id":"CCMSLIB00017305960","spectrum_index":44508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 380.1348 Da; putative annotation: N/A; putative formula: C14H25N2O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.2,"smiles":null,"spectrum_id":"CCMSLIB00017305963","spectrum_index":44509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 13.0055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.076,"smiles":null,"spectrum_id":"CCMSLIB00017305966","spectrum_index":44510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 327.2765 Da; putative annotation: N/A; putative formula: C19H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.342,"smiles":null,"spectrum_id":"CCMSLIB00017305969","spectrum_index":44511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 151.0353 Da; putative annotation: N/A; putative formula: C2HN9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.079,"smiles":null,"spectrum_id":"CCMSLIB00017305972","spectrum_index":44512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 59.0219 Da; putative annotation: N/A; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.15,"smiles":null,"spectrum_id":"CCMSLIB00017305975","spectrum_index":44513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 92.0476 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.149,"smiles":null,"spectrum_id":"CCMSLIB00017305977","spectrum_index":44514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 140.0993 Da; putative annotation: N/A; putative formula: C12H12O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017305980","spectrum_index":44515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLGALACTOSAMINE (delta mass: 288.2589 Da; putative annotation: N/A; putative formula: C19H32N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.356,"smiles":null,"spectrum_id":"CCMSLIB00017305983","spectrum_index":44516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 179.0827 Da; putative annotation: N/A; putative formula: C5H14N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.145,"smiles":null,"spectrum_id":"CCMSLIB00017305986","spectrum_index":44517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Gln (delta mass: 111.0322 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.161,"smiles":null,"spectrum_id":"CCMSLIB00017305989","spectrum_index":44518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Leu (delta mass: 214.1321 Da; putative annotation: Leu-Thr; putative formula: C10H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.302,"smiles":null,"spectrum_id":"CCMSLIB00017305992","spectrum_index":44519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 151.0634 Da; putative annotation: PYRIDOXINE - 20.0 eV; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.134,"smiles":null,"spectrum_id":"CCMSLIB00017305995","spectrum_index":44520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 147.0687 Da; putative annotation: L-Phenylalanine; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017305998","spectrum_index":44521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 194.1693 Da; putative annotation: cis-11-Methyl-2-dodecenoic acid; putative formula: C13H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.24,"smiles":null,"spectrum_id":"CCMSLIB00017306001","spectrum_index":44522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 83.0371 Da; putative annotation: L-Homoserine lactone; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017306004","spectrum_index":44523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alosetron (delta mass: 200.0887 Da; putative annotation: Glu-Ala; putative formula: C8H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.244,"smiles":null,"spectrum_id":"CCMSLIB00017306007","spectrum_index":44524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 125.0477 Da; putative annotation: (2-Oxo-1-pyrrolidinyl)acetic acid; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.139,"smiles":null,"spectrum_id":"CCMSLIB00017306010","spectrum_index":44525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Mannitol from NIST14 (delta mass: 280.241 Da; putative annotation: 6-Oxooctadecanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.327,"smiles":null,"spectrum_id":"CCMSLIB00017306013","spectrum_index":44526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 147.0679 Da; putative annotation: 2-Anilinopropanoic acid; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017306016","spectrum_index":44527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.096,"smiles":null,"spectrum_id":"CCMSLIB00017306019","spectrum_index":44528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 172.144 Da; putative annotation: N/A; putative formula: C6H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.209,"smiles":null,"spectrum_id":"CCMSLIB00017306022","spectrum_index":44529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 321.2671 Da; putative annotation: N/A; putative formula: C20H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.353,"smiles":null,"spectrum_id":"CCMSLIB00017306025","spectrum_index":44530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 42.9922 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.079,"smiles":null,"spectrum_id":"CCMSLIB00017306028","spectrum_index":44531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 325.1904 Da; putative annotation: N/A; putative formula: C18H23N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.271,"smiles":null,"spectrum_id":"CCMSLIB00017306030","spectrum_index":44532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 457.1797 Da; putative annotation: N/A; putative formula: C23H23N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.224,"smiles":null,"spectrum_id":"CCMSLIB00017306033","spectrum_index":44533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 133.2042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.247,"smiles":null,"spectrum_id":"CCMSLIB00017306035","spectrum_index":44534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 686.3666 Da; putative annotation: N/A; putative formula: C36H42N14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":893.453,"smiles":null,"spectrum_id":"CCMSLIB00017306038","spectrum_index":44535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 64.0 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.062,"smiles":null,"spectrum_id":"CCMSLIB00017306041","spectrum_index":44536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 270.2199 Da; putative annotation: N/A; putative formula: C16H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.328,"smiles":null,"spectrum_id":"CCMSLIB00017306044","spectrum_index":44537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 112.9326 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.003,"smiles":null,"spectrum_id":"CCMSLIB00017306046","spectrum_index":44538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-hydroxyoctanoyl)homoserine (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.227,"smiles":null,"spectrum_id":"CCMSLIB00017306049","spectrum_index":44539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 573.2271 Da; putative annotation: N/A; putative formula: C28H31N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.351,"smiles":null,"spectrum_id":"CCMSLIB00017306052","spectrum_index":44540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 220.0942 Da; putative annotation: N/A; putative formula: C9H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.181,"smiles":null,"spectrum_id":"CCMSLIB00017306055","spectrum_index":44541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 97.053 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.187,"smiles":null,"spectrum_id":"CCMSLIB00017306058","spectrum_index":44542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:102040 (delta mass: 406.1495 Da; putative annotation: N/A; putative formula: C19H34OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.241,"smiles":null,"spectrum_id":"CCMSLIB00017306061","spectrum_index":44543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 25.0383 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.119,"smiles":null,"spectrum_id":"CCMSLIB00017306063","spectrum_index":44544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 38.9897 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.024,"smiles":null,"spectrum_id":"CCMSLIB00017306066","spectrum_index":44545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 195.9868 Da; putative annotation: N/A; putative formula: C5N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.052,"smiles":null,"spectrum_id":"CCMSLIB00017306068","spectrum_index":44546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 504.1575 Da; putative annotation: N/A; putative formula: C25H32N2O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.223,"smiles":null,"spectrum_id":"CCMSLIB00017306071","spectrum_index":44547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Di-dihydrocaffeoyl spermidine (delta mass: 164.0472 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.307,"smiles":null,"spectrum_id":"CCMSLIB00017306074","spectrum_index":44548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HNQ:db (delta mass: 269.1835 Da; putative annotation: N/A; putative formula: C15H29NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.369,"smiles":null,"spectrum_id":"CCMSLIB00017306077","spectrum_index":44549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 632.2407 Da; putative annotation: N/A; putative formula: C24H48N4O7S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":869.353,"smiles":null,"spectrum_id":"CCMSLIB00017306080","spectrum_index":44550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 531.3767 Da; putative annotation: N/A; putative formula: C28H53NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.442,"smiles":null,"spectrum_id":"CCMSLIB00017306081","spectrum_index":44551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 152.0628 Da; putative annotation: N/A; putative formula: C12H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.107,"smiles":null,"spectrum_id":"CCMSLIB00017306084","spectrum_index":44552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dulcitol (delta mass: 47.0886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.175,"smiles":null,"spectrum_id":"CCMSLIB00017306087","spectrum_index":44553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"ADENOSINE 3',5'-DIPHOSPHATE\"\" (delta mass: 96.0224 Da; putative annotation: N/A; putative formula: C5H4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.059,"smiles":null,"spectrum_id":"CCMSLIB00017306090","spectrum_index":44554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 15.9925 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.079,"smiles":null,"spectrum_id":"CCMSLIB00017306092","spectrum_index":44555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 69.0573 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.201,"smiles":null,"spectrum_id":"CCMSLIB00017306096","spectrum_index":44556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptoethanol (delta mass: 77.0211 Da; putative annotation: N/A; putative formula: H3N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.042,"smiles":null,"spectrum_id":"CCMSLIB00017306098","spectrum_index":44557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 61.0663 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.126,"smiles":null,"spectrum_id":"CCMSLIB00017306100","spectrum_index":44558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 11.9883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.096,"smiles":null,"spectrum_id":"CCMSLIB00017306103","spectrum_index":44559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltotetraose from NIST14 (delta mass: 181.0751 Da; putative annotation: N/A; putative formula: C10H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.304,"smiles":null,"spectrum_id":"CCMSLIB00017306106","spectrum_index":44560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 147.032 Da; putative annotation: N/A; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.129,"smiles":null,"spectrum_id":"CCMSLIB00017306109","spectrum_index":44561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 41.0634 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.129,"smiles":null,"spectrum_id":"CCMSLIB00017306112","spectrum_index":44562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-NORMETANEPHRINE - 30.0 eV (delta mass: 40.0303 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.127,"smiles":null,"spectrum_id":"CCMSLIB00017306113","spectrum_index":44563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Tocotrienol (delta mass: 18.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.353,"smiles":null,"spectrum_id":"CCMSLIB00017306116","spectrum_index":44564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 224.1374 Da; putative annotation: N/A; putative formula: C9H16N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.216,"smiles":null,"spectrum_id":"CCMSLIB00017306119","spectrum_index":44565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 188.0826 Da; putative annotation: N/A; putative formula: C6H13N4OP)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.148,"smiles":null,"spectrum_id":"CCMSLIB00017306122","spectrum_index":44566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 144.1152 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.137,"smiles":null,"spectrum_id":"CCMSLIB00017306125","spectrum_index":44567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 492.285 Da; putative annotation: N/A; putative formula: C24H45O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.372,"smiles":null,"spectrum_id":"CCMSLIB00017306126","spectrum_index":44568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 142.0441 Da; putative annotation: N/A; putative formula: C10H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.12,"smiles":null,"spectrum_id":"CCMSLIB00017306129","spectrum_index":44569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecopipam (delta mass: 143.0578 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.188,"smiles":null,"spectrum_id":"CCMSLIB00017306132","spectrum_index":44570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 139.0432 Da; putative annotation: N/A; putative formula: C10H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.14,"smiles":null,"spectrum_id":"CCMSLIB00017306135","spectrum_index":44571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 101.0476 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.15,"smiles":null,"spectrum_id":"CCMSLIB00017306137","spectrum_index":44572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cephaeline CollisionEnergy:102040 (delta mass: 18.0112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.302,"smiles":null,"spectrum_id":"CCMSLIB00017306141","spectrum_index":44573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 195.045 Da; putative annotation: N/A; putative formula: C9H10NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.221,"smiles":null,"spectrum_id":"CCMSLIB00017306142","spectrum_index":44574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 149.0727 Da; putative annotation: N/A; putative formula: C4H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.132,"smiles":null,"spectrum_id":"CCMSLIB00017306145","spectrum_index":44575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of amino-N-[2-(2-methylindol-3-yl)ethyl]amide CollisionEnergy:205060 (delta mass: 142.0624 Da; putative annotation: N/A; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.191,"smiles":null,"spectrum_id":"CCMSLIB00017306148","spectrum_index":44576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU157406 6-Monoacetylmorphine|(9-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-yl) acetate (delta mass: 42.0093 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.164,"smiles":null,"spectrum_id":"CCMSLIB00017306151","spectrum_index":44577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 64.0125 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.109,"smiles":null,"spectrum_id":"CCMSLIB00017306153","spectrum_index":44578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 11.9988 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.106,"smiles":null,"spectrum_id":"CCMSLIB00017306155","spectrum_index":44579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 653.5624 Da; putative annotation: N/A; putative formula: C38H76N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":839.634,"smiles":null,"spectrum_id":"CCMSLIB00017306158","spectrum_index":44580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 386.1415 Da; putative annotation: N/A; putative formula: C19H22N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.228,"smiles":null,"spectrum_id":"CCMSLIB00017306161","spectrum_index":44581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 109.2038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.363,"smiles":null,"spectrum_id":"CCMSLIB00017306164","spectrum_index":44582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 37.0674 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017306166","spectrum_index":44583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 300.0998 Da; putative annotation: N/A; putative formula: C17H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.159,"smiles":null,"spectrum_id":"CCMSLIB00017306168","spectrum_index":44584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 41.0361 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.122,"smiles":null,"spectrum_id":"CCMSLIB00017306171","spectrum_index":44585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-hydroxypyrene (delta mass: 45.0641 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.145,"smiles":null,"spectrum_id":"CCMSLIB00017306174","spectrum_index":44586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Ethyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)acetic acid (delta mass: 203.8476 Da; putative annotation: N/A; putative formula: CH2P2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.956,"smiles":null,"spectrum_id":"CCMSLIB00017306177","spectrum_index":44587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 91.0616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.137,"smiles":null,"spectrum_id":"CCMSLIB00017306178","spectrum_index":44588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 34.0287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.034,"smiles":null,"spectrum_id":"CCMSLIB00017306183","spectrum_index":44589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 308.2878 Da; putative annotation: N/A; putative formula: C24H36O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.416,"smiles":null,"spectrum_id":"CCMSLIB00017306185","spectrum_index":44590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 121.0047 Da; putative annotation: N/A; putative formula: CH4N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.107,"smiles":null,"spectrum_id":"CCMSLIB00017306188","spectrum_index":44591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 136.0526 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.202,"smiles":null,"spectrum_id":"CCMSLIB00017306190","spectrum_index":44592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 448.745 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.869,"smiles":null,"spectrum_id":"CCMSLIB00017306193","spectrum_index":44593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 368.7223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.846,"smiles":null,"spectrum_id":"CCMSLIB00017306196","spectrum_index":44594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 35.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.17,"smiles":null,"spectrum_id":"CCMSLIB00017306199","spectrum_index":44595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 286.2295 Da; putative annotation: N/A; putative formula: C20H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.295,"smiles":null,"spectrum_id":"CCMSLIB00017306201","spectrum_index":44596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-6-methylnicotinic acid (delta mass: 14.0261 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.076,"smiles":null,"spectrum_id":"CCMSLIB00017306204","spectrum_index":44597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 94.0515 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.185,"smiles":null,"spectrum_id":"CCMSLIB00017306207","spectrum_index":44598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 114.0837 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.196,"smiles":null,"spectrum_id":"CCMSLIB00017306209","spectrum_index":44599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 311.2095 Da; putative annotation: N/A; putative formula: C17H29NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.348,"smiles":null,"spectrum_id":"CCMSLIB00017306212","spectrum_index":44600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 130.0618 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.195,"smiles":null,"spectrum_id":"CCMSLIB00017306215","spectrum_index":44601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 109.0913 Da; putative annotation: N/A; putative formula: C7H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.17,"smiles":null,"spectrum_id":"CCMSLIB00017306218","spectrum_index":44602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 336.1369 Da; putative annotation: N/A; putative formula: C14H20N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.234,"smiles":null,"spectrum_id":"CCMSLIB00017306220","spectrum_index":44603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01041 Hexahydrocurcumin (delta mass: 181.0948 Da; putative annotation: N/A; putative formula: C3H7N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.275,"smiles":null,"spectrum_id":"CCMSLIB00017306222","spectrum_index":44604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide IV (delta mass: 192.0738 Da; putative annotation: N/A; putative formula: C8H17OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.182,"smiles":null,"spectrum_id":"CCMSLIB00017306225","spectrum_index":44605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 83.037 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017306228","spectrum_index":44606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 26.5606 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.747,"smiles":null,"spectrum_id":"CCMSLIB00017306231","spectrum_index":44607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 346.2487 Da; putative annotation: N/A; putative formula: C18H30N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.33,"smiles":null,"spectrum_id":"CCMSLIB00017306232","spectrum_index":44608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 72.0566 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.158,"smiles":null,"spectrum_id":"CCMSLIB00017306235","spectrum_index":44609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 211.9696 Da; putative annotation: N/A; putative formula: C8H5O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.103,"smiles":null,"spectrum_id":"CCMSLIB00017306238","spectrum_index":44610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 121.0595 Da; putative annotation: N/A; putative formula: CH7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.099,"smiles":null,"spectrum_id":"CCMSLIB00017306241","spectrum_index":44611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 145.0729 Da; putative annotation: N/A; putative formula: C6H11NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.159,"smiles":null,"spectrum_id":"CCMSLIB00017306243","spectrum_index":44612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 109.0884 Da; putative annotation: N/A; putative formula: C7H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.164,"smiles":null,"spectrum_id":"CCMSLIB00017306246","spectrum_index":44613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 271.0841 Da; putative annotation: N/A; putative formula: C7H17N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.186,"smiles":null,"spectrum_id":"CCMSLIB00017306249","spectrum_index":44614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 87.1134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.154,"smiles":null,"spectrum_id":"CCMSLIB00017306251","spectrum_index":44615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 254.2609 Da; putative annotation: N/A; putative formula: C17H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.348,"smiles":null,"spectrum_id":"CCMSLIB00017306254","spectrum_index":44616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 243.1092 Da; putative annotation: N/A; putative formula: C8H9N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.212,"smiles":null,"spectrum_id":"CCMSLIB00017306258","spectrum_index":44617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 179.0801 Da; putative annotation: N/A; putative formula: C7H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.239,"smiles":null,"spectrum_id":"CCMSLIB00017306260","spectrum_index":44618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 44.0072 Da; putative annotation: N/A; putative formula: C2H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.086,"smiles":null,"spectrum_id":"CCMSLIB00017306263","spectrum_index":44619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 131.1162 Da; putative annotation: N/A; putative formula: C4H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.116,"smiles":null,"spectrum_id":"CCMSLIB00017306266","spectrum_index":44620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 242.2499 Da; putative annotation: N/A; putative formula: C13H30N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.31,"smiles":null,"spectrum_id":"CCMSLIB00017306269","spectrum_index":44621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 23.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.106,"smiles":null,"spectrum_id":"CCMSLIB00017306272","spectrum_index":44622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 595.7193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":938.843,"smiles":null,"spectrum_id":"CCMSLIB00017306273","spectrum_index":44623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 827.2872 Da; putative annotation: N/A; putative formula: C39H41N9O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1494.52,"smiles":null,"spectrum_id":"CCMSLIB00017306276","spectrum_index":44624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 388.1713 Da; putative annotation: N/A; putative formula: C15H28N6O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.258,"smiles":null,"spectrum_id":"CCMSLIB00017306279","spectrum_index":44625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 137.0841 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.191,"smiles":null,"spectrum_id":"CCMSLIB00017306282","spectrum_index":44626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 503.2478 Da; putative annotation: N/A; putative formula: C22H37N3O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.345,"smiles":null,"spectrum_id":"CCMSLIB00017306285","spectrum_index":44627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 162.0681 Da; putative annotation: N/A; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.123,"smiles":null,"spectrum_id":"CCMSLIB00017306287","spectrum_index":44628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 56.0617 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.179,"smiles":null,"spectrum_id":"CCMSLIB00017306289","spectrum_index":44629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 329.1879 Da; putative annotation: N/A; putative formula: C14H27N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.3,"smiles":null,"spectrum_id":"CCMSLIB00017306292","spectrum_index":44630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 315.096 Da; putative annotation: N/A; putative formula: C16H18N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.172,"smiles":null,"spectrum_id":"CCMSLIB00017306295","spectrum_index":44631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 66.0115 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017306298","spectrum_index":44632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-mannosamine - 40.0 eV (delta mass: 260.0364 Da; putative annotation: N/A; putative formula: C11H16OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.134,"smiles":null,"spectrum_id":"CCMSLIB00017306299","spectrum_index":44633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 181.183 Da; putative annotation: N/A; putative formula: C12H23N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.275,"smiles":null,"spectrum_id":"CCMSLIB00017306302","spectrum_index":44634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydro-beta-carboline (delta mass: 43.9899 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.113,"smiles":null,"spectrum_id":"CCMSLIB00017306305","spectrum_index":44635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 63.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017306308","spectrum_index":44636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100449 D(-)-Threose|D-Threo-tetrose|D-threo-Aldose (delta mass: 18.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.112,"smiles":null,"spectrum_id":"CCMSLIB00017306311","spectrum_index":44637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 27.9945 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.18,"smiles":null,"spectrum_id":"CCMSLIB00017306312","spectrum_index":44638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 240.1877 Da; putative annotation: N/A; putative formula: C18H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.284,"smiles":null,"spectrum_id":"CCMSLIB00017306317","spectrum_index":44639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.279,"smiles":null,"spectrum_id":"CCMSLIB00017306318","spectrum_index":44640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 48.0057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.113,"smiles":null,"spectrum_id":"CCMSLIB00017306321","spectrum_index":44641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 451.204 Da; putative annotation: N/A; putative formula: C26H26N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.358,"smiles":null,"spectrum_id":"CCMSLIB00017306324","spectrum_index":44642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 400.1262 Da; putative annotation: N/A; putative formula: C22H25O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.281,"smiles":null,"spectrum_id":"CCMSLIB00017306327","spectrum_index":44643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Hydroxybutorphanol (delta mass: 9.9852 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.207,"smiles":null,"spectrum_id":"CCMSLIB00017306329","spectrum_index":44644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE-3-ACETIC ACID (delta mass: 192.1584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.224,"smiles":null,"spectrum_id":"CCMSLIB00017306332","spectrum_index":44645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 158.0194 Da; putative annotation: N/A; putative formula: C10H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.142,"smiles":null,"spectrum_id":"CCMSLIB00017306335","spectrum_index":44646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 136.052 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017306338","spectrum_index":44647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 229.2459 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.415,"smiles":null,"spectrum_id":"CCMSLIB00017306342","spectrum_index":44648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 92.0511 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.13,"smiles":null,"spectrum_id":"CCMSLIB00017306345","spectrum_index":44649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 11.0356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.091,"smiles":null,"spectrum_id":"CCMSLIB00017306348","spectrum_index":44650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Met (delta mass: 365.133 Da; putative annotation: N/A; putative formula: C15H27NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.286,"smiles":null,"spectrum_id":"CCMSLIB00017306351","spectrum_index":44651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 171.0302 Da; putative annotation: N/A; putative formula: C4H6N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.283,"smiles":null,"spectrum_id":"CCMSLIB00017306354","spectrum_index":44652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 49.0051 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.139,"smiles":null,"spectrum_id":"CCMSLIB00017306357","spectrum_index":44653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 48.0108 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.144,"smiles":null,"spectrum_id":"CCMSLIB00017306360","spectrum_index":44654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1,2,3,4-tetrahydroquinoline (delta mass: 86.0215 Da; putative annotation: N/A; putative formula: CH2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017306362","spectrum_index":44655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 338.3186 Da; putative annotation: N/A; putative formula: C22H42O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.436,"smiles":null,"spectrum_id":"CCMSLIB00017306365","spectrum_index":44656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 365.2029 Da; putative annotation: N/A; putative formula: C20H31NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.383,"smiles":null,"spectrum_id":"CCMSLIB00017306368","spectrum_index":44657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-6-Hydroxy-5-(1H-indol-3-ylmethylene)-2-sulfanyl-4(5H)-pyrimidinone (delta mass: 32.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.081,"smiles":null,"spectrum_id":"CCMSLIB00017306371","spectrum_index":44658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.227,"smiles":null,"spectrum_id":"CCMSLIB00017306373","spectrum_index":44659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 369.0903 Da; putative annotation: N/A; putative formula: C25H11N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.255,"smiles":null,"spectrum_id":"CCMSLIB00017306377","spectrum_index":44660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrexone (delta mass: 85.0192 Da; putative annotation: N/A; putative formula: C2H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.189,"smiles":null,"spectrum_id":"CCMSLIB00017306379","spectrum_index":44661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 27.4137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017306382","spectrum_index":44662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 60.4352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017306385","spectrum_index":44663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 72.0179 Da; putative annotation: N/A; putative formula: C2H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.13,"smiles":null,"spectrum_id":"CCMSLIB00017306388","spectrum_index":44664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chelidonin (delta mass: 20.975 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.109,"smiles":null,"spectrum_id":"CCMSLIB00017306389","spectrum_index":44665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-[(6-Methoxy-1H-benzimidazol-2-yl)sulfanyl]-2-furaldehyde (delta mass: 18.0171 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.066,"smiles":null,"spectrum_id":"CCMSLIB00017306394","spectrum_index":44666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 90.0567 Da; putative annotation: N/A; putative formula: C6H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.18,"smiles":null,"spectrum_id":"CCMSLIB00017306395","spectrum_index":44667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine hydrochloride (delta mass: 257.1086 Da; putative annotation: N/A; putative formula: C12H19NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.188,"smiles":null,"spectrum_id":"CCMSLIB00017306398","spectrum_index":44668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 344.1631 Da; putative annotation: N/A; putative formula: C20H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.234,"smiles":null,"spectrum_id":"CCMSLIB00017306401","spectrum_index":44669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 113.0845 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.255,"smiles":null,"spectrum_id":"CCMSLIB00017306404","spectrum_index":44670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 189.0767 Da; putative annotation: 3-[N-(4-methylphenyl)carbamoyl]propanoic acid CollisionEnergy:102040; putative formula: C11H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.152,"smiles":null,"spectrum_id":"CCMSLIB00017306405","spectrum_index":44671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 258.1983 Da; putative annotation: Stearidonic acid; putative formula: C18H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.295,"smiles":null,"spectrum_id":"CCMSLIB00017306408","spectrum_index":44672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 198.0893 Da; putative annotation: 3-Oxo-1,8-octanedicarboxylic acid; putative formula: C10H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.16,"smiles":null,"spectrum_id":"CCMSLIB00017306411","spectrum_index":44673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 124.0167 Da; putative annotation: 5-Hydroxymethyl-2-furancarboxylic acid; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.092,"smiles":null,"spectrum_id":"CCMSLIB00017306414","spectrum_index":44674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 155.1331 Da; putative annotation: (S)-N-methyl-pregabalin; putative formula: C9H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.204,"smiles":null,"spectrum_id":"CCMSLIB00017306415","spectrum_index":44675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 148.0379 Da; putative annotation: Heteroxanthine - 40.0 eV; putative formula: C6H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.098,"smiles":null,"spectrum_id":"CCMSLIB00017306418","spectrum_index":44676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 17.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.129,"smiles":null,"spectrum_id":"CCMSLIB00017306421","spectrum_index":44677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 162.1267 Da; putative annotation: N/A; putative formula: C9H14N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.207,"smiles":null,"spectrum_id":"CCMSLIB00017306424","spectrum_index":44678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (delta mass: 63.0613 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.165,"smiles":null,"spectrum_id":"CCMSLIB00017306427","spectrum_index":44679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 209.0513 Da; putative annotation: N/A; putative formula: C10H11NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.153,"smiles":null,"spectrum_id":"CCMSLIB00017306429","spectrum_index":44680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 70.0789 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.332,"smiles":null,"spectrum_id":"CCMSLIB00017306432","spectrum_index":44681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 96.0206 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.117,"smiles":null,"spectrum_id":"CCMSLIB00017306435","spectrum_index":44682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 299.1384 Da; putative annotation: N/A; putative formula: C15H17N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.24,"smiles":null,"spectrum_id":"CCMSLIB00017306437","spectrum_index":44683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopycnarrhine (delta mass: 98.0475 Da; putative annotation: N/A; putative formula: C4H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.149,"smiles":null,"spectrum_id":"CCMSLIB00017306440","spectrum_index":44684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 292.0451 Da; putative annotation: N/A; putative formula: C12H12N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.136,"smiles":null,"spectrum_id":"CCMSLIB00017306443","spectrum_index":44685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 220.1462 Da; putative annotation: N/A; putative formula: C14H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.269,"smiles":null,"spectrum_id":"CCMSLIB00017306446","spectrum_index":44686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 38.0548 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.098,"smiles":null,"spectrum_id":"CCMSLIB00017306447","spectrum_index":44687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 145.0991 Da; putative annotation: N/A; putative formula: C9H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.212,"smiles":null,"spectrum_id":"CCMSLIB00017306450","spectrum_index":44688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 313.1139 Da; putative annotation: N/A; putative formula: C18H19NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.179,"smiles":null,"spectrum_id":"CCMSLIB00017306453","spectrum_index":44689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 17.0313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.148,"smiles":null,"spectrum_id":"CCMSLIB00017306456","spectrum_index":44690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 272.139 Da; putative annotation: N/A; putative formula: C13H16N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.293,"smiles":null,"spectrum_id":"CCMSLIB00017306459","spectrum_index":44691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 55.0609 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.174,"smiles":null,"spectrum_id":"CCMSLIB00017306461","spectrum_index":44692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 84.9924 Da; putative annotation: N/A; putative formula: CH-1N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.053,"smiles":null,"spectrum_id":"CCMSLIB00017306463","spectrum_index":44693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 48.0348 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.184,"smiles":null,"spectrum_id":"CCMSLIB00017306466","spectrum_index":44694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 14.9631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.091,"smiles":null,"spectrum_id":"CCMSLIB00017306469","spectrum_index":44695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 220.1468 Da; putative annotation: N/A; putative formula: C14H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.233,"smiles":null,"spectrum_id":"CCMSLIB00017306472","spectrum_index":44696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU043906 2,2'-(Oxydimethanediyl)bis(2-ethylpropane-1,3-diol)|Ditrimethylolpropane|2-[2,2-bis(hydroxymethyl)butoxymethyl]-2-ethylpropane-1,3-diol (delta mass: 36.0361 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.221,"smiles":null,"spectrum_id":"CCMSLIB00017306475","spectrum_index":44697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 90.0442 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.193,"smiles":null,"spectrum_id":"CCMSLIB00017306478","spectrum_index":44698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ365709 Cimaterol|2-amino-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile (delta mass: 87.0206 Da; putative annotation: N/A; putative formula: C5HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.165,"smiles":null,"spectrum_id":"CCMSLIB00017306480","spectrum_index":44699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 210.068 Da; putative annotation: N/A; putative formula: C14H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.192,"smiles":null,"spectrum_id":"CCMSLIB00017306483","spectrum_index":44700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-hydroxybenzo(a)pyrene (delta mass: 82.1111 Da; putative annotation: N/A; putative formula: C7H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.207,"smiles":null,"spectrum_id":"CCMSLIB00017306486","spectrum_index":44701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 159.0274 Da; putative annotation: N/A; putative formula: C6H10NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.109,"smiles":null,"spectrum_id":"CCMSLIB00017306488","spectrum_index":44702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 328.3264 Da; putative annotation: N/A; putative formula: C23H40N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.438,"smiles":null,"spectrum_id":"CCMSLIB00017306490","spectrum_index":44703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 273.6557 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.742,"smiles":null,"spectrum_id":"CCMSLIB00017306493","spectrum_index":44704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 166.9877 Da; putative annotation: N/A; putative formula: C5H2N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.085,"smiles":null,"spectrum_id":"CCMSLIB00017306496","spectrum_index":44705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 129.1513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.222,"smiles":null,"spectrum_id":"CCMSLIB00017306499","spectrum_index":44706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltotriose from NIST14 (delta mass: 186.0531 Da; putative annotation: N/A; putative formula: C8H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.229,"smiles":null,"spectrum_id":"CCMSLIB00017306501","spectrum_index":44707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 341.1323 Da; putative annotation: N/A; putative formula: C12H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.256,"smiles":null,"spectrum_id":"CCMSLIB00017306505","spectrum_index":44708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 174.0862 Da; putative annotation: N/A; putative formula: C4H10N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.172,"smiles":null,"spectrum_id":"CCMSLIB00017306507","spectrum_index":44709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 175.0621 Da; putative annotation: N/A; putative formula: C4H10N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.154,"smiles":null,"spectrum_id":"CCMSLIB00017306509","spectrum_index":44710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 255.1303 Da; putative annotation: N/A; putative formula: C13H23NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.222,"smiles":null,"spectrum_id":"CCMSLIB00017306512","spectrum_index":44711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 439.279 Da; putative annotation: N/A; putative formula: C31H38NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.424,"smiles":null,"spectrum_id":"CCMSLIB00017306515","spectrum_index":44712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 30.0112 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.059,"smiles":null,"spectrum_id":"CCMSLIB00017306518","spectrum_index":44713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 610.1248 Da; putative annotation: N/A; putative formula: C42H26O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":979.236,"smiles":null,"spectrum_id":"CCMSLIB00017306521","spectrum_index":44714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 222.2343 Da; putative annotation: N/A; putative formula: C16H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.305,"smiles":null,"spectrum_id":"CCMSLIB00017306524","spectrum_index":44715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 157.1756 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.262,"smiles":null,"spectrum_id":"CCMSLIB00017306527","spectrum_index":44716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 602.5811 Da; putative annotation: N/A; putative formula: C44H74)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.653,"smiles":null,"spectrum_id":"CCMSLIB00017306528","spectrum_index":44717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 137.0839 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.237,"smiles":null,"spectrum_id":"CCMSLIB00017306531","spectrum_index":44718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 402.2794 Da; putative annotation: N/A; putative formula: C24H39N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.348,"smiles":null,"spectrum_id":"CCMSLIB00017306534","spectrum_index":44719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 888.4697 Da; putative annotation: N/A; putative formula: C69H60)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1110.57,"smiles":null,"spectrum_id":"CCMSLIB00017306537","spectrum_index":44720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 620.3214 Da; putative annotation: N/A; putative formula: C27H44N10O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.413,"smiles":null,"spectrum_id":"CCMSLIB00017306538","spectrum_index":44721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 90.0627 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.097,"smiles":null,"spectrum_id":"CCMSLIB00017306543","spectrum_index":44722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE10; CorrDec (delta mass: 55.0424 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.103,"smiles":null,"spectrum_id":"CCMSLIB00017306544","spectrum_index":44723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 663.2322 Da; putative annotation: N/A; putative formula: C36H41NO7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1168.41,"smiles":null,"spectrum_id":"CCMSLIB00017306547","spectrum_index":44724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 62.9861 Da; putative annotation: N/A; putative formula: H2NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.077,"smiles":null,"spectrum_id":"CCMSLIB00017306550","spectrum_index":44725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 12.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.19,"smiles":null,"spectrum_id":"CCMSLIB00017306553","spectrum_index":44726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 136.1261 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.416,"smiles":null,"spectrum_id":"CCMSLIB00017306554","spectrum_index":44727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 131.0364 Da; putative annotation: N/A; putative formula: C2H6N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.139,"smiles":null,"spectrum_id":"CCMSLIB00017306557","spectrum_index":44728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 2.0076 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.089,"smiles":null,"spectrum_id":"CCMSLIB00017306560","spectrum_index":44729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 24.9916 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.067,"smiles":null,"spectrum_id":"CCMSLIB00017306563","spectrum_index":44730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.144,"smiles":null,"spectrum_id":"CCMSLIB00017306564","spectrum_index":44731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 30.0179 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.151,"smiles":null,"spectrum_id":"CCMSLIB00017306567","spectrum_index":44732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 72.0211 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.145,"smiles":null,"spectrum_id":"CCMSLIB00017306570","spectrum_index":44733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 99.0748 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.25,"smiles":null,"spectrum_id":"CCMSLIB00017306573","spectrum_index":44734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Glu (delta mass: 23.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.15,"smiles":null,"spectrum_id":"CCMSLIB00017306575","spectrum_index":44735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 410.1301 Da; putative annotation: N/A; putative formula: C22H22N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.264,"smiles":null,"spectrum_id":"CCMSLIB00017306577","spectrum_index":44736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 328.1074 Da; putative annotation: N/A; putative formula: C15H21O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.194,"smiles":null,"spectrum_id":"CCMSLIB00017306580","spectrum_index":44737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (Z,E)-Tetradeca-9,12-dienol from NIST14 (delta mass: 161.1426 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.348,"smiles":null,"spectrum_id":"CCMSLIB00017306583","spectrum_index":44738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylose (delta mass: 65.0268 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.087,"smiles":null,"spectrum_id":"CCMSLIB00017306586","spectrum_index":44739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-.beta.-D-ribofuranosyl-1H-imidazole-4-carboxamide (delta mass: 60.062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.166,"smiles":null,"spectrum_id":"CCMSLIB00017306588","spectrum_index":44740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 22.04 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.21,"smiles":null,"spectrum_id":"CCMSLIB00017306591","spectrum_index":44741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 10.0571 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.143,"smiles":null,"spectrum_id":"CCMSLIB00017306593","spectrum_index":44742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 625.3769 Da; putative annotation: N/A; putative formula: C40H51NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":908.546,"smiles":null,"spectrum_id":"CCMSLIB00017306596","spectrum_index":44743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 70.0174 Da; putative annotation: N/A; putative formula: C2H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.088,"smiles":null,"spectrum_id":"CCMSLIB00017306599","spectrum_index":44744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:KO008824 N-Acetylneuraminate|5-Acetamido-3,5-dideoxy-D-glycero-D-galacto-2-nonulosonic acid|N-Acetylneuraminic acid|Neu5Ac (delta mass: 9.9801 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.093,"smiles":null,"spectrum_id":"CCMSLIB00017306601","spectrum_index":44745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N.alpha.-Acetyl-L-lysine from NIST14 (delta mass: 278.2607 Da; putative annotation: N/A; putative formula: C19H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.384,"smiles":null,"spectrum_id":"CCMSLIB00017306604","spectrum_index":44746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 74.0702 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.25,"smiles":null,"spectrum_id":"CCMSLIB00017306607","spectrum_index":44747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 207.0768 Da; putative annotation: N/A; putative formula: C6H14N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.116,"smiles":null,"spectrum_id":"CCMSLIB00017306610","spectrum_index":44748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 673.5488 Da; putative annotation: N/A; putative formula: C38H75NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":836.609,"smiles":null,"spectrum_id":"CCMSLIB00017306613","spectrum_index":44749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-L-phenylalanine (delta mass: 10.0223 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.098,"smiles":null,"spectrum_id":"CCMSLIB00017306616","spectrum_index":44750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 193.0376 Da; putative annotation: N/A; putative formula: C9H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.124,"smiles":null,"spectrum_id":"CCMSLIB00017306618","spectrum_index":44751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 105.0431 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.103,"smiles":null,"spectrum_id":"CCMSLIB00017306621","spectrum_index":44752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 25.9762 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.115,"smiles":null,"spectrum_id":"CCMSLIB00017306624","spectrum_index":44753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenylethylamine (delta mass: 18.0846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.202,"smiles":null,"spectrum_id":"CCMSLIB00017306627","spectrum_index":44754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Iditol (delta mass: 48.0366 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.123,"smiles":null,"spectrum_id":"CCMSLIB00017306630","spectrum_index":44755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 64.0153 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.19,"smiles":null,"spectrum_id":"CCMSLIB00017306633","spectrum_index":44756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301042 Thalsimidine (delta mass: 92.0493 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.325,"smiles":null,"spectrum_id":"CCMSLIB00017306635","spectrum_index":44757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 110.0392 Da; putative annotation: N/A; putative formula: C5H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.12,"smiles":null,"spectrum_id":"CCMSLIB00017306638","spectrum_index":44758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 46.0083 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.1,"smiles":null,"spectrum_id":"CCMSLIB00017306641","spectrum_index":44759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 40.9691 Da; putative annotation: N/A; putative formula: C16H23N7O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.049,"smiles":null,"spectrum_id":"CCMSLIB00017306644","spectrum_index":44760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 74.0498 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.126,"smiles":null,"spectrum_id":"CCMSLIB00017306647","spectrum_index":44761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT200730 D(+)-Galacturonic acid monohydrate|D-galacturonate|(2S,3R,4S,5R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid (delta mass: 104.0625 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017306650","spectrum_index":44762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 119.0555 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.142,"smiles":null,"spectrum_id":"CCMSLIB00017306652","spectrum_index":44763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 245.8406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.0,"smiles":null,"spectrum_id":"CCMSLIB00017306655","spectrum_index":44764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 327.9981 Da; putative annotation: N/A; putative formula: C8H8N8OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.121,"smiles":null,"spectrum_id":"CCMSLIB00017306658","spectrum_index":44765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 190.0865 Da; putative annotation: N/A; putative formula: C7H15N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.162,"smiles":null,"spectrum_id":"CCMSLIB00017306661","spectrum_index":44766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSAMINE (delta mass: 66.0108 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.097,"smiles":null,"spectrum_id":"CCMSLIB00017306664","spectrum_index":44767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 216.115 Da; putative annotation: N/A; putative formula: C14H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017306667","spectrum_index":44768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 60.0 eV (delta mass: 70.1037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.19,"smiles":null,"spectrum_id":"CCMSLIB00017306668","spectrum_index":44769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE0; MS2Dec (delta mass: 180.1519 Da; putative annotation: N/A; putative formula: C12H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.212,"smiles":null,"spectrum_id":"CCMSLIB00017306671","spectrum_index":44770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 290.1536 Da; putative annotation: N/A; putative formula: C18H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.272,"smiles":null,"spectrum_id":"CCMSLIB00017306674","spectrum_index":44771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 139.1326 Da; putative annotation: N/A; putative formula: C9H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017306677","spectrum_index":44772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 2.0703 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.12,"smiles":null,"spectrum_id":"CCMSLIB00017306680","spectrum_index":44773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 66.0044 Da; putative annotation: N/A; putative formula: C4H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.128,"smiles":null,"spectrum_id":"CCMSLIB00017306681","spectrum_index":44774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 317.1552 Da; putative annotation: N/A; putative formula: C18H24NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.236,"smiles":null,"spectrum_id":"CCMSLIB00017306684","spectrum_index":44775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 459.4106 Da; putative annotation: N/A; putative formula: C20H49N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":802.534,"smiles":null,"spectrum_id":"CCMSLIB00017306687","spectrum_index":44776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 154.1672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.254,"smiles":null,"spectrum_id":"CCMSLIB00017306690","spectrum_index":44777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 129.0425 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.146,"smiles":null,"spectrum_id":"CCMSLIB00017306693","spectrum_index":44778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 611.2757 Da; putative annotation: N/A; putative formula: C35H33N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.43,"smiles":null,"spectrum_id":"CCMSLIB00017306696","spectrum_index":44779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hernagine (delta mass: 45.1501 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.304,"smiles":null,"spectrum_id":"CCMSLIB00017306699","spectrum_index":44780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 108.9885 Da; putative annotation: N/A; putative formula: H4N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.004,"smiles":null,"spectrum_id":"CCMSLIB00017306704","spectrum_index":44781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:102040\"\" (delta mass: 36.021 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017306705","spectrum_index":44782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 256.1131 Da; putative annotation: N/A; putative formula: C15H17N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.236,"smiles":null,"spectrum_id":"CCMSLIB00017306709","spectrum_index":44783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 489.1774 Da; putative annotation: N/A; putative formula: C25H19N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.264,"smiles":null,"spectrum_id":"CCMSLIB00017306711","spectrum_index":44784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 124.162 Da; putative annotation: N/A; putative formula: C10H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.295,"smiles":null,"spectrum_id":"CCMSLIB00017306714","spectrum_index":44785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 105.0531 Da; putative annotation: N/A; putative formula: C2H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.139,"smiles":null,"spectrum_id":"CCMSLIB00017306717","spectrum_index":44786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 161.0318 Da; putative annotation: N/A; putative formula: C5H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.118,"smiles":null,"spectrum_id":"CCMSLIB00017306720","spectrum_index":44787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 114.0317 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.139,"smiles":null,"spectrum_id":"CCMSLIB00017306723","spectrum_index":44788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 528.1689 Da; putative annotation: N/A; putative formula: C20H32O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.229,"smiles":null,"spectrum_id":"CCMSLIB00017306726","spectrum_index":44789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 97.0528 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.118,"smiles":null,"spectrum_id":"CCMSLIB00017306727","spectrum_index":44790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 1038.2755 Da; putative annotation: N/A; putative formula: C61H50O12S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1543.45,"smiles":null,"spectrum_id":"CCMSLIB00017306730","spectrum_index":44791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 46.0042 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.19,"smiles":null,"spectrum_id":"CCMSLIB00017306733","spectrum_index":44792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxy-3,5-dimethoxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 47.0451 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.152,"smiles":null,"spectrum_id":"CCMSLIB00017306736","spectrum_index":44793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 45.9882 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.133,"smiles":null,"spectrum_id":"CCMSLIB00017306737","spectrum_index":44794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 63.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.191,"smiles":null,"spectrum_id":"CCMSLIB00017306740","spectrum_index":44795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 26.0157 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.165,"smiles":null,"spectrum_id":"CCMSLIB00017306743","spectrum_index":44796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 12.0184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.104,"smiles":null,"spectrum_id":"CCMSLIB00017306746","spectrum_index":44797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 462.7523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.823,"smiles":null,"spectrum_id":"CCMSLIB00017306749","spectrum_index":44798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 162.0427 Da; putative annotation: N/A; putative formula: C8H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.156,"smiles":null,"spectrum_id":"CCMSLIB00017306750","spectrum_index":44799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 28.1412 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.114,"smiles":null,"spectrum_id":"CCMSLIB00017306753","spectrum_index":44800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 118.0624 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.149,"smiles":null,"spectrum_id":"CCMSLIB00017306756","spectrum_index":44801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 3.44 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.5,"smiles":null,"spectrum_id":"CCMSLIB00017306759","spectrum_index":44802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 281.1765 Da; putative annotation: N/A; putative formula: C15H19N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.3,"smiles":null,"spectrum_id":"CCMSLIB00017306762","spectrum_index":44803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 170.078 Da; putative annotation: N/A; putative formula: C9H16O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.158,"smiles":null,"spectrum_id":"CCMSLIB00017306763","spectrum_index":44804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 371.169 Da; putative annotation: N/A; putative formula: C16H25N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.255,"smiles":null,"spectrum_id":"CCMSLIB00017306766","spectrum_index":44805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 45.9994 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.112,"smiles":null,"spectrum_id":"CCMSLIB00017306769","spectrum_index":44806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxaldehyde (delta mass: 56.0259 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.086,"smiles":null,"spectrum_id":"CCMSLIB00017306772","spectrum_index":44807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 112.1087 Da; putative annotation: N/A; putative formula: C5H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.15,"smiles":null,"spectrum_id":"CCMSLIB00017306773","spectrum_index":44808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 341.1315 Da; putative annotation: N/A; putative formula: C25H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.169,"smiles":null,"spectrum_id":"CCMSLIB00017306776","spectrum_index":44809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 159.096 Da; putative annotation: N/A; putative formula: C5H13N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.271,"smiles":null,"spectrum_id":"CCMSLIB00017306779","spectrum_index":44810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-methoxy-2-methylindol-3-yl)ethyl](4-methylphenyl)carboxamide CollisionEnergy:102040 (delta mass: 180.0635 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.239,"smiles":null,"spectrum_id":"CCMSLIB00017306781","spectrum_index":44811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corynoline (delta mass: 17.0255 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.175,"smiles":null,"spectrum_id":"CCMSLIB00017306783","spectrum_index":44812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 41.0492 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.167,"smiles":null,"spectrum_id":"CCMSLIB00017306786","spectrum_index":44813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(2-Nitrophenyl)-1,2-ethanediamine (delta mass: 52.0412 Da; putative annotation: N/A; putative formula: C3H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017306789","spectrum_index":44814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of confusarin (delta mass: 27.9943 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.101,"smiles":null,"spectrum_id":"CCMSLIB00017306792","spectrum_index":44815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 142.0993 Da; putative annotation: N/A; putative formula: C8H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.201,"smiles":null,"spectrum_id":"CCMSLIB00017306795","spectrum_index":44816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 106.0784 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017306796","spectrum_index":44817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 165.0789 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.15,"smiles":null,"spectrum_id":"CCMSLIB00017306799","spectrum_index":44818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 63.9985 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.173,"smiles":null,"spectrum_id":"CCMSLIB00017306802","spectrum_index":44819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 118.0745 Da; putative annotation: N/A; putative formula: C4H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017306805","spectrum_index":44820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Tyr-Pro from NIST14 (delta mass: 97.0641 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.198,"smiles":null,"spectrum_id":"CCMSLIB00017306806","spectrum_index":44821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 164.105 Da; putative annotation: N/A; putative formula: C8H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.243,"smiles":null,"spectrum_id":"CCMSLIB00017306809","spectrum_index":44822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 364.9243 Da; putative annotation: N/A; putative formula: C12H3N3O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017306812","spectrum_index":44823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 51.0547 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.23,"smiles":null,"spectrum_id":"CCMSLIB00017306815","spectrum_index":44824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 131.0945 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.192,"smiles":null,"spectrum_id":"CCMSLIB00017306817","spectrum_index":44825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.071,"smiles":null,"spectrum_id":"CCMSLIB00017306819","spectrum_index":44826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 98.0842 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.181,"smiles":null,"spectrum_id":"CCMSLIB00017306822","spectrum_index":44827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 42.0649 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.108,"smiles":null,"spectrum_id":"CCMSLIB00017306825","spectrum_index":44828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-5-phenyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-one (delta mass: 27.9916 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.07,"smiles":null,"spectrum_id":"CCMSLIB00017306828","spectrum_index":44829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 12.0069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.151,"smiles":null,"spectrum_id":"CCMSLIB00017306830","spectrum_index":44830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(6,7-diethoxy(1,2,3,4-tetrahydroisoquinolyl))-6-methoxyphenol CollisionEnergy:102040\"\" (delta mass: 18.0138 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.199,"smiles":null,"spectrum_id":"CCMSLIB00017306832","spectrum_index":44831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 173.0424 Da; putative annotation: N/A; putative formula: C7H12NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.083,"smiles":null,"spectrum_id":"CCMSLIB00017306835","spectrum_index":44832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 133.0525 Da; putative annotation: 2,4-Dimethylnicotinic acid; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.139,"smiles":null,"spectrum_id":"CCMSLIB00017306838","spectrum_index":44833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 161.1197 Da; putative annotation: p-(Isoamyloxy)aniline; putative formula: C11H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.211,"smiles":null,"spectrum_id":"CCMSLIB00017306840","spectrum_index":44834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 97.0521 Da; putative annotation: L-Proline; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.123,"smiles":null,"spectrum_id":"CCMSLIB00017306842","spectrum_index":44835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 135.0323 Da; putative annotation: 3-Hydroxyanthranilic acid; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.108,"smiles":null,"spectrum_id":"CCMSLIB00017306845","spectrum_index":44836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 458.1427 Da; putative annotation: Physanguloside A; putative formula: C20H26O12)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.208,"smiles":null,"spectrum_id":"CCMSLIB00017306848","spectrum_index":44837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 156.0684 Da; putative annotation: (6-(Furan-2-yl)pyridin-3-yl)methanamine; putative formula: C10H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.144,"smiles":null,"spectrum_id":"CCMSLIB00017306850","spectrum_index":44838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptamine - 30.0 eV (delta mass: 99.0681 Da; putative annotation: 5-AMINOPENTANOATE - 40.0 eV; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.175,"smiles":null,"spectrum_id":"CCMSLIB00017306852","spectrum_index":44839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 184.1074 Da; putative annotation: 2-[5-(2-Hydroxypropyl)oxolan-2-yl]propanoic acid; putative formula: C10H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.23,"smiles":null,"spectrum_id":"CCMSLIB00017306855","spectrum_index":44840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 224.1055 Da; putative annotation: 3-(1-Hydroxybutyl)-1a,2,3,5,6,6a-hexahydrooxireno[2,3-f][2]benzofuran-2,6-diol; putative formula: C12H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.218,"smiles":null,"spectrum_id":"CCMSLIB00017306858","spectrum_index":44841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 134.1118 Da; putative annotation: Spectral Match to (1S,4R)-p-Mentha-2,8-dien-1-ol from METLIN; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.198,"smiles":null,"spectrum_id":"CCMSLIB00017306860","spectrum_index":44842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Formyltryptophan (delta mass: 186.1005 Da; putative annotation: Ser-Val; putative formula: C8H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.193,"smiles":null,"spectrum_id":"CCMSLIB00017306862","spectrum_index":44843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 56.034 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.121,"smiles":null,"spectrum_id":"CCMSLIB00017306865","spectrum_index":44844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 72.021 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017306868","spectrum_index":44845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 106.0627 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.212,"smiles":null,"spectrum_id":"CCMSLIB00017306870","spectrum_index":44846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 90.0314 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.18,"smiles":null,"spectrum_id":"CCMSLIB00017306872","spectrum_index":44847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 219.0894 Da; putative annotation: N/A; putative formula: C12H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.16,"smiles":null,"spectrum_id":"CCMSLIB00017306875","spectrum_index":44848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 113.039 Da; putative annotation: N/A; putative formula: C5H8NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.172,"smiles":null,"spectrum_id":"CCMSLIB00017306878","spectrum_index":44849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 155.1521 Da; putative annotation: N/A; putative formula: C7H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.212,"smiles":null,"spectrum_id":"CCMSLIB00017306880","spectrum_index":44850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 41.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017306883","spectrum_index":44851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 166.078 Da; putative annotation: N/A; putative formula: C13H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.202,"smiles":null,"spectrum_id":"CCMSLIB00017306885","spectrum_index":44852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 19.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.102,"smiles":null,"spectrum_id":"CCMSLIB00017306888","spectrum_index":44853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 279.1832 Da; putative annotation: N/A; putative formula: C16H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.264,"smiles":null,"spectrum_id":"CCMSLIB00017306891","spectrum_index":44854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 359.3036 Da; putative annotation: N/A; putative formula: C20H41NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.369,"smiles":null,"spectrum_id":"CCMSLIB00017306894","spectrum_index":44855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Methoxy-2,2-dimethyl-2,6-dihydro-pyrano[3,2-c]quinolin-5-one (delta mass: 19.0175 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.13,"smiles":null,"spectrum_id":"CCMSLIB00017306896","spectrum_index":44856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 132.0221 Da; putative annotation: N/A; putative formula: CH4N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.14,"smiles":null,"spectrum_id":"CCMSLIB00017306898","spectrum_index":44857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 157.1369 Da; putative annotation: N/A; putative formula: C9H20NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.202,"smiles":null,"spectrum_id":"CCMSLIB00017306901","spectrum_index":44858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G; AIF; CE0; CorrDec (delta mass: 55.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.117,"smiles":null,"spectrum_id":"CCMSLIB00017306904","spectrum_index":44859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000512 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 221.0897 Da; putative annotation: N/A; putative formula: C8H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.16,"smiles":null,"spectrum_id":"CCMSLIB00017306906","spectrum_index":44860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 386.044 Da; putative annotation: N/A; putative formula: C16H14N6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.104,"smiles":null,"spectrum_id":"CCMSLIB00017306908","spectrum_index":44861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 424.1329 Da; putative annotation: N/A; putative formula: C15H24N2O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.193,"smiles":null,"spectrum_id":"CCMSLIB00017306911","spectrum_index":44862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 302.1113 Da; putative annotation: N/A; putative formula: C12H18N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.208,"smiles":null,"spectrum_id":"CCMSLIB00017306914","spectrum_index":44863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacetic acid (delta mass: 12.0037 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.074,"smiles":null,"spectrum_id":"CCMSLIB00017306916","spectrum_index":44864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 121.0523 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.139,"smiles":null,"spectrum_id":"CCMSLIB00017306918","spectrum_index":44865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 188.0507 Da; putative annotation: N/A; putative formula: C8H12O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.111,"smiles":null,"spectrum_id":"CCMSLIB00017306921","spectrum_index":44866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 476.2075 Da; putative annotation: N/A; putative formula: C24H33N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.367,"smiles":null,"spectrum_id":"CCMSLIB00017306924","spectrum_index":44867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dichlorokynurenic acid (delta mass: 16.0949 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.067,"smiles":null,"spectrum_id":"CCMSLIB00017306926","spectrum_index":44868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 138.0536 Da; putative annotation: N/A; putative formula: C5H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.161,"smiles":null,"spectrum_id":"CCMSLIB00017306929","spectrum_index":44869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 280.0498 Da; putative annotation: N/A; putative formula: C16H4N6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.136,"smiles":null,"spectrum_id":"CCMSLIB00017306933","spectrum_index":44870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 991.5922 Da; putative annotation: N/A; putative formula: C59H81N3O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1154.65,"smiles":null,"spectrum_id":"CCMSLIB00017306934","spectrum_index":44871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 142.1409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.332,"smiles":null,"spectrum_id":"CCMSLIB00017306937","spectrum_index":44872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 85.9942 Da; putative annotation: N/A; putative formula: C2H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.081,"smiles":null,"spectrum_id":"CCMSLIB00017306940","spectrum_index":44873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 14.0266 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017306941","spectrum_index":44874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 134.0936 Da; putative annotation: N/A; putative formula: C2H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.169,"smiles":null,"spectrum_id":"CCMSLIB00017306944","spectrum_index":44875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 457.39 Da; putative annotation: N/A; putative formula: C26H47N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.519,"smiles":null,"spectrum_id":"CCMSLIB00017306947","spectrum_index":44876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 388.1265 Da; putative annotation: N/A; putative formula: C11H24N4O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.281,"smiles":null,"spectrum_id":"CCMSLIB00017306948","spectrum_index":44877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-uridine (delta mass: 410.102 Da; putative annotation: N/A; putative formula: C16H14N10O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.179,"smiles":null,"spectrum_id":"CCMSLIB00017306951","spectrum_index":44878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 74.0499 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.1,"smiles":null,"spectrum_id":"CCMSLIB00017306954","spectrum_index":44879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(4-nitrobenzyl)ethanamine (delta mass: 86.0455 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.164,"smiles":null,"spectrum_id":"CCMSLIB00017306955","spectrum_index":44880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 59.0367 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.206,"smiles":null,"spectrum_id":"CCMSLIB00017306958","spectrum_index":44881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 138.0681 Da; putative annotation: N/A; putative formula: C8H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017306961","spectrum_index":44882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 276.1502 Da; putative annotation: N/A; putative formula: C14H21N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.263,"smiles":null,"spectrum_id":"CCMSLIB00017306962","spectrum_index":44883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 68.0289 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.105,"smiles":null,"spectrum_id":"CCMSLIB00017306965","spectrum_index":44884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 407.1772 Da; putative annotation: N/A; putative formula: C14H29N7O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.326,"smiles":null,"spectrum_id":"CCMSLIB00017306968","spectrum_index":44885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTITOL (delta mass: 105.9457 Da; putative annotation: N/A; putative formula: CH-1O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.032,"smiles":null,"spectrum_id":"CCMSLIB00017306969","spectrum_index":44886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 71.9936 Da; putative annotation: N/A; putative formula: CN2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.085,"smiles":null,"spectrum_id":"CCMSLIB00017306972","spectrum_index":44887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 138.1399 Da; putative annotation: N/A; putative formula: C10H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.227,"smiles":null,"spectrum_id":"CCMSLIB00017306975","spectrum_index":44888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 39.0328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.181,"smiles":null,"spectrum_id":"CCMSLIB00017306976","spectrum_index":44889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 45.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.26,"smiles":null,"spectrum_id":"CCMSLIB00017306979","spectrum_index":44890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 2.0141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.06,"smiles":null,"spectrum_id":"CCMSLIB00017306982","spectrum_index":44891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 326.1157 Da; putative annotation: N/A; putative formula: C12H26N2O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.207,"smiles":null,"spectrum_id":"CCMSLIB00017306983","spectrum_index":44892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 45.0547 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.11,"smiles":null,"spectrum_id":"CCMSLIB00017306986","spectrum_index":44893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 371.1058 Da; putative annotation: N/A; putative formula: C25H13N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.229,"smiles":null,"spectrum_id":"CCMSLIB00017306989","spectrum_index":44894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylose (delta mass: 72.0341 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.094,"smiles":null,"spectrum_id":"CCMSLIB00017306990","spectrum_index":44895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 12.0028 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.09,"smiles":null,"spectrum_id":"CCMSLIB00017306993","spectrum_index":44896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-5-oxido-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-5-ium (delta mass: 55.0881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.389,"smiles":null,"spectrum_id":"CCMSLIB00017306996","spectrum_index":44897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 117.0149 Da; putative annotation: N/A; putative formula: C7H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.106,"smiles":null,"spectrum_id":"CCMSLIB00017306997","spectrum_index":44898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 8.9918 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.072,"smiles":null,"spectrum_id":"CCMSLIB00017307000","spectrum_index":44899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 111.0321 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.134,"smiles":null,"spectrum_id":"CCMSLIB00017307003","spectrum_index":44900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 181.0737 Da; putative annotation: N/A; putative formula: C9H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.144,"smiles":null,"spectrum_id":"CCMSLIB00017307004","spectrum_index":44901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 170.0766 Da; putative annotation: N/A; putative formula: C9H14OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.252,"smiles":null,"spectrum_id":"CCMSLIB00017307007","spectrum_index":44902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 209.1164 Da; putative annotation: N/A; putative formula: C10H15N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.213,"smiles":null,"spectrum_id":"CCMSLIB00017307009","spectrum_index":44903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 50.0156 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.086,"smiles":null,"spectrum_id":"CCMSLIB00017307011","spectrum_index":44904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-propanoic acid (delta mass: 302.1874 Da; putative annotation: N/A; putative formula: C13H27N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.274,"smiles":null,"spectrum_id":"CCMSLIB00017307014","spectrum_index":44905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N2-Trifluoroacetyl-L-glutamine (delta mass: 35.0284 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.087,"smiles":null,"spectrum_id":"CCMSLIB00017307015","spectrum_index":44906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 72.0642 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.118,"smiles":null,"spectrum_id":"CCMSLIB00017307018","spectrum_index":44907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 191.0796 Da; putative annotation: N/A; putative formula: C7H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.229,"smiles":null,"spectrum_id":"CCMSLIB00017307021","spectrum_index":44908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 97.0459 Da; putative annotation: N/A; putative formula: C5H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.137,"smiles":null,"spectrum_id":"CCMSLIB00017307022","spectrum_index":44909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 226.0291 Da; putative annotation: N/A; putative formula: C12H7N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.125,"smiles":null,"spectrum_id":"CCMSLIB00017307025","spectrum_index":44910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-indol-3-yl)-N-((1-methyl-1H-pyrrol-2-yl)methyl)ethanamine (delta mass: 76.0403 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.206,"smiles":null,"spectrum_id":"CCMSLIB00017307026","spectrum_index":44911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100147 Indole-3-acetaldehyde (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.086,"smiles":null,"spectrum_id":"CCMSLIB00017307029","spectrum_index":44912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 70.0416 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.305,"smiles":null,"spectrum_id":"CCMSLIB00017307032","spectrum_index":44913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 160.0487 Da; putative annotation: N/A; putative formula: C5H8N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.14,"smiles":null,"spectrum_id":"CCMSLIB00017307034","spectrum_index":44914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol (delta mass: 196.1449 Da; putative annotation: N/A; putative formula: C8H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.304,"smiles":null,"spectrum_id":"CCMSLIB00017307036","spectrum_index":44915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Desmethoxy-4-nitroomeprazole sulfone (delta mass: 354.0832 Da; putative annotation: N/A; putative formula: C30H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.175,"smiles":null,"spectrum_id":"CCMSLIB00017307039","spectrum_index":44916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 26.075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.167,"smiles":null,"spectrum_id":"CCMSLIB00017307042","spectrum_index":44917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 46.0384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.276,"smiles":null,"spectrum_id":"CCMSLIB00017307044","spectrum_index":44918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 54.0338 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.182,"smiles":null,"spectrum_id":"CCMSLIB00017307046","spectrum_index":44919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNITOL (delta mass: 126.083 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.169,"smiles":null,"spectrum_id":"CCMSLIB00017307049","spectrum_index":44920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 89.0796 Da; putative annotation: N/A; putative formula: H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.144,"smiles":null,"spectrum_id":"CCMSLIB00017307052","spectrum_index":44921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 44.0047 Da; putative annotation: N/A; putative formula: C5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.107,"smiles":null,"spectrum_id":"CCMSLIB00017307053","spectrum_index":44922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 487.2207 Da; putative annotation: N/A; putative formula: C26H33NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.307,"smiles":null,"spectrum_id":"CCMSLIB00017307056","spectrum_index":44923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 72.0067 Da; putative annotation: N/A; putative formula: N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.098,"smiles":null,"spectrum_id":"CCMSLIB00017307059","spectrum_index":44924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydro-10-phenophosphazinol 10-oxide (delta mass: 119.1984 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.251,"smiles":null,"spectrum_id":"CCMSLIB00017307062","spectrum_index":44925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 275.1415 Da; putative annotation: N/A; putative formula: C10H21N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.207,"smiles":null,"spectrum_id":"CCMSLIB00017307064","spectrum_index":44926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-9H-pyrido[2,3-b]indole (AalphaC) (delta mass: 23.9943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.081,"smiles":null,"spectrum_id":"CCMSLIB00017307066","spectrum_index":44927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 190.0742 Da; putative annotation: N/A; putative formula: C10H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.134,"smiles":null,"spectrum_id":"CCMSLIB00017307069","spectrum_index":44928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 485.6799 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.856,"smiles":null,"spectrum_id":"CCMSLIB00017307072","spectrum_index":44929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 1092.3824 Da; putative annotation: N/A; putative formula: C81H48N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1759.61,"smiles":null,"spectrum_id":"CCMSLIB00017307074","spectrum_index":44930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl Gramine (delta mass: 275.2891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.428,"smiles":null,"spectrum_id":"CCMSLIB00017307076","spectrum_index":44931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 40.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.15,"smiles":null,"spectrum_id":"CCMSLIB00017307079","spectrum_index":44932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 160.1209 Da; putative annotation: N/A; putative formula: C7H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.197,"smiles":null,"spectrum_id":"CCMSLIB00017307082","spectrum_index":44933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 66.0452 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.169,"smiles":null,"spectrum_id":"CCMSLIB00017307085","spectrum_index":44934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-3-indoleacetic acid (delta mass: 26.0127 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.099,"smiles":null,"spectrum_id":"CCMSLIB00017307086","spectrum_index":44935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 62.0093 Da; putative annotation: N/A; putative formula: H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.107,"smiles":null,"spectrum_id":"CCMSLIB00017307089","spectrum_index":44936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 47.0373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.16,"smiles":null,"spectrum_id":"CCMSLIB00017307091","spectrum_index":44937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 200.161 Da; putative annotation: N/A; putative formula: C5H16N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.29,"smiles":null,"spectrum_id":"CCMSLIB00017307094","spectrum_index":44938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU279501 5-Hydroxyindole-3-acetic acid|2-(5-hydroxy-1H-indol-3-yl)acetic acid (delta mass: 50.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017307096","spectrum_index":44939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-(1H-indol-3-yl)ethyl)thiourea (delta mass: 18.0559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.146,"smiles":null,"spectrum_id":"CCMSLIB00017307099","spectrum_index":44940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 51.0473 Da; putative annotation: N/A; putative formula: C4H5NO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.113,"smiles":null,"spectrum_id":"CCMSLIB00017307102","spectrum_index":44941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloro-4-fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 5.0012 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.034,"smiles":null,"spectrum_id":"CCMSLIB00017307104","spectrum_index":44942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 71.0556 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.143,"smiles":null,"spectrum_id":"CCMSLIB00017307107","spectrum_index":44943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE0; MS2Dec (delta mass: 60.0127 Da; putative annotation: N/A; putative formula: C2H5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.073,"smiles":null,"spectrum_id":"CCMSLIB00017307109","spectrum_index":44944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 211.1515 Da; putative annotation: N/A; putative formula: C11H21N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.254,"smiles":null,"spectrum_id":"CCMSLIB00017307112","spectrum_index":44945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 132.0444 Da; putative annotation: N/A; putative formula: C6H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.147,"smiles":null,"spectrum_id":"CCMSLIB00017307115","spectrum_index":44946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 39.0221 Da; putative annotation: N/A; putative formula: CHN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.103,"smiles":null,"spectrum_id":"CCMSLIB00017307118","spectrum_index":44947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrindole (delta mass: 247.0953 Da; putative annotation: N/A; putative formula: C12H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.297,"smiles":null,"spectrum_id":"CCMSLIB00017307119","spectrum_index":44948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 50.0154 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.122,"smiles":null,"spectrum_id":"CCMSLIB00017307122","spectrum_index":44949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 175.0809 Da; putative annotation: N/A; putative formula: C3H9N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.18,"smiles":null,"spectrum_id":"CCMSLIB00017307125","spectrum_index":44950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 244.0847 Da; putative annotation: N/A; putative formula: C13H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.16,"smiles":null,"spectrum_id":"CCMSLIB00017307128","spectrum_index":44951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoyl)-6,7-dimethoxy-N-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide (delta mass: 88.048 Da; putative annotation: N/A; putative formula: H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.271,"smiles":null,"spectrum_id":"CCMSLIB00017307131","spectrum_index":44952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 117.1404 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.222,"smiles":null,"spectrum_id":"CCMSLIB00017307132","spectrum_index":44953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 517.3373 Da; putative annotation: N/A; putative formula: C26H51N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.424,"smiles":null,"spectrum_id":"CCMSLIB00017307135","spectrum_index":44954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxy-2-oxo-1-pyrrolidinyl)acetamide (delta mass: 2.0157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.092,"smiles":null,"spectrum_id":"CCMSLIB00017307138","spectrum_index":44955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 685.7127 Da; putative annotation: N/A; putative formula: C47H91NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.826,"smiles":null,"spectrum_id":"CCMSLIB00017307140","spectrum_index":44956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 66.0583 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.129,"smiles":null,"spectrum_id":"CCMSLIB00017307142","spectrum_index":44957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 423.1638 Da; putative annotation: N/A; putative formula: C19H25N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.25,"smiles":null,"spectrum_id":"CCMSLIB00017307145","spectrum_index":44958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 44.0257 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.153,"smiles":null,"spectrum_id":"CCMSLIB00017307148","spectrum_index":44959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 255.1842 Da; putative annotation: N/A; putative formula: C14H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.26,"smiles":null,"spectrum_id":"CCMSLIB00017307151","spectrum_index":44960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 42.0108 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.087,"smiles":null,"spectrum_id":"CCMSLIB00017307153","spectrum_index":44961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[2-(3,4-dimethoxyphenyl)ethyl]-4-chlorobutanamide CollisionEnergy:205060\"\" (delta mass: 146.0696 Da; putative annotation: N/A; putative formula: C5H10N2O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.19,"smiles":null,"spectrum_id":"CCMSLIB00017307155","spectrum_index":44962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-hydroxypyrene (delta mass: 74.0269 Da; putative annotation: N/A; putative formula: C5H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.107,"smiles":null,"spectrum_id":"CCMSLIB00017307158","spectrum_index":44963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 18.009 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.116,"smiles":null,"spectrum_id":"CCMSLIB00017307161","spectrum_index":44964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 23.0011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.15,"smiles":null,"spectrum_id":"CCMSLIB00017307163","spectrum_index":44965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 447.1093 Da; putative annotation: N/A; putative formula: C25H9N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.196,"smiles":null,"spectrum_id":"CCMSLIB00017307165","spectrum_index":44966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 15.018 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.061,"smiles":null,"spectrum_id":"CCMSLIB00017307168","spectrum_index":44967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 45.0293 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017307171","spectrum_index":44968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 144.0895 Da; putative annotation: N/A; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.15,"smiles":null,"spectrum_id":"CCMSLIB00017307174","spectrum_index":44969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Isopropyl-1H-benzimidazole-2-thiol (delta mass: 64.0309 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.11,"smiles":null,"spectrum_id":"CCMSLIB00017307177","spectrum_index":44970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 107.0233 Da; putative annotation: N/A; putative formula: C3HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.13,"smiles":null,"spectrum_id":"CCMSLIB00017307179","spectrum_index":44971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 123.0057 Da; putative annotation: N/A; putative formula: C4HN3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.093,"smiles":null,"spectrum_id":"CCMSLIB00017307181","spectrum_index":44972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.113,"smiles":null,"spectrum_id":"CCMSLIB00017307184","spectrum_index":44973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 191.0942 Da; putative annotation: L-Tyrosine, ethyl ester; putative formula: C11H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.165,"smiles":null,"spectrum_id":"CCMSLIB00017307187","spectrum_index":44974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 136.1002 Da; putative annotation: 2-(Trimethyl-1H-pyrazol-4-yl)ethan-1-ol; putative formula: C8H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.165,"smiles":null,"spectrum_id":"CCMSLIB00017307190","spectrum_index":44975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 160.0373 Da; putative annotation: Gly-Cys; putative formula: C5H8N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.071,"smiles":null,"spectrum_id":"CCMSLIB00017307191","spectrum_index":44976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 163.0634 Da; putative annotation: 3-Hydroxyphenylalanine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.134,"smiles":null,"spectrum_id":"CCMSLIB00017307194","spectrum_index":44977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 126.1039 Da; putative annotation: 2-Ethyl-2-methylpentanoic acid; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.164,"smiles":null,"spectrum_id":"CCMSLIB00017307197","spectrum_index":44978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 121.0523 Da; putative annotation: 3-Amino-2,3-dihydrobenzoic acid; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017307199","spectrum_index":44979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 192.0418 Da; putative annotation: (2-Formyl-4-methoxyphenoxy)acetic acid; putative formula: C10H8O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.107,"smiles":null,"spectrum_id":"CCMSLIB00017307201","spectrum_index":44980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 71.036 Da; putative annotation: BETA-ALANINE; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.107,"smiles":null,"spectrum_id":"CCMSLIB00017307204","spectrum_index":44981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 119.0754 Da; putative annotation: PHENYLETHANOLAMINE; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.199,"smiles":null,"spectrum_id":"CCMSLIB00017307207","spectrum_index":44982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-6-ol, 1-(4-methoxyphenyl)-2-methyl-3-nitro- (delta mass: 172.0799 Da; putative annotation: N/A; putative formula: C12H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.182,"smiles":null,"spectrum_id":"CCMSLIB00017307210","spectrum_index":44983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 658.7534 Da; putative annotation: N/A; putative formula: C46H94N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.84,"smiles":null,"spectrum_id":"CCMSLIB00017307211","spectrum_index":44984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 265.2103 Da; putative annotation: N/A; putative formula: C11H23N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.302,"smiles":null,"spectrum_id":"CCMSLIB00017307214","spectrum_index":44985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 30.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.138,"smiles":null,"spectrum_id":"CCMSLIB00017307216","spectrum_index":44986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 368.1779 Da; putative annotation: N/A; putative formula: C19H32N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.353,"smiles":null,"spectrum_id":"CCMSLIB00017307219","spectrum_index":44987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 33.0077 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.131,"smiles":null,"spectrum_id":"CCMSLIB00017307222","spectrum_index":44988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 236.141 Da; putative annotation: N/A; putative formula: C14H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.264,"smiles":null,"spectrum_id":"CCMSLIB00017307224","spectrum_index":44989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 20.0 eV (delta mass: 108.0406 Da; putative annotation: N/A; putative formula: C7H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.132,"smiles":null,"spectrum_id":"CCMSLIB00017307226","spectrum_index":44990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 166.1132 Da; putative annotation: N/A; putative formula: C14H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.387,"smiles":null,"spectrum_id":"CCMSLIB00017307229","spectrum_index":44991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 240.2002 Da; putative annotation: N/A; putative formula: C15H29P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.235,"smiles":null,"spectrum_id":"CCMSLIB00017307231","spectrum_index":44992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 435.2018 Da; putative annotation: N/A; putative formula: C22H25N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.299,"smiles":null,"spectrum_id":"CCMSLIB00017307234","spectrum_index":44993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole; AIF; CE10; MS2Dec (delta mass: 74.0356 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.096,"smiles":null,"spectrum_id":"CCMSLIB00017307236","spectrum_index":44994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 97.0967 Da; putative annotation: N/A; putative formula: C5H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.183,"smiles":null,"spectrum_id":"CCMSLIB00017307239","spectrum_index":44995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 203.0793 Da; putative annotation: N/A; putative formula: C8H13NO5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.166,"smiles":null,"spectrum_id":"CCMSLIB00017307240","spectrum_index":44996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Trp (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.265,"smiles":null,"spectrum_id":"CCMSLIB00017307243","spectrum_index":44997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 24.0361 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.138,"smiles":null,"spectrum_id":"CCMSLIB00017307245","spectrum_index":44998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 172.0139 Da; putative annotation: N/A; putative formula: C6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.152,"smiles":null,"spectrum_id":"CCMSLIB00017307248","spectrum_index":44999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 39.9021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017307251","spectrum_index":45000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 91.0493 Da; putative annotation: N/A; putative formula: H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.12,"smiles":null,"spectrum_id":"CCMSLIB00017307253","spectrum_index":45001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 306.1218 Da; putative annotation: N/A; putative formula: C15H18N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.193,"smiles":null,"spectrum_id":"CCMSLIB00017307256","spectrum_index":45002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 88.1823 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.263,"smiles":null,"spectrum_id":"CCMSLIB00017307259","spectrum_index":45003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 60.0 eV (delta mass: 662.0509 Da; putative annotation: N/A; putative formula: C18H24N4O19P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":884.148,"smiles":null,"spectrum_id":"CCMSLIB00017307261","spectrum_index":45004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Butylurea (delta mass: 118.9696 Da; putative annotation: N/A; putative formula: C2H3NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.072,"smiles":null,"spectrum_id":"CCMSLIB00017307264","spectrum_index":45005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 103.0537 Da; putative annotation: N/A; putative formula: C6H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.145,"smiles":null,"spectrum_id":"CCMSLIB00017307267","spectrum_index":45006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 629.3408 Da; putative annotation: N/A; putative formula: C44H43N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.401,"smiles":null,"spectrum_id":"CCMSLIB00017307269","spectrum_index":45007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 29.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.154,"smiles":null,"spectrum_id":"CCMSLIB00017307272","spectrum_index":45008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Ala-Lys (delta mass: 55.0413 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.239,"smiles":null,"spectrum_id":"CCMSLIB00017307275","spectrum_index":45009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Catharanthine (delta mass: 35.9834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.174,"smiles":null,"spectrum_id":"CCMSLIB00017307277","spectrum_index":45010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 89.0506 Da; putative annotation: N/A; putative formula: C2H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.168,"smiles":null,"spectrum_id":"CCMSLIB00017307280","spectrum_index":45011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 71.0381 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.117,"smiles":null,"spectrum_id":"CCMSLIB00017307282","spectrum_index":45012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 151.2087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.295,"smiles":null,"spectrum_id":"CCMSLIB00017307285","spectrum_index":45013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 32.0116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.15,"smiles":null,"spectrum_id":"CCMSLIB00017307288","spectrum_index":45014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 74.054 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.24,"smiles":null,"spectrum_id":"CCMSLIB00017307291","spectrum_index":45015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 778.4476 Da; putative annotation: N/A; putative formula: C36H50N20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1105.58,"smiles":null,"spectrum_id":"CCMSLIB00017307293","spectrum_index":45016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 128.0464 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.17,"smiles":null,"spectrum_id":"CCMSLIB00017307296","spectrum_index":45017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 530.342 Da; putative annotation: N/A; putative formula: C34H47N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.433,"smiles":null,"spectrum_id":"CCMSLIB00017307298","spectrum_index":45018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 64.0309 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.075,"smiles":null,"spectrum_id":"CCMSLIB00017307301","spectrum_index":45019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 69.0797 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.128,"smiles":null,"spectrum_id":"CCMSLIB00017307304","spectrum_index":45020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 282.1365 Da; putative annotation: N/A; putative formula: C17H18N2O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.223,"smiles":null,"spectrum_id":"CCMSLIB00017307307","spectrum_index":45021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmalol (delta mass: 78.0315 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017307308","spectrum_index":45022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 108.0938 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.216,"smiles":null,"spectrum_id":"CCMSLIB00017307311","spectrum_index":45023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 130.0154 Da; putative annotation: N/A; putative formula: CH3N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.097,"smiles":null,"spectrum_id":"CCMSLIB00017307314","spectrum_index":45024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 208.2192 Da; putative annotation: N/A; putative formula: C15H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.301,"smiles":null,"spectrum_id":"CCMSLIB00017307317","spectrum_index":45025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 17.0339 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.076,"smiles":null,"spectrum_id":"CCMSLIB00017307319","spectrum_index":45026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 465.176 Da; putative annotation: N/A; putative formula: C22H23N7O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.273,"smiles":null,"spectrum_id":"CCMSLIB00017307321","spectrum_index":45027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 129.0623 Da; putative annotation: N/A; putative formula: C6H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.128,"smiles":null,"spectrum_id":"CCMSLIB00017307324","spectrum_index":45028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Linezolid (delta mass: 103.026 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.177,"smiles":null,"spectrum_id":"CCMSLIB00017307327","spectrum_index":45029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.165,"smiles":null,"spectrum_id":"CCMSLIB00017307329","spectrum_index":45030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 161.9957 Da; putative annotation: N/A; putative formula: C8H2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.071,"smiles":null,"spectrum_id":"CCMSLIB00017307331","spectrum_index":45031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 222.183 Da; putative annotation: N/A; putative formula: C12H22N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.243,"smiles":null,"spectrum_id":"CCMSLIB00017307334","spectrum_index":45032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 224.2127 Da; putative annotation: N/A; putative formula: C15H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.382,"smiles":null,"spectrum_id":"CCMSLIB00017307337","spectrum_index":45033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norisoboldine (delta mass: 124.0639 Da; putative annotation: N/A; putative formula: C6H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.203,"smiles":null,"spectrum_id":"CCMSLIB00017307339","spectrum_index":45034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 84.058 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.149,"smiles":null,"spectrum_id":"CCMSLIB00017307342","spectrum_index":45035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 55.0423 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.118,"smiles":null,"spectrum_id":"CCMSLIB00017307344","spectrum_index":45036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 126.0794 Da; putative annotation: N/A; putative formula: C6H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.192,"smiles":null,"spectrum_id":"CCMSLIB00017307347","spectrum_index":45037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aristolactam (delta mass: 15.0233 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.099,"smiles":null,"spectrum_id":"CCMSLIB00017307350","spectrum_index":45038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 288.1515 Da; putative annotation: N/A; putative formula: C21H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.272,"smiles":null,"spectrum_id":"CCMSLIB00017307353","spectrum_index":45039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 69.0554 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.194,"smiles":null,"spectrum_id":"CCMSLIB00017307356","spectrum_index":45040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 198.1627 Da; putative annotation: N/A; putative formula: C12H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.254,"smiles":null,"spectrum_id":"CCMSLIB00017307359","spectrum_index":45041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380158-01!2-[2-[2-[[2-[2-(2-hydroxypropanoylamino)-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoyl]oxypropanoylamino]-3-methylbutanoic acid (delta mass: 576.3372 Da; putative annotation: N/A; putative formula: C26H48N4O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1136.66,"smiles":null,"spectrum_id":"CCMSLIB00017307361","spectrum_index":45042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 352.0409 Da; putative annotation: N/A; putative formula: C12H20N2O2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.164,"smiles":null,"spectrum_id":"CCMSLIB00017307363","spectrum_index":45043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380167-01!3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015] (delta mass: 193.0956 Da; putative annotation: N/A; putative formula: C7H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.25,"smiles":null,"spectrum_id":"CCMSLIB00017307366","spectrum_index":45044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 423.2245 Da; putative annotation: N/A; putative formula: C26H35NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.326,"smiles":null,"spectrum_id":"CCMSLIB00017307369","spectrum_index":45045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GALACTOSAMINE (delta mass: 32.0031 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.09,"smiles":null,"spectrum_id":"CCMSLIB00017307372","spectrum_index":45046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 88.0407 Da; putative annotation: N/A; putative formula: C6H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.09,"smiles":null,"spectrum_id":"CCMSLIB00017307374","spectrum_index":45047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 87.0445 Da; putative annotation: N/A; putative formula: C2H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.146,"smiles":null,"spectrum_id":"CCMSLIB00017307377","spectrum_index":45048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 46.9898 Da; putative annotation: N/A; putative formula: H2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017307379","spectrum_index":45049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 96.0687 Da; putative annotation: N/A; putative formula: C5H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.15,"smiles":null,"spectrum_id":"CCMSLIB00017307382","spectrum_index":45050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001048999-01!1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole\"\" (delta mass: 17.034 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.141,"smiles":null,"spectrum_id":"CCMSLIB00017307385","spectrum_index":45051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 341.1514 Da; putative annotation: N/A; putative formula: C13H27NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.278,"smiles":null,"spectrum_id":"CCMSLIB00017307388","spectrum_index":45052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 684.2323 Da; putative annotation: N/A; putative formula: C19H52N12O-1P4S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.292,"smiles":null,"spectrum_id":"CCMSLIB00017307390","spectrum_index":45053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 36.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.097,"smiles":null,"spectrum_id":"CCMSLIB00017307392","spectrum_index":45054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 365.3076 Da; putative annotation: N/A; putative formula: C26H39N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.431,"smiles":null,"spectrum_id":"CCMSLIB00017307395","spectrum_index":45055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 92.0116 Da; putative annotation: N/A; putative formula: C2H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.119,"smiles":null,"spectrum_id":"CCMSLIB00017307398","spectrum_index":45056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 89.0283 Da; putative annotation: N/A; putative formula: C3H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.066,"smiles":null,"spectrum_id":"CCMSLIB00017307401","spectrum_index":45057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 142.0962 Da; putative annotation: N/A; putative formula: C4H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.187,"smiles":null,"spectrum_id":"CCMSLIB00017307404","spectrum_index":45058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 164.0828 Da; putative annotation: N/A; putative formula: C4H13N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.127,"smiles":null,"spectrum_id":"CCMSLIB00017307406","spectrum_index":45059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 120.9181 Da; putative annotation: N/A; putative formula: CNPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.02,"smiles":null,"spectrum_id":"CCMSLIB00017307408","spectrum_index":45060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 124.1102 Da; putative annotation: N/A; putative formula: C6H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.197,"smiles":null,"spectrum_id":"CCMSLIB00017307411","spectrum_index":45061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 111.0472 Da; putative annotation: N/A; putative formula: C9H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017307414","spectrum_index":45062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 127.0692 Da; putative annotation: N/A; putative formula: CH5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.112,"smiles":null,"spectrum_id":"CCMSLIB00017307417","spectrum_index":45063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carbaldehyde (delta mass: 132.0417 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.097,"smiles":null,"spectrum_id":"CCMSLIB00017307419","spectrum_index":45064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 114.0673 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.216,"smiles":null,"spectrum_id":"CCMSLIB00017307421","spectrum_index":45065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 205.0208 Da; putative annotation: N/A; putative formula: C3H-1N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.123,"smiles":null,"spectrum_id":"CCMSLIB00017307424","spectrum_index":45066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 212.3892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.554,"smiles":null,"spectrum_id":"CCMSLIB00017307427","spectrum_index":45067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 313.1824 Da; putative annotation: N/A; putative formula: C15H27N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.285,"smiles":null,"spectrum_id":"CCMSLIB00017307430","spectrum_index":45068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 689.3271 Da; putative annotation: N/A; putative formula: C33H47N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.398,"smiles":null,"spectrum_id":"CCMSLIB00017307431","spectrum_index":45069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 14.0127 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.141,"smiles":null,"spectrum_id":"CCMSLIB00017307434","spectrum_index":45070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 88.0502 Da; putative annotation: N/A; putative formula: H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.141,"smiles":null,"spectrum_id":"CCMSLIB00017307437","spectrum_index":45071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 601.3118 Da; putative annotation: N/A; putative formula: C33H44N7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.461,"smiles":null,"spectrum_id":"CCMSLIB00017307440","spectrum_index":45072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 543.2518 Da; putative annotation: N/A; putative formula: C28H49NO-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.406,"smiles":null,"spectrum_id":"CCMSLIB00017307442","spectrum_index":45073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 958.6615 Da; putative annotation: N/A; putative formula: C54H86N8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1180.76,"smiles":null,"spectrum_id":"CCMSLIB00017307445","spectrum_index":45074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Val (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.239,"smiles":null,"spectrum_id":"CCMSLIB00017307447","spectrum_index":45075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Panowamycin B (delta mass: 82.0418 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.237,"smiles":null,"spectrum_id":"CCMSLIB00017307450","spectrum_index":45076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 87.0471 Da; putative annotation: N/A; putative formula: C7H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.123,"smiles":null,"spectrum_id":"CCMSLIB00017307453","spectrum_index":45077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mitoridine (delta mass: 354.1957 Da; putative annotation: N/A; putative formula: C22H22N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.371,"smiles":null,"spectrum_id":"CCMSLIB00017307456","spectrum_index":45078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Terbutaline (delta mass: 64.0159 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017307457","spectrum_index":45079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 40.0567 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.164,"smiles":null,"spectrum_id":"CCMSLIB00017307460","spectrum_index":45080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 550.2541 Da; putative annotation: N/A; putative formula: C36H38O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.351,"smiles":null,"spectrum_id":"CCMSLIB00017307463","spectrum_index":45081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 57.9543 Da; putative annotation: N/A; putative formula: CO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.078,"smiles":null,"spectrum_id":"CCMSLIB00017307466","spectrum_index":45082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-hydroxy-2-methylindole-3-carboxylic acid CollisionEnergy:205060 (delta mass: 29.9928 Da; putative annotation: N/A; putative formula: CH2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.058,"smiles":null,"spectrum_id":"CCMSLIB00017307467","spectrum_index":45083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 141.0577 Da; putative annotation: N/A; putative formula: C10H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017307470","spectrum_index":45084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 60.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.191,"smiles":null,"spectrum_id":"CCMSLIB00017307473","spectrum_index":45085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 768.424 Da; putative annotation: N/A; putative formula: C32H56N12O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":961.495,"smiles":null,"spectrum_id":"CCMSLIB00017307476","spectrum_index":45086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 394.2583 Da; putative annotation: N/A; putative formula: C20H34N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.329,"smiles":null,"spectrum_id":"CCMSLIB00017307478","spectrum_index":45087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 477.336 Da; putative annotation: N/A; putative formula: C23H43N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.396,"smiles":null,"spectrum_id":"CCMSLIB00017307480","spectrum_index":45088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 545.2534 Da; putative annotation: N/A; putative formula: C32H39N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.34,"smiles":null,"spectrum_id":"CCMSLIB00017307483","spectrum_index":45089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of UNII-UGT5535REQ (delta mass: 32.0341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.149,"smiles":null,"spectrum_id":"CCMSLIB00017307486","spectrum_index":45090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[3-(2-Carboxyethyl)-4-methylpyrrol-2-methylidenyl]-2-indolinone (delta mass: 63.0205 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.144,"smiles":null,"spectrum_id":"CCMSLIB00017307488","spectrum_index":45091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-[4-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triaz ol-3-ylthio]acetamide CollisionEnergy:102040\"\" (delta mass: 17.029 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.147,"smiles":null,"spectrum_id":"CCMSLIB00017307491","spectrum_index":45092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385672-01!(E)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)hept-4-en-3-one (delta mass: 122.0555 Da; putative annotation: N/A; putative formula: C8H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.199,"smiles":null,"spectrum_id":"CCMSLIB00017307493","spectrum_index":45093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 919.8628 Da; putative annotation: N/A; putative formula: C57H113N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1073.95,"smiles":null,"spectrum_id":"CCMSLIB00017307496","spectrum_index":45094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 62.0154 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.123,"smiles":null,"spectrum_id":"CCMSLIB00017307499","spectrum_index":45095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 376.245 Da; putative annotation: N/A; putative formula: C23H38P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.399,"smiles":null,"spectrum_id":"CCMSLIB00017307501","spectrum_index":45096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine (delta mass: 488.1756 Da; putative annotation: N/A; putative formula: C19H28N4O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.44,"smiles":null,"spectrum_id":"CCMSLIB00017307503","spectrum_index":45097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 89.9944 Da; putative annotation: N/A; putative formula: C2H2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.037,"smiles":null,"spectrum_id":"CCMSLIB00017307506","spectrum_index":45098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 631.1973 Da; putative annotation: N/A; putative formula: C24H33N5O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.273,"smiles":null,"spectrum_id":"CCMSLIB00017307509","spectrum_index":45099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 129.1016 Da; putative annotation: N/A; putative formula: C4H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.287,"smiles":null,"spectrum_id":"CCMSLIB00017307511","spectrum_index":45100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 90.0876 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.33,"smiles":null,"spectrum_id":"CCMSLIB00017307514","spectrum_index":45101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 23.0163 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.076,"smiles":null,"spectrum_id":"CCMSLIB00017307516","spectrum_index":45102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-formyl-5,6-dimethoxy-1H-indole-2-carboxylate (delta mass: 57.0247 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.111,"smiles":null,"spectrum_id":"CCMSLIB00017307519","spectrum_index":45103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 260.1702 Da; putative annotation: N/A; putative formula: C8H20N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.324,"smiles":null,"spectrum_id":"CCMSLIB00017307522","spectrum_index":45104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 615.2721 Da; putative annotation: N/A; putative formula: C35H29N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.437,"smiles":null,"spectrum_id":"CCMSLIB00017307525","spectrum_index":45105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 190.1392 Da; putative annotation: N/A; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.22,"smiles":null,"spectrum_id":"CCMSLIB00017307528","spectrum_index":45106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hypaphorine (delta mass: 125.0952 Da; putative annotation: N/A; putative formula: C6H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.239,"smiles":null,"spectrum_id":"CCMSLIB00017307530","spectrum_index":45107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006044 Indole-3-acetonitrile|2-(1H-indol-3-yl)acetonitrile (delta mass: 117.0661 Da; putative annotation: N/A; putative formula: C2H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.142,"smiles":null,"spectrum_id":"CCMSLIB00017307532","spectrum_index":45108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Guadiscidine (delta mass: 12.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.148,"smiles":null,"spectrum_id":"CCMSLIB00017307535","spectrum_index":45109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 198.0884 Da; putative annotation: N/A; putative formula: C10H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.201,"smiles":null,"spectrum_id":"CCMSLIB00017307538","spectrum_index":45110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 189.9778 Da; putative annotation: N/A; putative formula: C4H3N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.02,"smiles":null,"spectrum_id":"CCMSLIB00017307540","spectrum_index":45111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 46.4196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017307542","spectrum_index":45112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 10.0197 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.122,"smiles":null,"spectrum_id":"CCMSLIB00017307545","spectrum_index":45113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophan ethyl ester (delta mass: 238.2295 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.358,"smiles":null,"spectrum_id":"CCMSLIB00017307548","spectrum_index":45114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 114.0107 Da; putative annotation: N/A; putative formula: C8H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.091,"smiles":null,"spectrum_id":"CCMSLIB00017307551","spectrum_index":45115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GLUCOSAMINE (delta mass: 266.2606 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.347,"smiles":null,"spectrum_id":"CCMSLIB00017307553","spectrum_index":45116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 131.298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.378,"smiles":null,"spectrum_id":"CCMSLIB00017307555","spectrum_index":45117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 345.1906 Da; putative annotation: N/A; putative formula: C16H31N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.287,"smiles":null,"spectrum_id":"CCMSLIB00017307558","spectrum_index":45118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-TYROSINE - 20.0 eV (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.092,"smiles":null,"spectrum_id":"CCMSLIB00017307561","spectrum_index":45119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 109.0624 Da; putative annotation: N/A; putative formula: C5H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.149,"smiles":null,"spectrum_id":"CCMSLIB00017307563","spectrum_index":45120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 271.1062 Da; putative annotation: N/A; putative formula: C13H21NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.177,"smiles":null,"spectrum_id":"CCMSLIB00017307566","spectrum_index":45121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 43.0113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.103,"smiles":null,"spectrum_id":"CCMSLIB00017307568","spectrum_index":45122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 354.1243 Da; putative annotation: N/A; putative formula: C18H27OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.221,"smiles":null,"spectrum_id":"CCMSLIB00017307571","spectrum_index":45123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 59.1951 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.298,"smiles":null,"spectrum_id":"CCMSLIB00017307574","spectrum_index":45124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017307576","spectrum_index":45125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 138.0312 Da; putative annotation: 2-(Hydroxymethyl)-5-methoxy-4H-pyran-4-one; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.117,"smiles":null,"spectrum_id":"CCMSLIB00017307579","spectrum_index":45126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Pro-Lys from NIST14 (delta mass: 243.1225 Da; putative annotation: Lys-Asp; putative formula: C10H17N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.357,"smiles":null,"spectrum_id":"CCMSLIB00017307582","spectrum_index":45127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 147.0684 Da; putative annotation: L-phenylalanine CollisionEnergy:102040; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.129,"smiles":null,"spectrum_id":"CCMSLIB00017307585","spectrum_index":45128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-2-ol (delta mass: 120.112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.172,"smiles":null,"spectrum_id":"CCMSLIB00017307587","spectrum_index":45129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 138.0465 Da; putative annotation: N/A; putative formula: C11H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.17,"smiles":null,"spectrum_id":"CCMSLIB00017307590","spectrum_index":45130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 77.0267 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017307593","spectrum_index":45131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 138.0525 Da; putative annotation: N/A; putative formula: CH2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.186,"smiles":null,"spectrum_id":"CCMSLIB00017307596","spectrum_index":45132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 204.1832 Da; putative annotation: N/A; putative formula: C6H20N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.28,"smiles":null,"spectrum_id":"CCMSLIB00017307598","spectrum_index":45133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 193.0661 Da; putative annotation: N/A; putative formula: C10H12NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.21,"smiles":null,"spectrum_id":"CCMSLIB00017307600","spectrum_index":45134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ACETYL ARGININE - 40.0 eV (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.198,"smiles":null,"spectrum_id":"CCMSLIB00017307604","spectrum_index":45135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 17.8529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.917,"smiles":null,"spectrum_id":"CCMSLIB00017307606","spectrum_index":45136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 705.3928 Da; putative annotation: N/A; putative formula: C47H51N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.464,"smiles":null,"spectrum_id":"CCMSLIB00017307609","spectrum_index":45137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 108.0664 Da; putative annotation: N/A; putative formula: C6H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.107,"smiles":null,"spectrum_id":"CCMSLIB00017307612","spectrum_index":45138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Difluoromethoxy)-1H-indole-2-carboxylic acid (delta mass: 266.3483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.395,"smiles":null,"spectrum_id":"CCMSLIB00017307615","spectrum_index":45139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017307617","spectrum_index":45140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 194.1311 Da; putative annotation: N/A; putative formula: C12H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.207,"smiles":null,"spectrum_id":"CCMSLIB00017307620","spectrum_index":45141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 560.4056 Da; putative annotation: N/A; putative formula: C31H56N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.497,"smiles":null,"spectrum_id":"CCMSLIB00017307623","spectrum_index":45142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 22.5608 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.626,"smiles":null,"spectrum_id":"CCMSLIB00017307625","spectrum_index":45143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 116.9287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.009,"smiles":null,"spectrum_id":"CCMSLIB00017307628","spectrum_index":45144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 296.1507 Da; putative annotation: N/A; putative formula: C11H25N2O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.295,"smiles":null,"spectrum_id":"CCMSLIB00017307631","spectrum_index":45145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 307.1481 Da; putative annotation: N/A; putative formula: C14H23N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.23,"smiles":null,"spectrum_id":"CCMSLIB00017307634","spectrum_index":45146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 267.2845 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.319,"smiles":null,"spectrum_id":"CCMSLIB00017307635","spectrum_index":45147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169735-02!(5S)-5-hydroxy-1,7-diphenylheptan-3-one (delta mass: 110.0798 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.249,"smiles":null,"spectrum_id":"CCMSLIB00017307638","spectrum_index":45148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 130.0629 Da; putative annotation: N/A; putative formula: C6H10O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.181,"smiles":null,"spectrum_id":"CCMSLIB00017307641","spectrum_index":45149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 46.057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.181,"smiles":null,"spectrum_id":"CCMSLIB00017307644","spectrum_index":45150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 80.0284 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.072,"smiles":null,"spectrum_id":"CCMSLIB00017307646","spectrum_index":45151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 70.0035 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.063,"smiles":null,"spectrum_id":"CCMSLIB00017307648","spectrum_index":45152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 224.1455 Da; putative annotation: N/A; putative formula: C11H20N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.201,"smiles":null,"spectrum_id":"CCMSLIB00017307651","spectrum_index":45153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 78.9643 Da; putative annotation: N/A; putative formula: H2NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.045,"smiles":null,"spectrum_id":"CCMSLIB00017307654","spectrum_index":45154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 340.0213 Da; putative annotation: N/A; putative formula: C12H21OPS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.108,"smiles":null,"spectrum_id":"CCMSLIB00017307656","spectrum_index":45155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 123.0446 Da; putative annotation: N/A; putative formula: C5H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.141,"smiles":null,"spectrum_id":"CCMSLIB00017307658","spectrum_index":45156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 209.997 Da; putative annotation: N/A; putative formula: C13H6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.12,"smiles":null,"spectrum_id":"CCMSLIB00017307661","spectrum_index":45157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 100.0674 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.117,"smiles":null,"spectrum_id":"CCMSLIB00017307664","spectrum_index":45158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 632.383 Da; putative annotation: N/A; putative formula: C39H56N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.516,"smiles":null,"spectrum_id":"CCMSLIB00017307666","spectrum_index":45159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 122.0517 Da; putative annotation: N/A; putative formula: C11H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.112,"smiles":null,"spectrum_id":"CCMSLIB00017307669","spectrum_index":45160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 207.0488 Da; putative annotation: N/A; putative formula: C5H9N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.09,"smiles":null,"spectrum_id":"CCMSLIB00017307671","spectrum_index":45161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-BUTYRIC ACID (delta mass: 119.037 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.139,"smiles":null,"spectrum_id":"CCMSLIB00017307674","spectrum_index":45162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 28.9481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.097,"smiles":null,"spectrum_id":"CCMSLIB00017307677","spectrum_index":45163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 74.0575 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.227,"smiles":null,"spectrum_id":"CCMSLIB00017307680","spectrum_index":45164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 188.0942 Da; putative annotation: N/A; putative formula: C11H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017307682","spectrum_index":45165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 90.0476 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.197,"smiles":null,"spectrum_id":"CCMSLIB00017307684","spectrum_index":45166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 931.7724 Da; putative annotation: N/A; putative formula: C56H93N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1153.87,"smiles":null,"spectrum_id":"CCMSLIB00017307687","spectrum_index":45167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 280.0904 Da; putative annotation: N/A; putative formula: C9H16N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.151,"smiles":null,"spectrum_id":"CCMSLIB00017307690","spectrum_index":45168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 86.0525 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.16,"smiles":null,"spectrum_id":"CCMSLIB00017307692","spectrum_index":45169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Ala (delta mass: 17.9395 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.027,"smiles":null,"spectrum_id":"CCMSLIB00017307695","spectrum_index":45170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017307698","spectrum_index":45171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 154.1142 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.229,"smiles":null,"spectrum_id":"CCMSLIB00017307701","spectrum_index":45172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 162.0829 Da; putative annotation: N/A; putative formula: C6H14N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.227,"smiles":null,"spectrum_id":"CCMSLIB00017307704","spectrum_index":45173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Glu (delta mass: 111.0312 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.16,"smiles":null,"spectrum_id":"CCMSLIB00017307707","spectrum_index":45174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 396.1282 Da; putative annotation: N/A; putative formula: C16H20N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.19,"smiles":null,"spectrum_id":"CCMSLIB00017307708","spectrum_index":45175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 87.0326 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.203,"smiles":null,"spectrum_id":"CCMSLIB00017307711","spectrum_index":45176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptoline CollisionEnergy:102040 (delta mass: 164.0927 Da; putative annotation: N/A; putative formula: C5H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.2,"smiles":null,"spectrum_id":"CCMSLIB00017307714","spectrum_index":45177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE-3-ACETIC ACID (delta mass: 158.131 Da; putative annotation: N/A; putative formula: C9H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.197,"smiles":null,"spectrum_id":"CCMSLIB00017307717","spectrum_index":45178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 90.051 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.111,"smiles":null,"spectrum_id":"CCMSLIB00017307719","spectrum_index":45179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 36.0365 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.16,"smiles":null,"spectrum_id":"CCMSLIB00017307722","spectrum_index":45180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 162.0612 Da; putative annotation: N/A; putative formula: C9H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.176,"smiles":null,"spectrum_id":"CCMSLIB00017307724","spectrum_index":45181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 70.0 eV (delta mass: 36.9136 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.0,"smiles":null,"spectrum_id":"CCMSLIB00017307727","spectrum_index":45182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 490.9705 Da; putative annotation: N/A; putative formula: C15H9N9O3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.068,"smiles":null,"spectrum_id":"CCMSLIB00017307730","spectrum_index":45183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 159.0998 Da; putative annotation: N/A; putative formula: C6H13N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.159,"smiles":null,"spectrum_id":"CCMSLIB00017307732","spectrum_index":45184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300242 Isorhynchophylline (delta mass: 197.1132 Da; putative annotation: N/A; putative formula: C5H11N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.325,"smiles":null,"spectrum_id":"CCMSLIB00017307735","spectrum_index":45185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol Hydrochloride (delta mass: 161.9603 Da; putative annotation: N/A; putative formula: C8H2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.047,"smiles":null,"spectrum_id":"CCMSLIB00017307738","spectrum_index":45186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 120.0681 Da; putative annotation: N/A; putative formula: C7H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.139,"smiles":null,"spectrum_id":"CCMSLIB00017307741","spectrum_index":45187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 55.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.128,"smiles":null,"spectrum_id":"CCMSLIB00017307743","spectrum_index":45188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 39.0745 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.15,"smiles":null,"spectrum_id":"CCMSLIB00017307746","spectrum_index":45189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 162.0443 Da; putative annotation: N/A; putative formula: C5H10N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.156,"smiles":null,"spectrum_id":"CCMSLIB00017307749","spectrum_index":45190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 403.1922 Da; putative annotation: N/A; putative formula: C23H26N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.268,"smiles":null,"spectrum_id":"CCMSLIB00017307752","spectrum_index":45191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 171.0641 Da; putative annotation: N/A; putative formula: C6H9N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.166,"smiles":null,"spectrum_id":"CCMSLIB00017307755","spectrum_index":45192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 70.0431 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.181,"smiles":null,"spectrum_id":"CCMSLIB00017307757","spectrum_index":45193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 172.0096 Da; putative annotation: N/A; putative formula: C9H4N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.08,"smiles":null,"spectrum_id":"CCMSLIB00017307760","spectrum_index":45194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 72.0212 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017307763","spectrum_index":45195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 304.1487 Da; putative annotation: N/A; putative formula: C7H12N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.272,"smiles":null,"spectrum_id":"CCMSLIB00017307766","spectrum_index":45196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 259.2512 Da; putative annotation: N/A; putative formula: C11H29N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.363,"smiles":null,"spectrum_id":"CCMSLIB00017307768","spectrum_index":45197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 99.0748 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.304,"smiles":null,"spectrum_id":"CCMSLIB00017307771","spectrum_index":45198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 202.0642 Da; putative annotation: N/A; putative formula: C12H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.156,"smiles":null,"spectrum_id":"CCMSLIB00017307773","spectrum_index":45199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 61.9461 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.058,"smiles":null,"spectrum_id":"CCMSLIB00017307776","spectrum_index":45200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 139.0384 Da; putative annotation: N/A; putative formula: C5H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.119,"smiles":null,"spectrum_id":"CCMSLIB00017307779","spectrum_index":45201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 60.0132 Da; putative annotation: N/A; putative formula: C2H5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.152,"smiles":null,"spectrum_id":"CCMSLIB00017307782","spectrum_index":45202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 80.0263 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017307783","spectrum_index":45203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactose 1-phosphate - 30.0 eV (delta mass: 684.2325 Da; putative annotation: N/A; putative formula: C24H44O22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.269,"smiles":null,"spectrum_id":"CCMSLIB00017307786","spectrum_index":45204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyltapentadol (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.196,"smiles":null,"spectrum_id":"CCMSLIB00017307789","spectrum_index":45205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 265.3019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.383,"smiles":null,"spectrum_id":"CCMSLIB00017307792","spectrum_index":45206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 293.0715 Da; putative annotation: N/A; putative formula: C16H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.153,"smiles":null,"spectrum_id":"CCMSLIB00017307794","spectrum_index":45207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 85.0521 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.159,"smiles":null,"spectrum_id":"CCMSLIB00017307796","spectrum_index":45208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 45.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.212,"smiles":null,"spectrum_id":"CCMSLIB00017307799","spectrum_index":45209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 65.0689 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.16,"smiles":null,"spectrum_id":"CCMSLIB00017307802","spectrum_index":45210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 666.2191 Da; putative annotation: N/A; putative formula: C30H39N2O13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1009.34,"smiles":null,"spectrum_id":"CCMSLIB00017307804","spectrum_index":45211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 171.9966 Da; putative annotation: N/A; putative formula: C4H5N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.094,"smiles":null,"spectrum_id":"CCMSLIB00017307807","spectrum_index":45212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 113.124 Da; putative annotation: N/A; putative formula: C7H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.14,"smiles":null,"spectrum_id":"CCMSLIB00017307810","spectrum_index":45213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 251.1012 Da; putative annotation: N/A; putative formula: C10H21NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.225,"smiles":null,"spectrum_id":"CCMSLIB00017307812","spectrum_index":45214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 297.1911 Da; putative annotation: N/A; putative formula: C12H23N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.223,"smiles":null,"spectrum_id":"CCMSLIB00017307814","spectrum_index":45215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 112.0496 Da; putative annotation: N/A; putative formula: C2H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.188,"smiles":null,"spectrum_id":"CCMSLIB00017307817","spectrum_index":45216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 64.0566 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.18,"smiles":null,"spectrum_id":"CCMSLIB00017307820","spectrum_index":45217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 308.117 Da; putative annotation: N/A; putative formula: C11H16N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.24,"smiles":null,"spectrum_id":"CCMSLIB00017307823","spectrum_index":45218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 57.0214 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.171,"smiles":null,"spectrum_id":"CCMSLIB00017307825","spectrum_index":45219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 98.1206 Da; putative annotation: N/A; putative formula: C6H14N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.228,"smiles":null,"spectrum_id":"CCMSLIB00017307827","spectrum_index":45220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 1028.7553 Da; putative annotation: N/A; putative formula: C63H96N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1533.93,"smiles":null,"spectrum_id":"CCMSLIB00017307830","spectrum_index":45221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 229.1904 Da; putative annotation: N/A; putative formula: C10H23N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.277,"smiles":null,"spectrum_id":"CCMSLIB00017307833","spectrum_index":45222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 84.0292 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.127,"smiles":null,"spectrum_id":"CCMSLIB00017307834","spectrum_index":45223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)(3-fluorophenyl)amine (delta mass: 17.0391 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.169,"smiles":null,"spectrum_id":"CCMSLIB00017307837","spectrum_index":45224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 116.1205 Da; putative annotation: N/A; putative formula: C3H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.18,"smiles":null,"spectrum_id":"CCMSLIB00017307840","spectrum_index":45225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 27.0222 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.103,"smiles":null,"spectrum_id":"CCMSLIB00017307843","spectrum_index":45226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 288.2457 Da; putative annotation: N/A; putative formula: C20H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.337,"smiles":null,"spectrum_id":"CCMSLIB00017307845","spectrum_index":45227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 76.0374 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.124,"smiles":null,"spectrum_id":"CCMSLIB00017307847","spectrum_index":45228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 76.0313 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.118,"smiles":null,"spectrum_id":"CCMSLIB00017307850","spectrum_index":45229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 63.0473 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017307853","spectrum_index":45230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 144.0305 Da; putative annotation: N/A; putative formula: C4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.112,"smiles":null,"spectrum_id":"CCMSLIB00017307855","spectrum_index":45231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 428.2486 Da; putative annotation: N/A; putative formula: C16H36N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.387,"smiles":null,"spectrum_id":"CCMSLIB00017307858","spectrum_index":45232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 158.0369 Da; putative annotation: N/A; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.108,"smiles":null,"spectrum_id":"CCMSLIB00017307861","spectrum_index":45233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 151.0975 Da; putative annotation: N/A; putative formula: C5H9N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.246,"smiles":null,"spectrum_id":"CCMSLIB00017307864","spectrum_index":45234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 188.1416 Da; putative annotation: N/A; putative formula: C10H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.264,"smiles":null,"spectrum_id":"CCMSLIB00017307867","spectrum_index":45235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Phe (delta mass: 57.0212 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.191,"smiles":null,"spectrum_id":"CCMSLIB00017307869","spectrum_index":45236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine (delta mass: 61.0202 Da; putative annotation: N/A; putative formula: H4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017307872","spectrum_index":45237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 96.0329 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.033,"smiles":null,"spectrum_id":"CCMSLIB00017307874","spectrum_index":45238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Acetyloxy)-2-naphthoic acid (delta mass: 36.0199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.085,"smiles":null,"spectrum_id":"CCMSLIB00017307877","spectrum_index":45239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311112 Caffeoyl putrescin (isomer of 1059) (delta mass: 79.9575 Da; putative annotation: N/A; putative formula: H2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.096,"smiles":null,"spectrum_id":"CCMSLIB00017307880","spectrum_index":45240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 30.0981 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.222,"smiles":null,"spectrum_id":"CCMSLIB00017307883","spectrum_index":45241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 310.0709 Da; putative annotation: N/A; putative formula: C15H20OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.194,"smiles":null,"spectrum_id":"CCMSLIB00017307884","spectrum_index":45242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 12.0076 Da; putative annotation: N/A; putative formula: N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.116,"smiles":null,"spectrum_id":"CCMSLIB00017307889","spectrum_index":45243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.07,"smiles":null,"spectrum_id":"CCMSLIB00017307890","spectrum_index":45244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 304.08 Da; putative annotation: N/A; putative formula: C15H17N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.156,"smiles":null,"spectrum_id":"CCMSLIB00017307893","spectrum_index":45245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 108.0942 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.316,"smiles":null,"spectrum_id":"CCMSLIB00017307896","spectrum_index":45246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 265.1319 Da; putative annotation: N/A; putative formula: C15H23NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.255,"smiles":null,"spectrum_id":"CCMSLIB00017307897","spectrum_index":45247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 579.5092 Da; putative annotation: N/A; putative formula: C33H65N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1188.78,"smiles":null,"spectrum_id":"CCMSLIB00017307900","spectrum_index":45248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 109.0406 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.101,"smiles":null,"spectrum_id":"CCMSLIB00017307903","spectrum_index":45249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 102.9913 Da; putative annotation: N/A; putative formula: C3H5NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.073,"smiles":null,"spectrum_id":"CCMSLIB00017307906","spectrum_index":45250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 70.0 eV (delta mass: 23.8808 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.967,"smiles":null,"spectrum_id":"CCMSLIB00017307908","spectrum_index":45251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 40.0314 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.112,"smiles":null,"spectrum_id":"CCMSLIB00017307910","spectrum_index":45252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridylamidoxime (delta mass: 24.0077 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.074,"smiles":null,"spectrum_id":"CCMSLIB00017307913","spectrum_index":45253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 46.0169 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.113,"smiles":null,"spectrum_id":"CCMSLIB00017307916","spectrum_index":45254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 81.9919 Da; putative annotation: N/A; putative formula: CH-2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.027,"smiles":null,"spectrum_id":"CCMSLIB00017307918","spectrum_index":45255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 225.1573 Da; putative annotation: N/A; putative formula: C6H15N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.301,"smiles":null,"spectrum_id":"CCMSLIB00017307921","spectrum_index":45256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 61.0326 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.119,"smiles":null,"spectrum_id":"CCMSLIB00017307924","spectrum_index":45257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 119.0374 Da; putative annotation: Anthranilic acid; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.161,"smiles":null,"spectrum_id":"CCMSLIB00017307928","spectrum_index":45258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 332.2341 Da; putative annotation: Tetrahydrocorticosterone; putative formula: C21H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.294,"smiles":null,"spectrum_id":"CCMSLIB00017307930","spectrum_index":45259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 200.1161 Da; putative annotation: Ile-Ser; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.271,"smiles":null,"spectrum_id":"CCMSLIB00017307933","spectrum_index":45260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 286.1965 Da; putative annotation: h_266_oxandrolone_m3; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.32,"smiles":null,"spectrum_id":"CCMSLIB00017307935","spectrum_index":45261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 279.2248 Da; putative annotation: Gly-C15:1; putative formula: C17H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.29,"smiles":null,"spectrum_id":"CCMSLIB00017307938","spectrum_index":45262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Benzylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione (delta mass: 131.0944 Da; putative annotation: Triethanolamine; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.223,"smiles":null,"spectrum_id":"CCMSLIB00017307941","spectrum_index":45263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 198.1036 Da; putative annotation: (1R,6R)-6-Benzylcyclohex-3-enecarboxylic acid; putative formula: C14H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.174,"smiles":null,"spectrum_id":"CCMSLIB00017307943","spectrum_index":45264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 162.051 Da; putative annotation: D-Fructose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.174,"smiles":null,"spectrum_id":"CCMSLIB00017307945","spectrum_index":45265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 124.0482 Da; putative annotation: 2-(1H-1,2,3,4-Tetrazol-5-yl)acetohydrazide; putative formula: C3H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017307948","spectrum_index":45266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 260.1258 Da; putative annotation: N/A; putative formula: C12H20O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.311,"smiles":null,"spectrum_id":"CCMSLIB00017307951","spectrum_index":45267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 65.0262 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.139,"smiles":null,"spectrum_id":"CCMSLIB00017307953","spectrum_index":45268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 613.5552 Da; putative annotation: N/A; putative formula: C39H71N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":797.652,"smiles":null,"spectrum_id":"CCMSLIB00017307956","spectrum_index":45269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 138.0466 Da; putative annotation: N/A; putative formula: C11H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.17,"smiles":null,"spectrum_id":"CCMSLIB00017307959","spectrum_index":45270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 71.0384 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.177,"smiles":null,"spectrum_id":"CCMSLIB00017307962","spectrum_index":45271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 262.2296 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.305,"smiles":null,"spectrum_id":"CCMSLIB00017307963","spectrum_index":45272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 82.0497 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.129,"smiles":null,"spectrum_id":"CCMSLIB00017307966","spectrum_index":45273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 150.0229 Da; putative annotation: N/A; putative formula: C8H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.149,"smiles":null,"spectrum_id":"CCMSLIB00017307969","spectrum_index":45274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diphenyl(4-piperidinyl)methanol (delta mass: 47.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.195,"smiles":null,"spectrum_id":"CCMSLIB00017307972","spectrum_index":45275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 188.0574 Da; putative annotation: N/A; putative formula: C10H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.169,"smiles":null,"spectrum_id":"CCMSLIB00017307975","spectrum_index":45276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 187.1205 Da; putative annotation: N/A; putative formula: C9H17NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.207,"smiles":null,"spectrum_id":"CCMSLIB00017307977","spectrum_index":45277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 64.0101 Da; putative annotation: N/A; putative formula: C3N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.123,"smiles":null,"spectrum_id":"CCMSLIB00017307980","spectrum_index":45278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 282.0476 Da; putative annotation: N/A; putative formula: C8H2N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.15,"smiles":null,"spectrum_id":"CCMSLIB00017307982","spectrum_index":45279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 102.0321 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.165,"smiles":null,"spectrum_id":"CCMSLIB00017307985","spectrum_index":45280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311158 Methoxytyramine (delta mass: 44.0166 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.118,"smiles":null,"spectrum_id":"CCMSLIB00017307988","spectrum_index":45281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU089302 Volinanserin (delta mass: 70.0825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.295,"smiles":null,"spectrum_id":"CCMSLIB00017307990","spectrum_index":45282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 115.064 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.234,"smiles":null,"spectrum_id":"CCMSLIB00017307993","spectrum_index":45283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 300.267 Da; putative annotation: N/A; putative formula: C18H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.354,"smiles":null,"spectrum_id":"CCMSLIB00017307996","spectrum_index":45284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 259.1425 Da; putative annotation: N/A; putative formula: C13H25NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.203,"smiles":null,"spectrum_id":"CCMSLIB00017307998","spectrum_index":45285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Subsessiline (delta mass: 177.9371 Da; putative annotation: N/A; putative formula: C8H2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.039,"smiles":null,"spectrum_id":"CCMSLIB00017308001","spectrum_index":45286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 99.0555 Da; putative annotation: N/A; putative formula: C2H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.173,"smiles":null,"spectrum_id":"CCMSLIB00017308004","spectrum_index":45287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 319.2155 Da; putative annotation: N/A; putative formula: C20H25N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.296,"smiles":null,"spectrum_id":"CCMSLIB00017308006","spectrum_index":45288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 67.0815 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.257,"smiles":null,"spectrum_id":"CCMSLIB00017308008","spectrum_index":45289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sinomenine (delta mass: 131.0863 Da; putative annotation: N/A; putative formula: C6H14NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.256,"smiles":null,"spectrum_id":"CCMSLIB00017308011","spectrum_index":45290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 132.0806 Da; putative annotation: N/A; putative formula: C7H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.185,"smiles":null,"spectrum_id":"CCMSLIB00017308014","spectrum_index":45291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 369.3527 Da; putative annotation: N/A; putative formula: C23H48NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.387,"smiles":null,"spectrum_id":"CCMSLIB00017308016","spectrum_index":45292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 214.063 Da; putative annotation: N/A; putative formula: C13H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.134,"smiles":null,"spectrum_id":"CCMSLIB00017308018","spectrum_index":45293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 84.0577 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.159,"smiles":null,"spectrum_id":"CCMSLIB00017308021","spectrum_index":45294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 144.13 Da; putative annotation: N/A; putative formula: C12H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.383,"smiles":null,"spectrum_id":"CCMSLIB00017308024","spectrum_index":45295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 266.1015 Da; putative annotation: N/A; putative formula: C11H14N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.224,"smiles":null,"spectrum_id":"CCMSLIB00017308027","spectrum_index":45296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 251.0748 Da; putative annotation: N/A; putative formula: C9H18NO3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.14,"smiles":null,"spectrum_id":"CCMSLIB00017308029","spectrum_index":45297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1.(3S,4S,21R)-14-Ethyl-21-hydroxy-9-(hydroxymethyl)-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid (delta mass: 43.9891 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.249,"smiles":null,"spectrum_id":"CCMSLIB00017308031","spectrum_index":45298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 15.9783 Da; putative annotation: N/A; putative formula: O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.024,"smiles":null,"spectrum_id":"CCMSLIB00017308034","spectrum_index":45299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 139.0385 Da; putative annotation: N/A; putative formula: C5H5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.114,"smiles":null,"spectrum_id":"CCMSLIB00017308037","spectrum_index":45300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 250.1894 Da; putative annotation: N/A; putative formula: C6H23N10O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.328,"smiles":null,"spectrum_id":"CCMSLIB00017308040","spectrum_index":45301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Allyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol (delta mass: 18.0133 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.178,"smiles":null,"spectrum_id":"CCMSLIB00017308043","spectrum_index":45302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 171.0381 Da; putative annotation: N/A; putative formula: C6H10N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.161,"smiles":null,"spectrum_id":"CCMSLIB00017308045","spectrum_index":45303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380746-01!1,7-bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.201,"smiles":null,"spectrum_id":"CCMSLIB00017308048","spectrum_index":45304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 259.9595 Da; putative annotation: N/A; putative formula: C4H8N2O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.062,"smiles":null,"spectrum_id":"CCMSLIB00017308051","spectrum_index":45305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 87.0312 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.091,"smiles":null,"spectrum_id":"CCMSLIB00017308054","spectrum_index":45306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 14.012 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.133,"smiles":null,"spectrum_id":"CCMSLIB00017308056","spectrum_index":45307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 168.0581 Da; putative annotation: N/A; putative formula: C5H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.123,"smiles":null,"spectrum_id":"CCMSLIB00017308059","spectrum_index":45308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 586.1553 Da; putative annotation: N/A; putative formula: C27H30N4O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.257,"smiles":null,"spectrum_id":"CCMSLIB00017308061","spectrum_index":45309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(cyclohexylmethyl)- (delta mass: 94.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.196,"smiles":null,"spectrum_id":"CCMSLIB00017308064","spectrum_index":45310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 74.0624 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.17,"smiles":null,"spectrum_id":"CCMSLIB00017308066","spectrum_index":45311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 163.0319 Da; putative annotation: N/A; putative formula: C6H5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.16,"smiles":null,"spectrum_id":"CCMSLIB00017308068","spectrum_index":45312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311099 Camptothecin (delta mass: 14.019 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.137,"smiles":null,"spectrum_id":"CCMSLIB00017308071","spectrum_index":45313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 613.222 Da; putative annotation: N/A; putative formula: C30H31N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.334,"smiles":null,"spectrum_id":"CCMSLIB00017308074","spectrum_index":45314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 77.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.155,"smiles":null,"spectrum_id":"CCMSLIB00017308077","spectrum_index":45315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 167.1309 Da; putative annotation: N/A; putative formula: C10H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.202,"smiles":null,"spectrum_id":"CCMSLIB00017308080","spectrum_index":45316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 560.4583 Da; putative annotation: N/A; putative formula: C31H64N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.555,"smiles":null,"spectrum_id":"CCMSLIB00017308082","spectrum_index":45317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meropenem (delta mass: 387.1564 Da; putative annotation: N/A; putative formula: C16H26N3O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.315,"smiles":null,"spectrum_id":"CCMSLIB00017308084","spectrum_index":45318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 352.2288 Da; putative annotation: N/A; putative formula: C19H33N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":743.404,"smiles":null,"spectrum_id":"CCMSLIB00017308087","spectrum_index":45319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 56.0261 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.122,"smiles":null,"spectrum_id":"CCMSLIB00017308089","spectrum_index":45320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 435.399 Da; putative annotation: N/A; putative formula: C28H54NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.442,"smiles":null,"spectrum_id":"CCMSLIB00017308092","spectrum_index":45321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 548.4977 Da; putative annotation: N/A; putative formula: C36H68OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":734.569,"smiles":null,"spectrum_id":"CCMSLIB00017308095","spectrum_index":45322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Di(2-naphthyl)amine (delta mass: 45.9915 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.119,"smiles":null,"spectrum_id":"CCMSLIB00017308097","spectrum_index":45323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 18.0137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.053,"smiles":null,"spectrum_id":"CCMSLIB00017308100","spectrum_index":45324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 704.4368 Da; putative annotation: N/A; putative formula: C29H66N6O9P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.533,"smiles":null,"spectrum_id":"CCMSLIB00017308103","spectrum_index":45325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 56.0681 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.17,"smiles":null,"spectrum_id":"CCMSLIB00017308106","spectrum_index":45326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 206.0576 Da; putative annotation: N/A; putative formula: C11H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.154,"smiles":null,"spectrum_id":"CCMSLIB00017308108","spectrum_index":45327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 406.2354 Da; putative annotation: N/A; putative formula: C23H34O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.347,"smiles":null,"spectrum_id":"CCMSLIB00017308111","spectrum_index":45328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Glucosamine from NIST14 (delta mass: 448.1574 Da; putative annotation: N/A; putative formula: C18H27N8P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.244,"smiles":null,"spectrum_id":"CCMSLIB00017308114","spectrum_index":45329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 194.1885 Da; putative annotation: N/A; putative formula: C11H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.306,"smiles":null,"spectrum_id":"CCMSLIB00017308116","spectrum_index":45330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 110.0378 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.108,"smiles":null,"spectrum_id":"CCMSLIB00017308119","spectrum_index":45331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 13.0309 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":142.133,"smiles":null,"spectrum_id":"CCMSLIB00017308122","spectrum_index":45332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 42.0085 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.163,"smiles":null,"spectrum_id":"CCMSLIB00017308125","spectrum_index":45333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 80.0052 Da; putative annotation: N/A; putative formula: C8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017308127","spectrum_index":45334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 126.0339 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.131,"smiles":null,"spectrum_id":"CCMSLIB00017308130","spectrum_index":45335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 140.0483 Da; putative annotation: N/A; putative formula: C8H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.193,"smiles":null,"spectrum_id":"CCMSLIB00017308133","spectrum_index":45336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 151.0633 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.15,"smiles":null,"spectrum_id":"CCMSLIB00017308136","spectrum_index":45337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 118.0458 Da; putative annotation: N/A; putative formula: C5H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.184,"smiles":null,"spectrum_id":"CCMSLIB00017308138","spectrum_index":45338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 776.4786 Da; putative annotation: N/A; putative formula: C37H68N4O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1311.75,"smiles":null,"spectrum_id":"CCMSLIB00017308140","spectrum_index":45339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-5,6-dihydroxy-6-methyl-7-oxocyclopenta[c]pyridine-5-carboxylate (delta mass: 14.0165 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.197,"smiles":null,"spectrum_id":"CCMSLIB00017308143","spectrum_index":45340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 107.0368 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017308146","spectrum_index":45341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 77.9969 Da; putative annotation: N/A; putative formula: C2H-2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.073,"smiles":null,"spectrum_id":"CCMSLIB00017308149","spectrum_index":45342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 76.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.149,"smiles":null,"spectrum_id":"CCMSLIB00017308150","spectrum_index":45343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 96.0576 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.123,"smiles":null,"spectrum_id":"CCMSLIB00017308153","spectrum_index":45344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 72.0211 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.118,"smiles":null,"spectrum_id":"CCMSLIB00017308156","spectrum_index":45345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 547.2603 Da; putative annotation: N/A; putative formula: C29H41NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.384,"smiles":null,"spectrum_id":"CCMSLIB00017308159","spectrum_index":45346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 166.0268 Da; putative annotation: N/A; putative formula: C8H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.118,"smiles":null,"spectrum_id":"CCMSLIB00017308161","spectrum_index":45347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 168.1738 Da; putative annotation: N/A; putative formula: C9H20N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.281,"smiles":null,"spectrum_id":"CCMSLIB00017308163","spectrum_index":45348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 477.1987 Da; putative annotation: N/A; putative formula: C29H27N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.259,"smiles":null,"spectrum_id":"CCMSLIB00017308166","spectrum_index":45349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Raffinose (delta mass: 286.6935 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.87,"smiles":null,"spectrum_id":"CCMSLIB00017308169","spectrum_index":45350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 368.3236 Da; putative annotation: N/A; putative formula: C22H44N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.447,"smiles":null,"spectrum_id":"CCMSLIB00017308170","spectrum_index":45351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 150.1044 Da; putative annotation: N/A; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.164,"smiles":null,"spectrum_id":"CCMSLIB00017308173","spectrum_index":45352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 174.0293 Da; putative annotation: N/A; putative formula: C10H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.1,"smiles":null,"spectrum_id":"CCMSLIB00017308176","spectrum_index":45353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nitrazepam (delta mass: 57.9986 Da; putative annotation: N/A; putative formula: CH2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.086,"smiles":null,"spectrum_id":"CCMSLIB00017308177","spectrum_index":45354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 185.1121 Da; putative annotation: N/A; putative formula: C4H11N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.292,"smiles":null,"spectrum_id":"CCMSLIB00017308180","spectrum_index":45355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 276.1204 Da; putative annotation: N/A; putative formula: C12H20O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.217,"smiles":null,"spectrum_id":"CCMSLIB00017308183","spectrum_index":45356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 221.0766 Da; putative annotation: N/A; putative formula: C7H18N3O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.23,"smiles":null,"spectrum_id":"CCMSLIB00017308186","spectrum_index":45357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptoline (delta mass: 298.1068 Da; putative annotation: N/A; putative formula: C15H14N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.214,"smiles":null,"spectrum_id":"CCMSLIB00017308188","spectrum_index":45358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 152.0548 Da; putative annotation: N/A; putative formula: C2H8N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.208,"smiles":null,"spectrum_id":"CCMSLIB00017308190","spectrum_index":45359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 169.0325 Da; putative annotation: N/A; putative formula: C14H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.15,"smiles":null,"spectrum_id":"CCMSLIB00017308193","spectrum_index":45360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371607 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 172.0788 Da; putative annotation: N/A; putative formula: C6H12N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.149,"smiles":null,"spectrum_id":"CCMSLIB00017308196","spectrum_index":45361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 22.0749 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.102,"smiles":null,"spectrum_id":"CCMSLIB00017308199","spectrum_index":45362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100279 D-Sorbitol|D-Sorbit|D-Glucitol|D-1,2,3,4,5,6-Hexanehexol|D-Sorbol|Cystosol|Glucarine|Diakarmon|Esasorb|Sorbol (delta mass: 280.2402 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.327,"smiles":null,"spectrum_id":"CCMSLIB00017308202","spectrum_index":45363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 53.0198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.174,"smiles":null,"spectrum_id":"CCMSLIB00017308205","spectrum_index":45364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Leu-Pro from NIST14 (delta mass: 114.043 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.198,"smiles":null,"spectrum_id":"CCMSLIB00017308208","spectrum_index":45365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385672-01!(E)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)hept-4-en-3-one (delta mass: 90.0513 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.195,"smiles":null,"spectrum_id":"CCMSLIB00017308211","spectrum_index":45366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indolelactic acid; LC-tDDA; CE20 (delta mass: 72.9989 Da; putative annotation: N/A; putative formula: C2H3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.08,"smiles":null,"spectrum_id":"CCMSLIB00017308212","spectrum_index":45367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 314.2259 Da; putative annotation: N/A; putative formula: C21H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.349,"smiles":null,"spectrum_id":"CCMSLIB00017308215","spectrum_index":45368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 268.0361 Da; putative annotation: N/A; putative formula: C9H9N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.165,"smiles":null,"spectrum_id":"CCMSLIB00017308218","spectrum_index":45369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 145.1093 Da; putative annotation: N/A; putative formula: C7H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.227,"smiles":null,"spectrum_id":"CCMSLIB00017308221","spectrum_index":45370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ferrioxamine B [M+Fe-2H] (delta mass: 432.1577 Da; putative annotation: N/A; putative formula: C21H21N8OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.43,"smiles":null,"spectrum_id":"CCMSLIB00017308223","spectrum_index":45371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 45.0534 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.139,"smiles":null,"spectrum_id":"CCMSLIB00017308226","spectrum_index":45372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 17.0247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.073,"smiles":null,"spectrum_id":"CCMSLIB00017308230","spectrum_index":45373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 103.1205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.185,"smiles":null,"spectrum_id":"CCMSLIB00017308233","spectrum_index":45374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 86.0618 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.185,"smiles":null,"spectrum_id":"CCMSLIB00017308236","spectrum_index":45375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 124.0165 Da; putative annotation: N/A; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.092,"smiles":null,"spectrum_id":"CCMSLIB00017308240","spectrum_index":45376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 50.0156 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.065,"smiles":null,"spectrum_id":"CCMSLIB00017308243","spectrum_index":45377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00109 Loline (delta mass: 17.015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.133,"smiles":null,"spectrum_id":"CCMSLIB00017308246","spectrum_index":45378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 18.0129 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.152,"smiles":null,"spectrum_id":"CCMSLIB00017308249","spectrum_index":45379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 129.0416 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.101,"smiles":null,"spectrum_id":"CCMSLIB00017308253","spectrum_index":45380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 132.0849 Da; putative annotation: N/A; putative formula: C4H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.26,"smiles":null,"spectrum_id":"CCMSLIB00017308255","spectrum_index":45381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 877.6139 Da; putative annotation: N/A; putative formula: C47H83N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1099.71,"smiles":null,"spectrum_id":"CCMSLIB00017308258","spectrum_index":45382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 157.9979 Da; putative annotation: N/A; putative formula: C5H6N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.058,"smiles":null,"spectrum_id":"CCMSLIB00017308261","spectrum_index":45383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 187.0845 Da; putative annotation: N/A; putative formula: C8H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.203,"smiles":null,"spectrum_id":"CCMSLIB00017308264","spectrum_index":45384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 798.7239 Da; putative annotation: N/A; putative formula: C56H94O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1017.8,"smiles":null,"spectrum_id":"CCMSLIB00017308267","spectrum_index":45385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 212.2004 Da; putative annotation: N/A; putative formula: C11H24N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.297,"smiles":null,"spectrum_id":"CCMSLIB00017308270","spectrum_index":45386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 12.0094 Da; putative annotation: N/A; putative formula: N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.1,"smiles":null,"spectrum_id":"CCMSLIB00017308273","spectrum_index":45387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 360.127 Da; putative annotation: N/A; putative formula: C18H16N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.229,"smiles":null,"spectrum_id":"CCMSLIB00017308274","spectrum_index":45388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 31.0434 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.094,"smiles":null,"spectrum_id":"CCMSLIB00017308277","spectrum_index":45389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 344.1351 Da; putative annotation: N/A; putative formula: C22H20N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.206,"smiles":null,"spectrum_id":"CCMSLIB00017308279","spectrum_index":45390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyltapentadol (delta mass: 162.1042 Da; putative annotation: N/A; putative formula: C11H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.274,"smiles":null,"spectrum_id":"CCMSLIB00017308282","spectrum_index":45391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.117,"smiles":null,"spectrum_id":"CCMSLIB00017308285","spectrum_index":45392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 92.0468 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.195,"smiles":null,"spectrum_id":"CCMSLIB00017308287","spectrum_index":45393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 58.7832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.886,"smiles":null,"spectrum_id":"CCMSLIB00017308290","spectrum_index":45394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 98.0274 Da; putative annotation: N/A; putative formula: C7H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.119,"smiles":null,"spectrum_id":"CCMSLIB00017308293","spectrum_index":45395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 82.0417 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017308295","spectrum_index":45396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 89.0009 Da; putative annotation: N/A; putative formula: C4H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.145,"smiles":null,"spectrum_id":"CCMSLIB00017308297","spectrum_index":45397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 14.9812 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.114,"smiles":null,"spectrum_id":"CCMSLIB00017308300","spectrum_index":45398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 632.3209 Da; putative annotation: N/A; putative formula: C45H45OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.413,"smiles":null,"spectrum_id":"CCMSLIB00017308303","spectrum_index":45399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 616.2872 Da; putative annotation: N/A; putative formula: C38H40N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.379,"smiles":null,"spectrum_id":"CCMSLIB00017308304","spectrum_index":45400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 106.0676 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.202,"smiles":null,"spectrum_id":"CCMSLIB00017308307","spectrum_index":45401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 328.0174 Da; putative annotation: N/A; putative formula: C13H13O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.098,"smiles":null,"spectrum_id":"CCMSLIB00017308310","spectrum_index":45402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 66.0833 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.305,"smiles":null,"spectrum_id":"CCMSLIB00017308311","spectrum_index":45403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 62.3974 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.5,"smiles":null,"spectrum_id":"CCMSLIB00017308314","spectrum_index":45404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 10.9796 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.076,"smiles":null,"spectrum_id":"CCMSLIB00017308317","spectrum_index":45405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 201.1003 Da; putative annotation: N/A; putative formula: C9H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.197,"smiles":null,"spectrum_id":"CCMSLIB00017308320","spectrum_index":45406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 203.1152 Da; putative annotation: N/A; putative formula: C9H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.191,"smiles":null,"spectrum_id":"CCMSLIB00017308323","spectrum_index":45407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 5.0054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.17,"smiles":null,"spectrum_id":"CCMSLIB00017308325","spectrum_index":45408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 169.1104 Da; putative annotation: N/A; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.181,"smiles":null,"spectrum_id":"CCMSLIB00017308327","spectrum_index":45409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 74.052 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.128,"smiles":null,"spectrum_id":"CCMSLIB00017308330","spectrum_index":45410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 177.0782 Da; putative annotation: N/A; putative formula: C4H12N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.17,"smiles":null,"spectrum_id":"CCMSLIB00017308333","spectrum_index":45411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 90.0491 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.199,"smiles":null,"spectrum_id":"CCMSLIB00017308336","spectrum_index":45412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 619.2696 Da; putative annotation: N/A; putative formula: C38H33N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.33,"smiles":null,"spectrum_id":"CCMSLIB00017308339","spectrum_index":45413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 51.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.165,"smiles":null,"spectrum_id":"CCMSLIB00017308340","spectrum_index":45414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 35.0349 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.205,"smiles":null,"spectrum_id":"CCMSLIB00017308343","spectrum_index":45415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 43.9893 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.117,"smiles":null,"spectrum_id":"CCMSLIB00017308346","spectrum_index":45416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 230.0529 Da; putative annotation: Asp-Asp; putative formula: C8H10N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.124,"smiles":null,"spectrum_id":"CCMSLIB00017308349","spectrum_index":45417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 201.0677 Da; putative annotation: O-Succinyl-L-homoserine; putative formula: C8H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.165,"smiles":null,"spectrum_id":"CCMSLIB00017308352","spectrum_index":45418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 128.0474 Da; putative annotation: 2,4-O-Ethylidene-D-erythrose; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.118,"smiles":null,"spectrum_id":"CCMSLIB00017308355","spectrum_index":45419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 339.2047 Da; putative annotation: 3,5-Dimethyl-2,4,6-triphenyl-4-piperidinol; putative formula: C25H25N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.285,"smiles":null,"spectrum_id":"CCMSLIB00017308358","spectrum_index":45420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 236.1201 Da; putative annotation: Cyclopropyl(4-methoxyphenyl)phenylmethanol; putative formula: C17H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.216,"smiles":null,"spectrum_id":"CCMSLIB00017308360","spectrum_index":45421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 94.0862 Da; putative annotation: N/A; putative formula: C6H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.23,"smiles":null,"spectrum_id":"CCMSLIB00017308363","spectrum_index":45422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 211.2732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.432,"smiles":null,"spectrum_id":"CCMSLIB00017308366","spectrum_index":45423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU030805 Lauryldiethanolamine|2-[dodecyl(2-hydroxyethyl)amino]ethanol (delta mass: 44.0254 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.299,"smiles":null,"spectrum_id":"CCMSLIB00017308369","spectrum_index":45424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 42.0194 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.09,"smiles":null,"spectrum_id":"CCMSLIB00017308372","spectrum_index":45425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 576.4727 Da; putative annotation: N/A; putative formula: C32H60N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.533,"smiles":null,"spectrum_id":"CCMSLIB00017308374","spectrum_index":45426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 126.0831 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.143,"smiles":null,"spectrum_id":"CCMSLIB00017308377","spectrum_index":45427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 41.0259 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.149,"smiles":null,"spectrum_id":"CCMSLIB00017308380","spectrum_index":45428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole-3-acetic acid CollisionEnergy:102040 (delta mass: 100.0637 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.129,"smiles":null,"spectrum_id":"CCMSLIB00017308383","spectrum_index":45429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 8.9401 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.02,"smiles":null,"spectrum_id":"CCMSLIB00017308386","spectrum_index":45430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 102.0683 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.211,"smiles":null,"spectrum_id":"CCMSLIB00017308388","spectrum_index":45431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 684.2637 Da; putative annotation: N/A; putative formula: C46H32N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1045.43,"smiles":null,"spectrum_id":"CCMSLIB00017308391","spectrum_index":45432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Leu (delta mass: 101.0488 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.219,"smiles":null,"spectrum_id":"CCMSLIB00017308394","spectrum_index":45433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 498.252 Da; putative annotation: N/A; putative formula: C31H34N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.343,"smiles":null,"spectrum_id":"CCMSLIB00017308397","spectrum_index":45434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 102.0924 Da; putative annotation: N/A; putative formula: C3H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.226,"smiles":null,"spectrum_id":"CCMSLIB00017308400","spectrum_index":45435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 86.9943 Da; putative annotation: N/A; putative formula: C2HNO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.037,"smiles":null,"spectrum_id":"CCMSLIB00017308402","spectrum_index":45436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 90.0469 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.149,"smiles":null,"spectrum_id":"CCMSLIB00017308405","spectrum_index":45437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 236.1409 Da; putative annotation: N/A; putative formula: C14H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.253,"smiles":null,"spectrum_id":"CCMSLIB00017308408","spectrum_index":45438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 177.9396 Da; putative annotation: N/A; putative formula: C4H2O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.977,"smiles":null,"spectrum_id":"CCMSLIB00017308409","spectrum_index":45439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 78.9802 Da; putative annotation: N/A; putative formula: H2NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.017,"smiles":null,"spectrum_id":"CCMSLIB00017308412","spectrum_index":45440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 87.0308 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.102,"smiles":null,"spectrum_id":"CCMSLIB00017308415","spectrum_index":45441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 199.2747 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.444,"smiles":null,"spectrum_id":"CCMSLIB00017308418","spectrum_index":45442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 258.1412 Da; putative annotation: N/A; putative formula: C12H24N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.253,"smiles":null,"spectrum_id":"CCMSLIB00017308419","spectrum_index":45443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 79.0775 Da; putative annotation: N/A; putative formula: C6H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.195,"smiles":null,"spectrum_id":"CCMSLIB00017308422","spectrum_index":45444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 85.0865 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.23,"smiles":null,"spectrum_id":"CCMSLIB00017308425","spectrum_index":45445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-5-(3,3-dimethylguanidine-1-yl)pentanoic acid (delta mass: 17.9183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.037,"smiles":null,"spectrum_id":"CCMSLIB00017308427","spectrum_index":45446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 177.143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.223,"smiles":null,"spectrum_id":"CCMSLIB00017308429","spectrum_index":45447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 164.0792 Da; putative annotation: N/A; putative formula: C6H10F2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.16,"smiles":null,"spectrum_id":"CCMSLIB00017308432","spectrum_index":45448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 44.0637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.124,"smiles":null,"spectrum_id":"CCMSLIB00017308435","spectrum_index":45449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 105.0211 Da; putative annotation: N/A; putative formula: C6H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.071,"smiles":null,"spectrum_id":"CCMSLIB00017308438","spectrum_index":45450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 159.0898 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.187,"smiles":null,"spectrum_id":"CCMSLIB00017308439","spectrum_index":45451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 92.0634 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.338,"smiles":null,"spectrum_id":"CCMSLIB00017308442","spectrum_index":45452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophan ethyl ester (delta mass: 264.2447 Da; putative annotation: N/A; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.373,"smiles":null,"spectrum_id":"CCMSLIB00017308445","spectrum_index":45453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 457.1435 Da; putative annotation: N/A; putative formula: C19H28N3O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.208,"smiles":null,"spectrum_id":"CCMSLIB00017308447","spectrum_index":45454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7,8a-dihydroxy-1-methoxy-7-methyl-1H-isochromene-6,8-dione (delta mass: 35.0459 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.187,"smiles":null,"spectrum_id":"CCMSLIB00017308449","spectrum_index":45455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-tert-Butyl-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.164,"smiles":null,"spectrum_id":"CCMSLIB00017308452","spectrum_index":45456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 145.0479 Da; putative annotation: N/A; putative formula: C6H12NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.202,"smiles":null,"spectrum_id":"CCMSLIB00017308455","spectrum_index":45457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 147.0685 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.191,"smiles":null,"spectrum_id":"CCMSLIB00017308457","spectrum_index":45458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 103.0572 Da; putative annotation: N/A; putative formula: C3H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.117,"smiles":null,"spectrum_id":"CCMSLIB00017308460","spectrum_index":45459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 308.2706 Da; putative annotation: N/A; putative formula: C20H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.362,"smiles":null,"spectrum_id":"CCMSLIB00017308463","spectrum_index":45460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 290.0884 Da; putative annotation: N/A; putative formula: C11H6N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.15,"smiles":null,"spectrum_id":"CCMSLIB00017308465","spectrum_index":45461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 44.0086 Da; putative annotation: N/A; putative formula: C2H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.053,"smiles":null,"spectrum_id":"CCMSLIB00017308469","spectrum_index":45462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 70.045 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.168,"smiles":null,"spectrum_id":"CCMSLIB00017308471","spectrum_index":45463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 1063.5216 Da; putative annotation: N/A; putative formula: C57H69N13O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1244.59,"smiles":null,"spectrum_id":"CCMSLIB00017308474","spectrum_index":45464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 294.1728 Da; putative annotation: N/A; putative formula: C19H22N2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.259,"smiles":null,"spectrum_id":"CCMSLIB00017308477","spectrum_index":45465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 9.0158 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.102,"smiles":null,"spectrum_id":"CCMSLIB00017308480","spectrum_index":45466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 158.1097 Da; putative annotation: N/A; putative formula: C12H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.19,"smiles":null,"spectrum_id":"CCMSLIB00017308482","spectrum_index":45467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 344.2921 Da; putative annotation: N/A; putative formula: C20H40O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.352,"smiles":null,"spectrum_id":"CCMSLIB00017308485","spectrum_index":45468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of imbricatine (delta mass: 102.0315 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.128,"smiles":null,"spectrum_id":"CCMSLIB00017308487","spectrum_index":45469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 26.0174 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.093,"smiles":null,"spectrum_id":"CCMSLIB00017308490","spectrum_index":45470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 329.1922 Da; putative annotation: N/A; putative formula: C19H27N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.279,"smiles":null,"spectrum_id":"CCMSLIB00017308493","spectrum_index":45471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 478.1797 Da; putative annotation: N/A; putative formula: C19H30N2O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.287,"smiles":null,"spectrum_id":"CCMSLIB00017308494","spectrum_index":45472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Ile (delta mass: 69.0589 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.208,"smiles":null,"spectrum_id":"CCMSLIB00017308497","spectrum_index":45473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 192.042 Da; putative annotation: N/A; putative formula: C10H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.102,"smiles":null,"spectrum_id":"CCMSLIB00017308500","spectrum_index":45474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381375-01!(6E)-heptadeca-6,16-diene-1,2,4-triol [IIN-based: Match] (delta mass: 80.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.3,"smiles":null,"spectrum_id":"CCMSLIB00017308503","spectrum_index":45475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 53.0635 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.129,"smiles":null,"spectrum_id":"CCMSLIB00017308504","spectrum_index":45476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 138.0484 Da; putative annotation: N/A; putative formula: C11H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.15,"smiles":null,"spectrum_id":"CCMSLIB00017308507","spectrum_index":45477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 55.9206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.965,"smiles":null,"spectrum_id":"CCMSLIB00017308510","spectrum_index":45478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 144.0789 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.144,"smiles":null,"spectrum_id":"CCMSLIB00017308512","spectrum_index":45479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 99.0678 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.171,"smiles":null,"spectrum_id":"CCMSLIB00017308515","spectrum_index":45480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine hydrochloride (delta mass: 18.0075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.086,"smiles":null,"spectrum_id":"CCMSLIB00017308518","spectrum_index":45481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 215.2966 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.357,"smiles":null,"spectrum_id":"CCMSLIB00017308520","spectrum_index":45482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 109.0356 Da; putative annotation: N/A; putative formula: C6H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.096,"smiles":null,"spectrum_id":"CCMSLIB00017308523","spectrum_index":45483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 481.4079 Da; putative annotation: N/A; putative formula: C28H57N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.51,"smiles":null,"spectrum_id":"CCMSLIB00017308526","spectrum_index":45484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 26.5013 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.687,"smiles":null,"spectrum_id":"CCMSLIB00017308529","spectrum_index":45485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 70.0844 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017308531","spectrum_index":45486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 127.031 Da; putative annotation: N/A; putative formula: C3H5N5O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.118,"smiles":null,"spectrum_id":"CCMSLIB00017308533","spectrum_index":45487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 113.0719 Da; putative annotation: N/A; putative formula: C3H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.21,"smiles":null,"spectrum_id":"CCMSLIB00017308536","spectrum_index":45488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 397.2823 Da; putative annotation: N/A; putative formula: C22H39NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.319,"smiles":null,"spectrum_id":"CCMSLIB00017308539","spectrum_index":45489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 125.0145 Da; putative annotation: N/A; putative formula: C4H4N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.137,"smiles":null,"spectrum_id":"CCMSLIB00017308541","spectrum_index":45490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 58.0146 Da; putative annotation: N/A; putative formula: CH2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.076,"smiles":null,"spectrum_id":"CCMSLIB00017308544","spectrum_index":45491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 88.0238 Da; putative annotation: N/A; putative formula: CH4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.131,"smiles":null,"spectrum_id":"CCMSLIB00017308547","spectrum_index":45492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.154,"smiles":null,"spectrum_id":"CCMSLIB00017308549","spectrum_index":45493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 550.3612 Da; putative annotation: N/A; putative formula: C32H55O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.421,"smiles":null,"spectrum_id":"CCMSLIB00017308552","spectrum_index":45494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310824 N-Fructosyl isoleucine (delta mass: 161.0676 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.222,"smiles":null,"spectrum_id":"CCMSLIB00017308555","spectrum_index":45495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 69.0405 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.106,"smiles":null,"spectrum_id":"CCMSLIB00017308557","spectrum_index":45496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 84.0574 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.216,"smiles":null,"spectrum_id":"CCMSLIB00017308560","spectrum_index":45497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 505.4931 Da; putative annotation: N/A; putative formula: C28H59N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.565,"smiles":null,"spectrum_id":"CCMSLIB00017308563","spectrum_index":45498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 83.9848 Da; putative annotation: N/A; putative formula: C3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.071,"smiles":null,"spectrum_id":"CCMSLIB00017308565","spectrum_index":45499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 268.0376 Da; putative annotation: N/A; putative formula: C7H14N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.103,"smiles":null,"spectrum_id":"CCMSLIB00017308568","spectrum_index":45500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.107,"smiles":null,"spectrum_id":"CCMSLIB00017308571","spectrum_index":45501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 4.9292 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.951,"smiles":null,"spectrum_id":"CCMSLIB00017308574","spectrum_index":45502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[4-[Acetyl(hydroxy)amino]butylcarbamoyl]-5-[3-[acetyl(hydroxy)amino]propylamino]-3-hydroxy-5-oxopentanoic acid (delta mass: 14.0085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.217,"smiles":null,"spectrum_id":"CCMSLIB00017308576","spectrum_index":45503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 306.091 Da; putative annotation: N/A; putative formula: C12H24N2O-1P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.214,"smiles":null,"spectrum_id":"CCMSLIB00017308578","spectrum_index":45504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 25.907 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.993,"smiles":null,"spectrum_id":"CCMSLIB00017308581","spectrum_index":45505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.149,"smiles":null,"spectrum_id":"CCMSLIB00017308584","spectrum_index":45506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,3-DIAMINOPROPANE\"\" (delta mass: 178.0476 Da; putative annotation: N/A; putative formula: C6H10O6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.139,"smiles":null,"spectrum_id":"CCMSLIB00017308587","spectrum_index":45507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ANISOMYCIN (delta mass: 93.0673 Da; putative annotation: N/A; putative formula: C5H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.206,"smiles":null,"spectrum_id":"CCMSLIB00017308588","spectrum_index":45508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 452.368 Da; putative annotation: N/A; putative formula: C30H49N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.522,"smiles":null,"spectrum_id":"CCMSLIB00017308591","spectrum_index":45509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 69.0215 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017308594","spectrum_index":45510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 13.0439 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.125,"smiles":null,"spectrum_id":"CCMSLIB00017308597","spectrum_index":45511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 362.2417 Da; putative annotation: N/A; putative formula: C17H34N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.312,"smiles":null,"spectrum_id":"CCMSLIB00017308599","spectrum_index":45512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 69.029 Da; putative annotation: N/A; putative formula: C2H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.1,"smiles":null,"spectrum_id":"CCMSLIB00017308602","spectrum_index":45513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 39.093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.2,"smiles":null,"spectrum_id":"CCMSLIB00017308604","spectrum_index":45514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Longicaulenone (delta mass: 121.038 Da; putative annotation: N/A; putative formula: C3H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.166,"smiles":null,"spectrum_id":"CCMSLIB00017308607","spectrum_index":45515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 152.0794 Da; putative annotation: N/A; putative formula: C5H8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.181,"smiles":null,"spectrum_id":"CCMSLIB00017308610","spectrum_index":45516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tinazoline (delta mass: 59.0804 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017308613","spectrum_index":45517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 65.0375 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.108,"smiles":null,"spectrum_id":"CCMSLIB00017308615","spectrum_index":45518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 89.0475 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.176,"smiles":null,"spectrum_id":"CCMSLIB00017308617","spectrum_index":45519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-3-pyridazinol (delta mass: 95.0255 Da; putative annotation: N/A; putative formula: C2HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.081,"smiles":null,"spectrum_id":"CCMSLIB00017308620","spectrum_index":45520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 257.0904 Da; putative annotation: N/A; putative formula: C12H19NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.172,"smiles":null,"spectrum_id":"CCMSLIB00017308623","spectrum_index":45521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 187.1435 Da; putative annotation: N/A; putative formula: C7H17N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.245,"smiles":null,"spectrum_id":"CCMSLIB00017308626","spectrum_index":45522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 240.0556 Da; putative annotation: N/A; putative formula: C12H17O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.173,"smiles":null,"spectrum_id":"CCMSLIB00017308627","spectrum_index":45523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"6,7-dimethoxy-1-benzyl-1,2,3,4-tetrahydroisoquinoline CollisionEnergy:102040\"\" (delta mass: 77.0471 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.212,"smiles":null,"spectrum_id":"CCMSLIB00017308630","spectrum_index":45524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 100.0739 Da; putative annotation: N/A; putative formula: C3H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.222,"smiles":null,"spectrum_id":"CCMSLIB00017308633","spectrum_index":45525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 263.9049 Da; putative annotation: N/A; putative formula: C8N4O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.981,"smiles":null,"spectrum_id":"CCMSLIB00017308636","spectrum_index":45526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 131.9985 Da; putative annotation: N/A; putative formula: C5HN4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.079,"smiles":null,"spectrum_id":"CCMSLIB00017308637","spectrum_index":45527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 496.4526 Da; putative annotation: N/A; putative formula: C30H61N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.539,"smiles":null,"spectrum_id":"CCMSLIB00017308640","spectrum_index":45528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301340 Ethylbeta-carboline (delta mass: 631.405 Da; putative annotation: N/A; putative formula: C31H57N3O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.512,"smiles":null,"spectrum_id":"CCMSLIB00017308643","spectrum_index":45529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 18.0009 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.119,"smiles":null,"spectrum_id":"CCMSLIB00017308645","spectrum_index":45530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 220.0881 Da; putative annotation: N/A; putative formula: C8H16N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.195,"smiles":null,"spectrum_id":"CCMSLIB00017308647","spectrum_index":45531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 95.0583 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017308650","spectrum_index":45532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 25.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.107,"smiles":null,"spectrum_id":"CCMSLIB00017308653","spectrum_index":45533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 64.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.144,"smiles":null,"spectrum_id":"CCMSLIB00017308654","spectrum_index":45534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 60.0301 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.09,"smiles":null,"spectrum_id":"CCMSLIB00017308657","spectrum_index":45535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 241.2602 Da; putative annotation: N/A; putative formula: C13H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.445,"smiles":null,"spectrum_id":"CCMSLIB00017308660","spectrum_index":45536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 88.0569 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.226,"smiles":null,"spectrum_id":"CCMSLIB00017308663","spectrum_index":45537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 151.0625 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.128,"smiles":null,"spectrum_id":"CCMSLIB00017308666","spectrum_index":45538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine propyl ester (delta mass: 97.9782 Da; putative annotation: N/A; putative formula: CH-1N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.086,"smiles":null,"spectrum_id":"CCMSLIB00017308667","spectrum_index":45539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 198.1368 Da; putative annotation: N/A; putative formula: C10H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.249,"smiles":null,"spectrum_id":"CCMSLIB00017308670","spectrum_index":45540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311040 Threonylleucine (isomer of 809, 926) (delta mass: 113.0835 Da; putative annotation: 2-Amino-2-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.233,"smiles":null,"spectrum_id":"CCMSLIB00017308673","spectrum_index":45541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 218.1081 Da; putative annotation: Ala-Phe; putative formula: C12H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.21,"smiles":null,"spectrum_id":"CCMSLIB00017308674","spectrum_index":45542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 129.0416 Da; putative annotation: Massbank:PB000462 Glutamic acid|2-aminopentanedioic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.102,"smiles":null,"spectrum_id":"CCMSLIB00017308677","spectrum_index":45543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 264.245 Da; putative annotation: trans-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.332,"smiles":null,"spectrum_id":"CCMSLIB00017308680","spectrum_index":45544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 128.0475 Da; putative annotation: 5-Methoxy-5-oxopentanoic acid CollisionEnergy:102040; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.123,"smiles":null,"spectrum_id":"CCMSLIB00017308683","spectrum_index":45545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 108.0212 Da; putative annotation: 4-Hydroxy-6-methyl-2-pyrone; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017308685","spectrum_index":45546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 285.1725 Da; putative annotation: Spirotetramat BYI08330-monohydroxy; putative formula: C18H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.237,"smiles":null,"spectrum_id":"CCMSLIB00017308688","spectrum_index":45547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 169.1461 Da; putative annotation: Leucine butyl ester; putative formula: C10H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.206,"smiles":null,"spectrum_id":"CCMSLIB00017308691","spectrum_index":45548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 141.0784 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.175,"smiles":null,"spectrum_id":"CCMSLIB00017308694","spectrum_index":45549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.118,"smiles":null,"spectrum_id":"CCMSLIB00017308697","spectrum_index":45550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 95.0364 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.133,"smiles":null,"spectrum_id":"CCMSLIB00017308699","spectrum_index":45551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 59.0739 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.155,"smiles":null,"spectrum_id":"CCMSLIB00017308702","spectrum_index":45552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004503 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 54.0788 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.175,"smiles":null,"spectrum_id":"CCMSLIB00017308705","spectrum_index":45553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 368.1703 Da; putative annotation: N/A; putative formula: C17H28N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.257,"smiles":null,"spectrum_id":"CCMSLIB00017308708","spectrum_index":45554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 232.2164 Da; putative annotation: N/A; putative formula: C17H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.313,"smiles":null,"spectrum_id":"CCMSLIB00017308711","spectrum_index":45555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 33.0201 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.205,"smiles":null,"spectrum_id":"CCMSLIB00017308713","spectrum_index":45556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 166.0674 Da; putative annotation: N/A; putative formula: C7H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.149,"smiles":null,"spectrum_id":"CCMSLIB00017308716","spectrum_index":45557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 115.0275 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.198,"smiles":null,"spectrum_id":"CCMSLIB00017308719","spectrum_index":45558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 266.2945 Da; putative annotation: N/A; putative formula: C19H38)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.381,"smiles":null,"spectrum_id":"CCMSLIB00017308722","spectrum_index":45559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 36.0278 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.197,"smiles":null,"spectrum_id":"CCMSLIB00017308725","spectrum_index":45560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 9.9849 Da; putative annotation: N/A; putative formula: C15H24N4O3S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.066,"smiles":null,"spectrum_id":"CCMSLIB00017308727","spectrum_index":45561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 181.6983 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.758,"smiles":null,"spectrum_id":"CCMSLIB00017308730","spectrum_index":45562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 56.0053 Da; putative annotation: N/A; putative formula: C6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.092,"smiles":null,"spectrum_id":"CCMSLIB00017308733","spectrum_index":45563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 2.4028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.5,"smiles":null,"spectrum_id":"CCMSLIB00017308736","spectrum_index":45564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoajmaline (delta mass: 229.2355 Da; putative annotation: N/A; putative formula: C10H27N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.442,"smiles":null,"spectrum_id":"CCMSLIB00017308739","spectrum_index":45565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 99.0223 Da; putative annotation: N/A; putative formula: C6HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.161,"smiles":null,"spectrum_id":"CCMSLIB00017308741","spectrum_index":45566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 133.9347 Da; putative annotation: N/A; putative formula: H-2N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.005,"smiles":null,"spectrum_id":"CCMSLIB00017308744","spectrum_index":45567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TEGASEROD MALEATE (delta mass: 326.1376 Da; putative annotation: N/A; putative formula: C17H26O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.335,"smiles":null,"spectrum_id":"CCMSLIB00017308747","spectrum_index":45568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 27.0569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.185,"smiles":null,"spectrum_id":"CCMSLIB00017308750","spectrum_index":45569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(2-Nitrophenyl)-1,3-propanediamine (delta mass: 94.0413 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.149,"smiles":null,"spectrum_id":"CCMSLIB00017308753","spectrum_index":45570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 66.0389 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.07,"smiles":null,"spectrum_id":"CCMSLIB00017308756","spectrum_index":45571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxyamphetamine (delta mass: 80.0588 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.203,"smiles":null,"spectrum_id":"CCMSLIB00017308759","spectrum_index":45572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrocinchonine (delta mass: 45.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.264,"smiles":null,"spectrum_id":"CCMSLIB00017308762","spectrum_index":45573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 80.1453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.285,"smiles":null,"spectrum_id":"CCMSLIB00017308765","spectrum_index":45574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 70.0417 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017308768","spectrum_index":45575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCURONOLACTONE (delta mass: 52.0692 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.119,"smiles":null,"spectrum_id":"CCMSLIB00017308771","spectrum_index":45576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 275.1326 Da; putative annotation: N/A; putative formula: C16H18FNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.256,"smiles":null,"spectrum_id":"CCMSLIB00017308774","spectrum_index":45577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 57.0102 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.086,"smiles":null,"spectrum_id":"CCMSLIB00017308777","spectrum_index":45578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 355.022 Da; putative annotation: N/A; putative formula: C3H5N11O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.119,"smiles":null,"spectrum_id":"CCMSLIB00017308780","spectrum_index":45579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 169.0512 Da; putative annotation: N/A; putative formula: C5H8N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.097,"smiles":null,"spectrum_id":"CCMSLIB00017308783","spectrum_index":45580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 37.9111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.997,"smiles":null,"spectrum_id":"CCMSLIB00017308786","spectrum_index":45581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylic acid (delta mass: 289.1787 Da; putative annotation: N/A; putative formula: C16H23N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.292,"smiles":null,"spectrum_id":"CCMSLIB00017308787","spectrum_index":45582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 973.0845 Da; putative annotation: N/A; putative formula: C72H16NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1195.18,"smiles":null,"spectrum_id":"CCMSLIB00017308790","spectrum_index":45583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 978.9797 Da; putative annotation: N/A; putative formula: C66H126N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1201.08,"smiles":null,"spectrum_id":"CCMSLIB00017308794","spectrum_index":45584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 254.235 Da; putative annotation: N/A; putative formula: C15H30N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.306,"smiles":null,"spectrum_id":"CCMSLIB00017308797","spectrum_index":45585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 316.13 Da; putative annotation: N/A; putative formula: C12H21N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.19,"smiles":null,"spectrum_id":"CCMSLIB00017308800","spectrum_index":45586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 128.9658 Da; putative annotation: N/A; putative formula: CN5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.078,"smiles":null,"spectrum_id":"CCMSLIB00017308803","spectrum_index":45587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 104.0108 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.134,"smiles":null,"spectrum_id":"CCMSLIB00017308806","spectrum_index":45588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 106.0408 Da; putative annotation: N/A; putative formula: CH7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.205,"smiles":null,"spectrum_id":"CCMSLIB00017308809","spectrum_index":45589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 299.0794 Da; putative annotation: N/A; putative formula: C16H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.181,"smiles":null,"spectrum_id":"CCMSLIB00017308812","spectrum_index":45590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 78.8179 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.946,"smiles":null,"spectrum_id":"CCMSLIB00017308815","spectrum_index":45591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arthrobactin (delta mass: 70.0053 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.261,"smiles":null,"spectrum_id":"CCMSLIB00017308818","spectrum_index":45592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 54.0093 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.133,"smiles":null,"spectrum_id":"CCMSLIB00017308821","spectrum_index":45593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA000880 Galantamine (delta mass: 40.9976 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.157,"smiles":null,"spectrum_id":"CCMSLIB00017308824","spectrum_index":45594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 665.2385 Da; putative annotation: N/A; putative formula: C48H32N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1008.36,"smiles":null,"spectrum_id":"CCMSLIB00017308827","spectrum_index":45595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 276.1579 Da; putative annotation: N/A; putative formula: C14H28OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.234,"smiles":null,"spectrum_id":"CCMSLIB00017308830","spectrum_index":45596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PAR_146.0966_8.3 (delta mass: 18.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.129,"smiles":null,"spectrum_id":"CCMSLIB00017308832","spectrum_index":45597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.beta.-Homoglutamine (delta mass: 238.2303 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.322,"smiles":null,"spectrum_id":"CCMSLIB00017308835","spectrum_index":45598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 18.9922 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.079,"smiles":null,"spectrum_id":"CCMSLIB00017308838","spectrum_index":45599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolidine CollisionEnergy:102040 (delta mass: 59.0737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.207,"smiles":null,"spectrum_id":"CCMSLIB00017308841","spectrum_index":45600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 60.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017308844","spectrum_index":45601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 93.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.048,"smiles":null,"spectrum_id":"CCMSLIB00017308845","spectrum_index":45602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1-octanamine (delta mass: 35.9762 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.198,"smiles":null,"spectrum_id":"CCMSLIB00017308848","spectrum_index":45603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 494.1719 Da; putative annotation: N/A; putative formula: C25H27N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":837.295,"smiles":null,"spectrum_id":"CCMSLIB00017308851","spectrum_index":45604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00918 Demethoxycurcumin (delta mass: 270.1103 Da; putative annotation: N/A; putative formula: C13H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.233,"smiles":null,"spectrum_id":"CCMSLIB00017308854","spectrum_index":45605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 273.0974 Da; putative annotation: N/A; putative formula: C11H11N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.195,"smiles":null,"spectrum_id":"CCMSLIB00017308857","spectrum_index":45606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 174.0679 Da; putative annotation: N/A; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.139,"smiles":null,"spectrum_id":"CCMSLIB00017308860","spectrum_index":45607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 176.0835 Da; putative annotation: N/A; putative formula: C11H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.138,"smiles":null,"spectrum_id":"CCMSLIB00017308863","spectrum_index":45608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 79.0943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.248,"smiles":null,"spectrum_id":"CCMSLIB00017308866","spectrum_index":45609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(3-Aminopropyl)-N1-methylpropane-1,3-diamine (delta mass: 206.1667 Da; putative annotation: N/A; putative formula: C14H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.332,"smiles":null,"spectrum_id":"CCMSLIB00017308869","spectrum_index":45610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Cyclohexyl-2,3,3a,4,5,6-hexahydro-1H-pyrazino[3,2,1-jk]carbazole (delta mass: 81.0896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.306,"smiles":null,"spectrum_id":"CCMSLIB00017308872","spectrum_index":45611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 220.0213 Da; putative annotation: N/A; putative formula: C12H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.123,"smiles":null,"spectrum_id":"CCMSLIB00017308874","spectrum_index":45612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 296.0419 Da; putative annotation: N/A; putative formula: C9H17N2O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.102,"smiles":null,"spectrum_id":"CCMSLIB00017308877","spectrum_index":45613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 53.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.16,"smiles":null,"spectrum_id":"CCMSLIB00017308880","spectrum_index":45614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tinazoline (delta mass: 17.0339 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.109,"smiles":null,"spectrum_id":"CCMSLIB00017308883","spectrum_index":45615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 77.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.166,"smiles":null,"spectrum_id":"CCMSLIB00017308886","spectrum_index":45616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 199.1059 Da; putative annotation: N/A; putative formula: C7H13N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.239,"smiles":null,"spectrum_id":"CCMSLIB00017308889","spectrum_index":45617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of E-N-Deoxyfructosyllysine (delta mass: 486.1581 Da; putative annotation: N/A; putative formula: C23H36O3P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.324,"smiles":null,"spectrum_id":"CCMSLIB00017308892","spectrum_index":45618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 16.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.196,"smiles":null,"spectrum_id":"CCMSLIB00017308894","spectrum_index":45619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 79.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.181,"smiles":null,"spectrum_id":"CCMSLIB00017308897","spectrum_index":45620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 60.1078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.167,"smiles":null,"spectrum_id":"CCMSLIB00017308900","spectrum_index":45621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 385.138 Da; putative annotation: N/A; putative formula: C18H27NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.25,"smiles":null,"spectrum_id":"CCMSLIB00017308904","spectrum_index":45622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 327.1614 Da; putative annotation: N/A; putative formula: C17H22N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.258,"smiles":null,"spectrum_id":"CCMSLIB00017308907","spectrum_index":45623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 79.078 Da; putative annotation: N/A; putative formula: C6H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.144,"smiles":null,"spectrum_id":"CCMSLIB00017308910","spectrum_index":45624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Blood Group A Trisaccharide (delta mass: 149.0583 Da; putative annotation: N/A; putative formula: C7H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.266,"smiles":null,"spectrum_id":"CCMSLIB00017308913","spectrum_index":45625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 331.0898 Da; putative annotation: N/A; putative formula: C13H17NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.254,"smiles":null,"spectrum_id":"CCMSLIB00017308916","spectrum_index":45626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 13.0316 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":118.086,"smiles":null,"spectrum_id":"CCMSLIB00017308919","spectrum_index":45627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 207.1887 Da; putative annotation: N/A; putative formula: C11H21N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.267,"smiles":null,"spectrum_id":"CCMSLIB00017308922","spectrum_index":45628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 8.0046 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.128,"smiles":null,"spectrum_id":"CCMSLIB00017308925","spectrum_index":45629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 105.0429 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.155,"smiles":null,"spectrum_id":"CCMSLIB00017308928","spectrum_index":45630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-His (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.193,"smiles":null,"spectrum_id":"CCMSLIB00017308931","spectrum_index":45631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 133.9938 Da; putative annotation: N/A; putative formula: C6H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.065,"smiles":null,"spectrum_id":"CCMSLIB00017308934","spectrum_index":45632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU161803 Ecgonine-methyl-ester (EME)|AC1L9FBF|methyl (3S,4R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate (delta mass: 209.1056 Da; putative annotation: N/A; putative formula: C11H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.234,"smiles":null,"spectrum_id":"CCMSLIB00017308937","spectrum_index":45633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 84.9886 Da; putative annotation: N/A; putative formula: CH-1N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.031,"smiles":null,"spectrum_id":"CCMSLIB00017308940","spectrum_index":45634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 182.0662 Da; putative annotation: N/A; putative formula: C4H6N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.21,"smiles":null,"spectrum_id":"CCMSLIB00017308943","spectrum_index":45635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 44.059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.296,"smiles":null,"spectrum_id":"CCMSLIB00017308946","spectrum_index":45636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 108.0333 Da; putative annotation: N/A; putative formula: C5H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.125,"smiles":null,"spectrum_id":"CCMSLIB00017308949","spectrum_index":45637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 101.0837 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.159,"smiles":null,"spectrum_id":"CCMSLIB00017308952","spectrum_index":45638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 68.0746 Da; putative annotation: N/A; putative formula: C4H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.124,"smiles":null,"spectrum_id":"CCMSLIB00017308954","spectrum_index":45639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 38.9916 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.104,"smiles":null,"spectrum_id":"CCMSLIB00017308957","spectrum_index":45640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 36.5651 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.656,"smiles":null,"spectrum_id":"CCMSLIB00017308960","spectrum_index":45641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311158 Methoxytyramine (delta mass: 486.2272 Da; putative annotation: N/A; putative formula: C21H30N10O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.329,"smiles":null,"spectrum_id":"CCMSLIB00017308963","spectrum_index":45642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 144.1659 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.237,"smiles":null,"spectrum_id":"CCMSLIB00017308966","spectrum_index":45643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 183.0894 Da; putative annotation: N/A; putative formula: C9H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017308969","spectrum_index":45644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 40.0309 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.148,"smiles":null,"spectrum_id":"CCMSLIB00017308972","spectrum_index":45645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 91.0985 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.201,"smiles":null,"spectrum_id":"CCMSLIB00017308975","spectrum_index":45646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 692.9707 Da; putative annotation: N/A; putative formula: C22H19N3O15S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1368.22,"smiles":null,"spectrum_id":"CCMSLIB00017308977","spectrum_index":45647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 30.0351 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017308980","spectrum_index":45648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 323.2 Da; putative annotation: N/A; putative formula: C20H25N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.25,"smiles":null,"spectrum_id":"CCMSLIB00017308984","spectrum_index":45649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 35.0132 Da; putative annotation: N/A; putative formula: C3HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.094,"smiles":null,"spectrum_id":"CCMSLIB00017308987","spectrum_index":45650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 188.1041 Da; putative annotation: N/A; putative formula: C9H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.169,"smiles":null,"spectrum_id":"CCMSLIB00017308990","spectrum_index":45651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 312.1164 Da; putative annotation: N/A; putative formula: C12H25O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.265,"smiles":null,"spectrum_id":"CCMSLIB00017308993","spectrum_index":45652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 40.0508 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.122,"smiles":null,"spectrum_id":"CCMSLIB00017308997","spectrum_index":45653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxyindole; AIF; CE10; MS2Dec (delta mass: 262.2053 Da; putative annotation: N/A; putative formula: C16H26N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.281,"smiles":null,"spectrum_id":"CCMSLIB00017308999","spectrum_index":45654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 472.2109 Da; putative annotation: N/A; putative formula: C20H45O2P5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.271,"smiles":null,"spectrum_id":"CCMSLIB00017309002","spectrum_index":45655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 157.0824 Da; putative annotation: N/A; putative formula: C6H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.18,"smiles":null,"spectrum_id":"CCMSLIB00017309005","spectrum_index":45656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 54.0322 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.176,"smiles":null,"spectrum_id":"CCMSLIB00017309008","spectrum_index":45657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 144.0519 Da; putative annotation: N/A; putative formula: C7H13O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.192,"smiles":null,"spectrum_id":"CCMSLIB00017309011","spectrum_index":45658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 124.0065 Da; putative annotation: N/A; putative formula: H6N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.13,"smiles":null,"spectrum_id":"CCMSLIB00017309014","spectrum_index":45659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 99.0797 Da; putative annotation: N/A; putative formula: C4H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.218,"smiles":null,"spectrum_id":"CCMSLIB00017309018","spectrum_index":45660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 37.9231 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.014,"smiles":null,"spectrum_id":"CCMSLIB00017309021","spectrum_index":45661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 106.0778 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.132,"smiles":null,"spectrum_id":"CCMSLIB00017309023","spectrum_index":45662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 76.067 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.127,"smiles":null,"spectrum_id":"CCMSLIB00017309026","spectrum_index":45663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 134.0556 Da; putative annotation: N/A; putative formula: C9H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.22,"smiles":null,"spectrum_id":"CCMSLIB00017309029","spectrum_index":45664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 251.2245 Da; putative annotation: N/A; putative formula: C16H29NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.347,"smiles":null,"spectrum_id":"CCMSLIB00017309032","spectrum_index":45665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 267.1825 Da; putative annotation: N/A; putative formula: C15H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.263,"smiles":null,"spectrum_id":"CCMSLIB00017309035","spectrum_index":45666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 106.0781 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.315,"smiles":null,"spectrum_id":"CCMSLIB00017309038","spectrum_index":45667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1-octanamine (delta mass: 127.052 Da; putative annotation: N/A; putative formula: C8H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.274,"smiles":null,"spectrum_id":"CCMSLIB00017309041","spectrum_index":45668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 250.1749 Da; putative annotation: N/A; putative formula: C8H22N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.282,"smiles":null,"spectrum_id":"CCMSLIB00017309044","spectrum_index":45669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4-(Difluoromethoxy)-3-methoxyphenyl]methanamine (delta mass: 91.0138 Da; putative annotation: N/A; putative formula: C4HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.097,"smiles":null,"spectrum_id":"CCMSLIB00017309047","spectrum_index":45670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 103.0624 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.143,"smiles":null,"spectrum_id":"CCMSLIB00017309050","spectrum_index":45671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 193.0737 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.17,"smiles":null,"spectrum_id":"CCMSLIB00017309052","spectrum_index":45672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 36.0669 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.168,"smiles":null,"spectrum_id":"CCMSLIB00017309055","spectrum_index":45673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Val (delta mass: 99.0684 Da; putative annotation: Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.182,"smiles":null,"spectrum_id":"CCMSLIB00017309058","spectrum_index":45674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Phe (delta mass: 147.0685 Da; putative annotation: L-Phenylalanine; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.213,"smiles":null,"spectrum_id":"CCMSLIB00017309061","spectrum_index":45675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 242.0937 Da; putative annotation: Parishin C; putative formula: C15H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.164,"smiles":null,"spectrum_id":"CCMSLIB00017309063","spectrum_index":45676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 1086.5619 Da; putative annotation: (2S,3S,4S,5R,6R)-4-{[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxy-6-{[(1S,2R,4S,5R,10S,13R,17S)-2-hydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.0,?.0?,?.0?,?.0?,]tetracosan-10-yl]oxy}-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-2-carboxylic acid; putative formula: C54H86O22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1267.63,"smiles":null,"spectrum_id":"CCMSLIB00017309066","spectrum_index":45677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 264.246 Da; putative annotation: cis-Vaccenic acid; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.322,"smiles":null,"spectrum_id":"CCMSLIB00017309068","spectrum_index":45678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 224.1416 Da; putative annotation: NCGC00385897-01_C13H22O4_6-Oxabicyclo[3.2.1]octane-3,8-diol, 8-[(1E)-3-hydroxy-1-buten-1-yl]-1,5-dimethyl-; putative formula: C13H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.254,"smiles":null,"spectrum_id":"CCMSLIB00017309071","spectrum_index":45679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 274.0263 Da; putative annotation: N/A; putative formula: C17H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.086,"smiles":null,"spectrum_id":"CCMSLIB00017309074","spectrum_index":45680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 22.8017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.904,"smiles":null,"spectrum_id":"CCMSLIB00017309077","spectrum_index":45681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(2-Oxo-2,3-dihydro-1H-indol-3-yl)acetic acid CollisionEnergy:205060\"\" (delta mass: 60.0215 Da; putative annotation: N/A; putative formula: C2H4O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017309079","spectrum_index":45682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 3.9937 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.059,"smiles":null,"spectrum_id":"CCMSLIB00017309082","spectrum_index":45683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 308.2101 Da; putative annotation: N/A; putative formula: C17H28N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.296,"smiles":null,"spectrum_id":"CCMSLIB00017309084","spectrum_index":45684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 273.1947 Da; putative annotation: N/A; putative formula: C15H31NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.307,"smiles":null,"spectrum_id":"CCMSLIB00017309087","spectrum_index":45685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cinchonine (delta mass: 40.0406 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.221,"smiles":null,"spectrum_id":"CCMSLIB00017309090","spectrum_index":45686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 35.9975 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.037,"smiles":null,"spectrum_id":"CCMSLIB00017309093","spectrum_index":45687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 129.0541 Da; putative annotation: N/A; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.151,"smiles":null,"spectrum_id":"CCMSLIB00017309096","spectrum_index":45688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 247.199 Da; putative annotation: N/A; putative formula: C10H25N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.369,"smiles":null,"spectrum_id":"CCMSLIB00017309098","spectrum_index":45689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 8.0051 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.102,"smiles":null,"spectrum_id":"CCMSLIB00017309101","spectrum_index":45690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 99.0326 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017309104","spectrum_index":45691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 197.0908 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.229,"smiles":null,"spectrum_id":"CCMSLIB00017309107","spectrum_index":45692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 327.2069 Da; putative annotation: N/A; putative formula: C16H30N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.283,"smiles":null,"spectrum_id":"CCMSLIB00017309109","spectrum_index":45693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 218.1672 Da; putative annotation: N/A; putative formula: C15H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.259,"smiles":null,"spectrum_id":"CCMSLIB00017309112","spectrum_index":45694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 126.9168 Da; putative annotation: N/A; putative formula: H2NO-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.977,"smiles":null,"spectrum_id":"CCMSLIB00017309115","spectrum_index":45695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 82.0103 Da; putative annotation: N/A; putative formula: C3H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.086,"smiles":null,"spectrum_id":"CCMSLIB00017309118","spectrum_index":45696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 223.1912 Da; putative annotation: N/A; putative formula: C10H21N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.34,"smiles":null,"spectrum_id":"CCMSLIB00017309120","spectrum_index":45697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanylglycine (delta mass: 27.9989 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.075,"smiles":null,"spectrum_id":"CCMSLIB00017309123","spectrum_index":45698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 213.1437 Da; putative annotation: N/A; putative formula: C9H19N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.245,"smiles":null,"spectrum_id":"CCMSLIB00017309126","spectrum_index":45699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 103.0415 Da; putative annotation: N/A; putative formula: C7H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017309129","spectrum_index":45700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 88.0166 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.103,"smiles":null,"spectrum_id":"CCMSLIB00017309130","spectrum_index":45701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 132.0847 Da; putative annotation: N/A; putative formula: C4H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.186,"smiles":null,"spectrum_id":"CCMSLIB00017309133","spectrum_index":45702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 334.1163 Da; putative annotation: N/A; putative formula: C16H18N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.203,"smiles":null,"spectrum_id":"CCMSLIB00017309136","spectrum_index":45703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00160283-01!1-(8-Quinolinyl)-beta-carboline (delta mass: 46.0142 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.132,"smiles":null,"spectrum_id":"CCMSLIB00017309139","spectrum_index":45704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 222.0498 Da; putative annotation: N/A; putative formula: C7H14N2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.11,"smiles":null,"spectrum_id":"CCMSLIB00017309141","spectrum_index":45705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 473.2001 Da; putative annotation: N/A; putative formula: C22H36NO6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.312,"smiles":null,"spectrum_id":"CCMSLIB00017309144","spectrum_index":45706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 625.3608 Da; putative annotation: N/A; putative formula: C30H52N5O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.458,"smiles":null,"spectrum_id":"CCMSLIB00017309147","spectrum_index":45707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[(2S)-2-Azetidinylmethoxy]pyridine (delta mass: 61.005 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017309149","spectrum_index":45708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C16:1 (delta mass: 1.8957 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.275,"smiles":null,"spectrum_id":"CCMSLIB00017309152","spectrum_index":45709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 223.9803 Da; putative annotation: N/A; putative formula: C5H4O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.104,"smiles":null,"spectrum_id":"CCMSLIB00017309155","spectrum_index":45710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 221.0898 Da; putative annotation: N/A; putative formula: C8H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.254,"smiles":null,"spectrum_id":"CCMSLIB00017309158","spectrum_index":45711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 488.3493 Da; putative annotation: N/A; putative formula: C24H49N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":833.519,"smiles":null,"spectrum_id":"CCMSLIB00017309161","spectrum_index":45712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 64.0197 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.122,"smiles":null,"spectrum_id":"CCMSLIB00017309163","spectrum_index":45713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 95.0744 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.156,"smiles":null,"spectrum_id":"CCMSLIB00017309166","spectrum_index":45714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 200.0991 Da; putative annotation: N/A; putative formula: C17H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.212,"smiles":null,"spectrum_id":"CCMSLIB00017309169","spectrum_index":45715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-1H-indole (delta mass: 30.0566 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.133,"smiles":null,"spectrum_id":"CCMSLIB00017309172","spectrum_index":45716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Pro-Lys from NIST14 (delta mass: 243.116 Da; putative annotation: N/A; putative formula: C17H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.35,"smiles":null,"spectrum_id":"CCMSLIB00017309175","spectrum_index":45717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1019.777 Da; putative annotation: N/A; putative formula: C59H101N7O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1241.87,"smiles":null,"spectrum_id":"CCMSLIB00017309177","spectrum_index":45718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 179.101 Da; putative annotation: N/A; putative formula: C4H13N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.165,"smiles":null,"spectrum_id":"CCMSLIB00017309180","spectrum_index":45719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 118.1146 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.352,"smiles":null,"spectrum_id":"CCMSLIB00017309183","spectrum_index":45720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110101 Terbutaline|5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol (delta mass: 254.2246 Da; putative annotation: N/A; putative formula: C16H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.368,"smiles":null,"spectrum_id":"CCMSLIB00017309186","spectrum_index":45721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 30.0 eV (delta mass: 720.2712 Da; putative annotation: N/A; putative formula: C51H36N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1063.39,"smiles":null,"spectrum_id":"CCMSLIB00017309188","spectrum_index":45722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 207.0098 Da; putative annotation: N/A; putative formula: HN9O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.086,"smiles":null,"spectrum_id":"CCMSLIB00017309191","spectrum_index":45723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 270.183 Da; putative annotation: N/A; putative formula: C15H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.231,"smiles":null,"spectrum_id":"CCMSLIB00017309194","spectrum_index":45724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 174.0006 Da; putative annotation: N/A; putative formula: C7H2N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.065,"smiles":null,"spectrum_id":"CCMSLIB00017309196","spectrum_index":45725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 101.0725 Da; putative annotation: N/A; putative formula: C2H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.221,"smiles":null,"spectrum_id":"CCMSLIB00017309199","spectrum_index":45726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 153.0788 Da; putative annotation: N/A; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017309202","spectrum_index":45727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 70.03 Da; putative annotation: N/A; putative formula: CH2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.216,"smiles":null,"spectrum_id":"CCMSLIB00017309205","spectrum_index":45728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 130.055 Da; putative annotation: N/A; putative formula: C8H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.152,"smiles":null,"spectrum_id":"CCMSLIB00017309208","spectrum_index":45729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310825 N-Fructosyl isoleucine (delta mass: 56.0635 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.218,"smiles":null,"spectrum_id":"CCMSLIB00017309210","spectrum_index":45730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 62.0157 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.139,"smiles":null,"spectrum_id":"CCMSLIB00017309213","spectrum_index":45731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 78.0911 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.193,"smiles":null,"spectrum_id":"CCMSLIB00017309215","spectrum_index":45732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 119.0862 Da; putative annotation: N/A; putative formula: C7H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.183,"smiles":null,"spectrum_id":"CCMSLIB00017309218","spectrum_index":45733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 28.0342 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.131,"smiles":null,"spectrum_id":"CCMSLIB00017309221","spectrum_index":45734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 716.4599 Da; putative annotation: N/A; putative formula: C45H68N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.546,"smiles":null,"spectrum_id":"CCMSLIB00017309224","spectrum_index":45735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 181.0889 Da; putative annotation: N/A; putative formula: C13H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.244,"smiles":null,"spectrum_id":"CCMSLIB00017309226","spectrum_index":45736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 124.0673 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.133,"smiles":null,"spectrum_id":"CCMSLIB00017309229","spectrum_index":45737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 60.0614 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.121,"smiles":null,"spectrum_id":"CCMSLIB00017309231","spectrum_index":45738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 28.0972 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.173,"smiles":null,"spectrum_id":"CCMSLIB00017309234","spectrum_index":45739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Heptyl-4-hydroxyquinoline N-oxide (delta mass: 46.0051 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.17,"smiles":null,"spectrum_id":"CCMSLIB00017309237","spectrum_index":45740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 78.0469 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017309240","spectrum_index":45741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 95.0552 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.131,"smiles":null,"spectrum_id":"CCMSLIB00017309242","spectrum_index":45742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,11-Dihydro-16H-benzo[a]carbazole (delta mass: 74.033 Da; putative annotation: N/A; putative formula: C2H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.145,"smiles":null,"spectrum_id":"CCMSLIB00017309245","spectrum_index":45743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 323.1581 Da; putative annotation: N/A; putative formula: C13H25NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.234,"smiles":null,"spectrum_id":"CCMSLIB00017309248","spectrum_index":45744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 82.0416 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.138,"smiles":null,"spectrum_id":"CCMSLIB00017309251","spectrum_index":45745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE\"\" (delta mass: 109.0379 Da; putative annotation: N/A; putative formula: C3H3N5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.14,"smiles":null,"spectrum_id":"CCMSLIB00017309254","spectrum_index":45746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 116.0837 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.175,"smiles":null,"spectrum_id":"CCMSLIB00017309256","spectrum_index":45747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 459.1534 Da; putative annotation: N/A; putative formula: C26H26N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.214,"smiles":null,"spectrum_id":"CCMSLIB00017309258","spectrum_index":45748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 73.0883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.217,"smiles":null,"spectrum_id":"CCMSLIB00017309261","spectrum_index":45749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 365.3051 Da; putative annotation: N/A; putative formula: C21H39N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.429,"smiles":null,"spectrum_id":"CCMSLIB00017309264","spectrum_index":45750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 42.9793 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.091,"smiles":null,"spectrum_id":"CCMSLIB00017309267","spectrum_index":45751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 120.0219 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.077,"smiles":null,"spectrum_id":"CCMSLIB00017309269","spectrum_index":45752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 274.4131 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.593,"smiles":null,"spectrum_id":"CCMSLIB00017309272","spectrum_index":45753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-3-Hexen-1-ol (delta mass: 250.1781 Da; putative annotation: N/A; putative formula: C13H22N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.274,"smiles":null,"spectrum_id":"CCMSLIB00017309274","spectrum_index":45754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 511.1954 Da; putative annotation: N/A; putative formula: C26H29N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.292,"smiles":null,"spectrum_id":"CCMSLIB00017309277","spectrum_index":45755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300460 Emetine (delta mass: 479.2724 Da; putative annotation: N/A; putative formula: C35H33N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.578,"smiles":null,"spectrum_id":"CCMSLIB00017309280","spectrum_index":45756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(5-fluoropentyl)- (delta mass: 17.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.145,"smiles":null,"spectrum_id":"CCMSLIB00017309283","spectrum_index":45757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloyl dopamine (delta mass: 276.1052 Da; putative annotation: N/A; putative formula: C21H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.239,"smiles":null,"spectrum_id":"CCMSLIB00017309285","spectrum_index":45758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 72.0288 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.198,"smiles":null,"spectrum_id":"CCMSLIB00017309288","spectrum_index":45759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 49.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.175,"smiles":null,"spectrum_id":"CCMSLIB00017309290","spectrum_index":45760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 196.0966 Da; putative annotation: N/A; putative formula: C8H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.188,"smiles":null,"spectrum_id":"CCMSLIB00017309293","spectrum_index":45761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 149.011 Da; putative annotation: N/A; putative formula: C7H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.138,"smiles":null,"spectrum_id":"CCMSLIB00017309296","spectrum_index":45762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 210.2237 Da; putative annotation: N/A; putative formula: C12H26N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.31,"smiles":null,"spectrum_id":"CCMSLIB00017309299","spectrum_index":45763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 264.9824 Da; putative annotation: N/A; putative formula: C7H10NO4P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.053,"smiles":null,"spectrum_id":"CCMSLIB00017309301","spectrum_index":45764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 205.145 Da; putative annotation: N/A; putative formula: C9H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.294,"smiles":null,"spectrum_id":"CCMSLIB00017309303","spectrum_index":45765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine methyl ester (delta mass: 98.0729 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.147,"smiles":null,"spectrum_id":"CCMSLIB00017309306","spectrum_index":45766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 627.6086 Da; putative annotation: N/A; putative formula: C41H77N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.68,"smiles":null,"spectrum_id":"CCMSLIB00017309309","spectrum_index":45767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 100.0373 Da; putative annotation: N/A; putative formula: C2H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.108,"smiles":null,"spectrum_id":"CCMSLIB00017309312","spectrum_index":45768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 30.4403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017309315","spectrum_index":45769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 8.4137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017309317","spectrum_index":45770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin - 30.0 eV (delta mass: 68.0375 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.14,"smiles":null,"spectrum_id":"CCMSLIB00017309320","spectrum_index":45771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 374.2467 Da; putative annotation: N/A; putative formula: C24H38O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.307,"smiles":null,"spectrum_id":"CCMSLIB00017309322","spectrum_index":45772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311040 Threonylleucine (isomer of 809, 926) (delta mass: 212.1159 Da; putative annotation: N/A; putative formula: C10H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.266,"smiles":null,"spectrum_id":"CCMSLIB00017309326","spectrum_index":45773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 298.2053 Da; putative annotation: N/A; putative formula: C19H26N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.355,"smiles":null,"spectrum_id":"CCMSLIB00017309328","spectrum_index":45774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Heptanone, 1,7-bis(3,4-dihydroxyphenyl)-6-methoxy- (delta mass: 27.9951 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.16,"smiles":null,"spectrum_id":"CCMSLIB00017309331","spectrum_index":45775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 102.0468 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017309334","spectrum_index":45776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 25.9789 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.133,"smiles":null,"spectrum_id":"CCMSLIB00017309337","spectrum_index":45777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.206,"smiles":null,"spectrum_id":"CCMSLIB00017309340","spectrum_index":45778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYLTYRAMINE (delta mass: 33.0236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.131,"smiles":null,"spectrum_id":"CCMSLIB00017309342","spectrum_index":45779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 327.1436 Da; putative annotation: N/A; putative formula: C15H25N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.262,"smiles":null,"spectrum_id":"CCMSLIB00017309345","spectrum_index":45780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 174.0884 Da; putative annotation: N/A; putative formula: C8H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.186,"smiles":null,"spectrum_id":"CCMSLIB00017309348","spectrum_index":45781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 49.0136 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.11,"smiles":null,"spectrum_id":"CCMSLIB00017309351","spectrum_index":45782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 88.0676 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.492,"smiles":null,"spectrum_id":"CCMSLIB00017309352","spectrum_index":45783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 213.0789 Da; putative annotation: N/A; putative formula: C13H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.155,"smiles":null,"spectrum_id":"CCMSLIB00017309355","spectrum_index":45784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 239.1367 Da; putative annotation: N/A; putative formula: C13H23NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.207,"smiles":null,"spectrum_id":"CCMSLIB00017309358","spectrum_index":45785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 57.0578 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.113,"smiles":null,"spectrum_id":"CCMSLIB00017309361","spectrum_index":45786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 572.3346 Da; putative annotation: N/A; putative formula: C28H53N4O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.421,"smiles":null,"spectrum_id":"CCMSLIB00017309364","spectrum_index":45787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110001 Salbutamol|Albuterol|4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol (delta mass: 18.9483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017309366","spectrum_index":45788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 225.1052 Da; putative annotation: N/A; putative formula: C9H15N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.169,"smiles":null,"spectrum_id":"CCMSLIB00017309369","spectrum_index":45789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 239.1672 Da; putative annotation: N/A; putative formula: C17H21N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.238,"smiles":null,"spectrum_id":"CCMSLIB00017309371","spectrum_index":45790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 207.1165 Da; putative annotation: N/A; putative formula: C6H19N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.219,"smiles":null,"spectrum_id":"CCMSLIB00017309374","spectrum_index":45791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 294.1218 Da; putative annotation: N/A; putative formula: C16H25O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.193,"smiles":null,"spectrum_id":"CCMSLIB00017309379","spectrum_index":45792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 24.9956 Da; putative annotation: N/A; putative formula: C25H37N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.061,"smiles":null,"spectrum_id":"CCMSLIB00017309381","spectrum_index":45793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 348.0863 Da; putative annotation: N/A; putative formula: C11H12N10O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.151,"smiles":null,"spectrum_id":"CCMSLIB00017309383","spectrum_index":45794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.227,"smiles":null,"spectrum_id":"CCMSLIB00017309386","spectrum_index":45795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 285.194 Da; putative annotation: N/A; putative formula: C15H27NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.26,"smiles":null,"spectrum_id":"CCMSLIB00017309389","spectrum_index":45796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310824 N-Fructosyl isoleucine (delta mass: 229.0513 Da; putative annotation: N/A; putative formula: C8H11N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.206,"smiles":null,"spectrum_id":"CCMSLIB00017309392","spectrum_index":45797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 35.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.212,"smiles":null,"spectrum_id":"CCMSLIB00017309395","spectrum_index":45798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-methyl-4-(pyridin-2-yl)but-3-yn-2-ol (delta mass: 296.3179 Da; putative annotation: N/A; putative formula: C19H40N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.409,"smiles":null,"spectrum_id":"CCMSLIB00017309396","spectrum_index":45799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 116.9243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.0,"smiles":null,"spectrum_id":"CCMSLIB00017309399","spectrum_index":45800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 136.0161 Da; putative annotation: N/A; putative formula: C7H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.066,"smiles":null,"spectrum_id":"CCMSLIB00017309402","spectrum_index":45801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 809.2766 Da; putative annotation: N/A; putative formula: C39H47N5O10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.337,"smiles":null,"spectrum_id":"CCMSLIB00017309405","spectrum_index":45802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 311.0399 Da; putative annotation: N/A; putative formula: C12H13N3O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.111,"smiles":null,"spectrum_id":"CCMSLIB00017309407","spectrum_index":45803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 74.0515 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017309409","spectrum_index":45804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 162.0306 Da; putative annotation: 5-Acetyl-2-hydroxybenzoic acid; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.101,"smiles":null,"spectrum_id":"CCMSLIB00017309412","spectrum_index":45805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 216.0821 Da; putative annotation: 7-Acetyl-3,6-dihydroxy-8-methyl-3,4-dihydronaphthalen-1(2H)-one; putative formula: C13H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.251,"smiles":null,"spectrum_id":"CCMSLIB00017309415","spectrum_index":45806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 124.0161 Da; putative annotation: 5-Hydroxymethyl-2-furancarboxylic acid; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017309418","spectrum_index":45807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 138.1041 Da; putative annotation: (2-Hydroxymethylbicyclo[2.2.1]hept-2-yl)methanol; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.341,"smiles":null,"spectrum_id":"CCMSLIB00017309420","spectrum_index":45808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 143.0732 Da; putative annotation: 3-(2-Hydroxyethyl)indole; putative formula: C10H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.197,"smiles":null,"spectrum_id":"CCMSLIB00017309422","spectrum_index":45809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 281.2765 Da; putative annotation: Spectral Match to D-erythro-C18-Sphingosine from NIST14; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.4,"smiles":null,"spectrum_id":"CCMSLIB00017309426","spectrum_index":45810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 113.0842 Da; putative annotation: 6-Aminocaproic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.171,"smiles":null,"spectrum_id":"CCMSLIB00017309428","spectrum_index":45811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.103,"smiles":null,"spectrum_id":"CCMSLIB00017309431","spectrum_index":45812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 242.1142 Da; putative annotation: N/A; putative formula: C9H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.201,"smiles":null,"spectrum_id":"CCMSLIB00017309434","spectrum_index":45813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 140.0585 Da; putative annotation: N/A; putative formula: C6H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.155,"smiles":null,"spectrum_id":"CCMSLIB00017309437","spectrum_index":45814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 146.1264 Da; putative annotation: N/A; putative formula: C4H14N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.207,"smiles":null,"spectrum_id":"CCMSLIB00017309439","spectrum_index":45815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aflatoxin M1 (delta mass: 15.0222 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.088,"smiles":null,"spectrum_id":"CCMSLIB00017309442","spectrum_index":45816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 59.0377 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.181,"smiles":null,"spectrum_id":"CCMSLIB00017309445","spectrum_index":45817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 327.2766 Da; putative annotation: N/A; putative formula: C19H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.314,"smiles":null,"spectrum_id":"CCMSLIB00017309448","spectrum_index":45818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mitraphylline (delta mass: 530.1905 Da; putative annotation: N/A; putative formula: C29H31N4O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.371,"smiles":null,"spectrum_id":"CCMSLIB00017309450","spectrum_index":45819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 869.4434 Da; putative annotation: N/A; putative formula: C45H59N9O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1076.53,"smiles":null,"spectrum_id":"CCMSLIB00017309452","spectrum_index":45820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1,2,3,4-tetrahydroquinazolin-2-one (delta mass: 27.0193 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.106,"smiles":null,"spectrum_id":"CCMSLIB00017309455","spectrum_index":45821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 32.0188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.127,"smiles":null,"spectrum_id":"CCMSLIB00017309458","spectrum_index":45822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 297.3018 Da; putative annotation: N/A; putative formula: C15H35N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.393,"smiles":null,"spectrum_id":"CCMSLIB00017309461","spectrum_index":45823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 301.2013 Da; putative annotation: N/A; putative formula: C15H23N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.356,"smiles":null,"spectrum_id":"CCMSLIB00017309463","spectrum_index":45824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.16,"smiles":null,"spectrum_id":"CCMSLIB00017309467","spectrum_index":45825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 195.0113 Da; putative annotation: N/A; putative formula: C7H7N3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.135,"smiles":null,"spectrum_id":"CCMSLIB00017309468","spectrum_index":45826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 235.0781 Da; putative annotation: N/A; putative formula: C11H13N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.202,"smiles":null,"spectrum_id":"CCMSLIB00017309471","spectrum_index":45827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310692 Disaccharide(Hex-Hex) (delta mass: 17.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.145,"smiles":null,"spectrum_id":"CCMSLIB00017309474","spectrum_index":45828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 992.7303 Da; putative annotation: N/A; putative formula: C58H100N6O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1214.83,"smiles":null,"spectrum_id":"CCMSLIB00017309477","spectrum_index":45829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 107.0368 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.123,"smiles":null,"spectrum_id":"CCMSLIB00017309480","spectrum_index":45830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 465.2226 Da; putative annotation: N/A; putative formula: C21H31N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.293,"smiles":null,"spectrum_id":"CCMSLIB00017309483","spectrum_index":45831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 20.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.085,"smiles":null,"spectrum_id":"CCMSLIB00017309484","spectrum_index":45832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kainic Acid (delta mass: 46.0049 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.112,"smiles":null,"spectrum_id":"CCMSLIB00017309489","spectrum_index":45833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 20.999 Da; putative annotation: N/A; putative formula: C2H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.085,"smiles":null,"spectrum_id":"CCMSLIB00017309491","spectrum_index":45834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 286.6839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.77,"smiles":null,"spectrum_id":"CCMSLIB00017309493","spectrum_index":45835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 90.0832 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.336,"smiles":null,"spectrum_id":"CCMSLIB00017309496","spectrum_index":45836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 1H-indol-3-ylacetate (delta mass: 2.0137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017309499","spectrum_index":45837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 136.0165 Da; putative annotation: N/A; putative formula: C7H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.077,"smiles":null,"spectrum_id":"CCMSLIB00017309502","spectrum_index":45838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 257.1365 Da; putative annotation: N/A; putative formula: C13H24NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.234,"smiles":null,"spectrum_id":"CCMSLIB00017309505","spectrum_index":45839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 428.1768 Da; putative annotation: N/A; putative formula: C15H24N8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.274,"smiles":null,"spectrum_id":"CCMSLIB00017309508","spectrum_index":45840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 159.0508 Da; putative annotation: N/A; putative formula: C10H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.121,"smiles":null,"spectrum_id":"CCMSLIB00017309510","spectrum_index":45841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 31.139 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.262,"smiles":null,"spectrum_id":"CCMSLIB00017309513","spectrum_index":45842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 516.1569 Da; putative annotation: N/A; putative formula: C18H36N4O5S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.198,"smiles":null,"spectrum_id":"CCMSLIB00017309515","spectrum_index":45843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 180.055 Da; putative annotation: N/A; putative formula: C9H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.1,"smiles":null,"spectrum_id":"CCMSLIB00017309518","spectrum_index":45844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ellipticine CollisionEnergy:205060 (delta mass: 244.0545 Da; putative annotation: N/A; putative formula: C5H12N2O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.177,"smiles":null,"spectrum_id":"CCMSLIB00017309521","spectrum_index":45845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 120.1142 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.195,"smiles":null,"spectrum_id":"CCMSLIB00017309524","spectrum_index":45846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 46.0095 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017309527","spectrum_index":45847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 27.074 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.171,"smiles":null,"spectrum_id":"CCMSLIB00017309529","spectrum_index":45848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uncarine D (delta mass: 344.1858 Da; putative annotation: N/A; putative formula: C19H20N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.367,"smiles":null,"spectrum_id":"CCMSLIB00017309531","spectrum_index":45849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 80.063 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.305,"smiles":null,"spectrum_id":"CCMSLIB00017309534","spectrum_index":45850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 415.1898 Da; putative annotation: N/A; putative formula: C25H25N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.344,"smiles":null,"spectrum_id":"CCMSLIB00017309537","spectrum_index":45851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Subsessiline (delta mass: 315.1087 Da; putative annotation: N/A; putative formula: C10H22NO8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.211,"smiles":null,"spectrum_id":"CCMSLIB00017309540","spectrum_index":45852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 732.4448 Da; putative annotation: N/A; putative formula: C39H52N14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":925.516,"smiles":null,"spectrum_id":"CCMSLIB00017309543","spectrum_index":45853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 84.0209 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.081,"smiles":null,"spectrum_id":"CCMSLIB00017309546","spectrum_index":45854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 40.0289 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.172,"smiles":null,"spectrum_id":"CCMSLIB00017309547","spectrum_index":45855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 112.0346 Da; putative annotation: N/A; putative formula: C6H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.131,"smiles":null,"spectrum_id":"CCMSLIB00017309550","spectrum_index":45856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hexen-1-ol, (E)- (delta mass: 38.0163 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.112,"smiles":null,"spectrum_id":"CCMSLIB00017309553","spectrum_index":45857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 161.9176 Da; putative annotation: N/A; putative formula: C4H3O-1PS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.087,"smiles":null,"spectrum_id":"CCMSLIB00017309556","spectrum_index":45858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 72.0195 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.09,"smiles":null,"spectrum_id":"CCMSLIB00017309557","spectrum_index":45859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylglutamine (delta mass: 238.2298 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.349,"smiles":null,"spectrum_id":"CCMSLIB00017309560","spectrum_index":45860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 571.2224 Da; putative annotation: N/A; putative formula: C21H37N3O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.351,"smiles":null,"spectrum_id":"CCMSLIB00017309563","spectrum_index":45861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 55.0422 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017309566","spectrum_index":45862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 120.0248 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.07,"smiles":null,"spectrum_id":"CCMSLIB00017309569","spectrum_index":45863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 45.0291 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.079,"smiles":null,"spectrum_id":"CCMSLIB00017309572","spectrum_index":45864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017309574","spectrum_index":45865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 244.1482 Da; putative annotation: N/A; putative formula: C15H21N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.25,"smiles":null,"spectrum_id":"CCMSLIB00017309576","spectrum_index":45866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU099405 8-Hydroxyquinoline|quinolin-8-ol (delta mass: 45.9116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.972,"smiles":null,"spectrum_id":"CCMSLIB00017309579","spectrum_index":45867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 34.0208 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.092,"smiles":null,"spectrum_id":"CCMSLIB00017309582","spectrum_index":45868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Tyrosine tert-butyl ester (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.139,"smiles":null,"spectrum_id":"CCMSLIB00017309585","spectrum_index":45869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palatinose (delta mass: 220.1687 Da; putative annotation: N/A; putative formula: C12H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.292,"smiles":null,"spectrum_id":"CCMSLIB00017309588","spectrum_index":45870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOSE (delta mass: 517.3401 Da; putative annotation: N/A; putative formula: C30H47NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.464,"smiles":null,"spectrum_id":"CCMSLIB00017309590","spectrum_index":45871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 287.1163 Da; putative annotation: N/A; putative formula: C9H17N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.255,"smiles":null,"spectrum_id":"CCMSLIB00017309593","spectrum_index":45872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 173.048 Da; putative annotation: N/A; putative formula: C10H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.15,"smiles":null,"spectrum_id":"CCMSLIB00017309596","spectrum_index":45873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 260.2127 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.283,"smiles":null,"spectrum_id":"CCMSLIB00017309599","spectrum_index":45874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 114.0812 Da; putative annotation: N/A; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.141,"smiles":null,"spectrum_id":"CCMSLIB00017309602","spectrum_index":45875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 74.0363 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.134,"smiles":null,"spectrum_id":"CCMSLIB00017309604","spectrum_index":45876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-(propylthio)phenylethylamine (delta mass: 45.0183 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.155,"smiles":null,"spectrum_id":"CCMSLIB00017309606","spectrum_index":45877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydromuronic acid (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.274,"smiles":null,"spectrum_id":"CCMSLIB00017309609","spectrum_index":45878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 186.0677 Da; putative annotation: N/A; putative formula: C12H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.217,"smiles":null,"spectrum_id":"CCMSLIB00017309612","spectrum_index":45879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE0; MS2Dec (delta mass: 40.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.071,"smiles":null,"spectrum_id":"CCMSLIB00017309615","spectrum_index":45880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 34.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.103,"smiles":null,"spectrum_id":"CCMSLIB00017309617","spectrum_index":45881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylose (delta mass: 156.0931 Da; putative annotation: N/A; putative formula: C6H13N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.153,"smiles":null,"spectrum_id":"CCMSLIB00017309619","spectrum_index":45882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 40.0 eV (delta mass: 169.028 Da; putative annotation: N/A; putative formula: C2H3N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.065,"smiles":null,"spectrum_id":"CCMSLIB00017309622","spectrum_index":45883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 15.0841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.155,"smiles":null,"spectrum_id":"CCMSLIB00017309625","spectrum_index":45884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 271.9999 Da; putative annotation: N/A; putative formula: C11H12O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.06,"smiles":null,"spectrum_id":"CCMSLIB00017309628","spectrum_index":45885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine (delta mass: 147.2484 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.392,"smiles":null,"spectrum_id":"CCMSLIB00017309630","spectrum_index":45886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 289.1426 Da; putative annotation: N/A; putative formula: C15H19N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.239,"smiles":null,"spectrum_id":"CCMSLIB00017309633","spectrum_index":45887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 672.388 Da; putative annotation: N/A; putative formula: C30H62N2O10P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":835.448,"smiles":null,"spectrum_id":"CCMSLIB00017309635","spectrum_index":45888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 623.2209 Da; putative annotation: N/A; putative formula: C42H29N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.307,"smiles":null,"spectrum_id":"CCMSLIB00017309638","spectrum_index":45889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 573.1538 Da; putative annotation: N/A; putative formula: C26H31N5O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.229,"smiles":null,"spectrum_id":"CCMSLIB00017309641","spectrum_index":45890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 77.0391 Da; putative annotation: N/A; putative formula: C4H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.082,"smiles":null,"spectrum_id":"CCMSLIB00017309644","spectrum_index":45891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 81.0575 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.144,"smiles":null,"spectrum_id":"CCMSLIB00017309647","spectrum_index":45892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 176.0692 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.193,"smiles":null,"spectrum_id":"CCMSLIB00017309648","spectrum_index":45893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-proline (delta mass: 42.0137 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.1,"smiles":null,"spectrum_id":"CCMSLIB00017309651","spectrum_index":45894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 68.0769 Da; putative annotation: N/A; putative formula: C4H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.19,"smiles":null,"spectrum_id":"CCMSLIB00017309654","spectrum_index":45895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 151.0623 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.149,"smiles":null,"spectrum_id":"CCMSLIB00017309657","spectrum_index":45896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 79.9899 Da; putative annotation: N/A; putative formula: C4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.07,"smiles":null,"spectrum_id":"CCMSLIB00017309660","spectrum_index":45897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 344.1546 Da; putative annotation: N/A; putative formula: C10H24N4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.236,"smiles":null,"spectrum_id":"CCMSLIB00017309663","spectrum_index":45898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 35.0248 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.147,"smiles":null,"spectrum_id":"CCMSLIB00017309665","spectrum_index":45899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-6-ol, 1-(4-methoxyphenyl)-2-methyl-3-nitro- (delta mass: 63.9993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.102,"smiles":null,"spectrum_id":"CCMSLIB00017309667","spectrum_index":45900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fenoterol (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.201,"smiles":null,"spectrum_id":"CCMSLIB00017309670","spectrum_index":45901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 15.9962 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.072,"smiles":null,"spectrum_id":"CCMSLIB00017309673","spectrum_index":45902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 129.0577 Da; putative annotation: N/A; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.181,"smiles":null,"spectrum_id":"CCMSLIB00017309676","spectrum_index":45903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HarmalolHCl2H2O///harmalol///Harmalol CollisionEnergy:205060 (delta mass: 43.006 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.108,"smiles":null,"spectrum_id":"CCMSLIB00017309679","spectrum_index":45904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 228.0993 Da; putative annotation: N/A; putative formula: C11H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.279,"smiles":null,"spectrum_id":"CCMSLIB00017309682","spectrum_index":45905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 9.9848 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.066,"smiles":null,"spectrum_id":"CCMSLIB00017309684","spectrum_index":45906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 50.0149 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017309687","spectrum_index":45907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 23.976 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.083,"smiles":null,"spectrum_id":"CCMSLIB00017309689","spectrum_index":45908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 926.4906 Da; putative annotation: N/A; putative formula: C65H66O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1107.56,"smiles":null,"spectrum_id":"CCMSLIB00017309692","spectrum_index":45909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 30.9945 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.081,"smiles":null,"spectrum_id":"CCMSLIB00017309694","spectrum_index":45910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Diamino-2-methylpropane (delta mass: 27.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":116.144,"smiles":null,"spectrum_id":"CCMSLIB00017309696","spectrum_index":45911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 363.2025 Da; putative annotation: N/A; putative formula: C24H29NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.299,"smiles":null,"spectrum_id":"CCMSLIB00017309699","spectrum_index":45912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxycodone (delta mass: 38.0158 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.155,"smiles":null,"spectrum_id":"CCMSLIB00017309702","spectrum_index":45913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 35.0293 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.126,"smiles":null,"spectrum_id":"CCMSLIB00017309703","spectrum_index":45914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 431.2801 Da; putative annotation: N/A; putative formula: C22H42NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.356,"smiles":null,"spectrum_id":"CCMSLIB00017309706","spectrum_index":45915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 154.1146 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017309709","spectrum_index":45916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apomorphine (delta mass: 912.5075 Da; putative annotation: N/A; putative formula: C60H68N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1180.64,"smiles":null,"spectrum_id":"CCMSLIB00017309710","spectrum_index":45917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 38.0519 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.221,"smiles":null,"spectrum_id":"CCMSLIB00017309713","spectrum_index":45918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Piperazinyl)-1H-indole (delta mass: 3.3661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017309716","spectrum_index":45919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4S)-4-Amino-5-hydroxypentanoic acid (delta mass: 52.0314 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.113,"smiles":null,"spectrum_id":"CCMSLIB00017309718","spectrum_index":45920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 98.052 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017309720","spectrum_index":45921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 322.1984 Da; putative annotation: N/A; putative formula: C19H32P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.352,"smiles":null,"spectrum_id":"CCMSLIB00017309723","spectrum_index":45922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 148.0366 Da; putative annotation: N/A; putative formula: C5H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.159,"smiles":null,"spectrum_id":"CCMSLIB00017309725","spectrum_index":45923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 161.105 Da; putative annotation: N/A; putative formula: C7H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.16,"smiles":null,"spectrum_id":"CCMSLIB00017309727","spectrum_index":45924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 51.9946 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.128,"smiles":null,"spectrum_id":"CCMSLIB00017309730","spectrum_index":45925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[(4-Hydroxyphenyl)acetyl]amino}acetic acid (delta mass: 52.031 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.107,"smiles":null,"spectrum_id":"CCMSLIB00017309733","spectrum_index":45926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 23.0184 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.157,"smiles":null,"spectrum_id":"CCMSLIB00017309734","spectrum_index":45927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 192.042 Da; putative annotation: N/A; putative formula: C10H8O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.107,"smiles":null,"spectrum_id":"CCMSLIB00017309737","spectrum_index":45928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Leu from NIST14 (delta mass: 113.0843 Da; putative annotation: 2-(Diethylamino)acetic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.234,"smiles":null,"spectrum_id":"CCMSLIB00017309740","spectrum_index":45929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 135.0326 Da; putative annotation: 2-Amino-5-hydroxybenzoic acid; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.108,"smiles":null,"spectrum_id":"CCMSLIB00017309741","spectrum_index":45930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 249.0849 Da; putative annotation: Zidovudine; putative formula: C10H11N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.145,"smiles":null,"spectrum_id":"CCMSLIB00017309744","spectrum_index":45931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 306.0516 Da; putative annotation: 2-{[((2Z)-4-Phenyl-1,3-thiazol-2(3H)-ylidene)amino]carbonyl}benzoic acid; putative formula: C17H10N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.112,"smiles":null,"spectrum_id":"CCMSLIB00017309747","spectrum_index":45932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 325.1681 Da; putative annotation: 6.beta.-Naltrexol; putative formula: C20H23NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.354,"smiles":null,"spectrum_id":"CCMSLIB00017309748","spectrum_index":45933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 113.0843 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017309751","spectrum_index":45934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 266.2605 Da; putative annotation: stearic acid CollisionEnergy:102040; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.321,"smiles":null,"spectrum_id":"CCMSLIB00017309752","spectrum_index":45935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 148.0718 Da; putative annotation: L-Fucitol; putative formula: C6H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.142,"smiles":null,"spectrum_id":"CCMSLIB00017309755","spectrum_index":45936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 257.1013 Da; putative annotation: Glu-Gln; putative formula: C10H15N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.204,"smiles":null,"spectrum_id":"CCMSLIB00017309758","spectrum_index":45937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 300.1721 Da; putative annotation: NCGC00347634-02!2,3-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,14,15,17-decahydro-1H-cyclopenta[a]phenanthrene-12,16-dione; putative formula: C19H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.243,"smiles":null,"spectrum_id":"CCMSLIB00017309759","spectrum_index":45938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-6-carboxamide, N-hydroxy-1-[(4-methoxyphenyl)methyl]- (delta mass: 140.0701 Da; putative annotation: N/A; putative formula: C5H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.194,"smiles":null,"spectrum_id":"CCMSLIB00017309762","spectrum_index":45939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 385.1589 Da; putative annotation: N/A; putative formula: C17H28N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.24,"smiles":null,"spectrum_id":"CCMSLIB00017309765","spectrum_index":45940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 98.0519 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.123,"smiles":null,"spectrum_id":"CCMSLIB00017309766","spectrum_index":45941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 86.0519 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.175,"smiles":null,"spectrum_id":"CCMSLIB00017309769","spectrum_index":45942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 300.1108 Da; putative annotation: N/A; putative formula: C16H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.186,"smiles":null,"spectrum_id":"CCMSLIB00017309772","spectrum_index":45943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 128.0449 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.168,"smiles":null,"spectrum_id":"CCMSLIB00017309773","spectrum_index":45944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 345.798 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.858,"smiles":null,"spectrum_id":"CCMSLIB00017309776","spectrum_index":45945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 25.9793 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.071,"smiles":null,"spectrum_id":"CCMSLIB00017309777","spectrum_index":45946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 44.0293 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.163,"smiles":null,"spectrum_id":"CCMSLIB00017309780","spectrum_index":45947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 248.2494 Da; putative annotation: N/A; putative formula: C18H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.346,"smiles":null,"spectrum_id":"CCMSLIB00017309783","spectrum_index":45948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 242.1157 Da; putative annotation: N/A; putative formula: C12H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.228,"smiles":null,"spectrum_id":"CCMSLIB00017309784","spectrum_index":45949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (1S,15S,17S)-17-[(1S)-1-hydroxyethyl]-3,13-diazapentacyclo[13.3.1.0,?.0?,?.0,?]nonadeca-2(10),4,6,8-tetraene-1-carboxylate (delta mass: 23.0084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.21,"smiles":null,"spectrum_id":"CCMSLIB00017309787","spectrum_index":45950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 37.0405 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.174,"smiles":null,"spectrum_id":"CCMSLIB00017309790","spectrum_index":45951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 18.9004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.023,"smiles":null,"spectrum_id":"CCMSLIB00017309791","spectrum_index":45952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 141.0998 Da; putative annotation: N/A; putative formula: C5H11N5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.165,"smiles":null,"spectrum_id":"CCMSLIB00017309794","spectrum_index":45953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 255.2189 Da; putative annotation: N/A; putative formula: C15H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.31,"smiles":null,"spectrum_id":"CCMSLIB00017309797","spectrum_index":45954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isomuronic acid (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.269,"smiles":null,"spectrum_id":"CCMSLIB00017309798","spectrum_index":45955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 114.0834 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.149,"smiles":null,"spectrum_id":"CCMSLIB00017309801","spectrum_index":45956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311012 Feruloyl putrescine (isomer of 1178) (delta mass: 147.0406 Da; putative annotation: N/A; putative formula: C3HN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.195,"smiles":null,"spectrum_id":"CCMSLIB00017309802","spectrum_index":45957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 14.0072 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.057,"smiles":null,"spectrum_id":"CCMSLIB00017309805","spectrum_index":45958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 20.0 eV (delta mass: 115.0642 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.177,"smiles":null,"spectrum_id":"CCMSLIB00017309808","spectrum_index":45959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 79.003 Da; putative annotation: N/A; putative formula: C4HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.068,"smiles":null,"spectrum_id":"CCMSLIB00017309809","spectrum_index":45960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 24.883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.981,"smiles":null,"spectrum_id":"CCMSLIB00017309812","spectrum_index":45961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosamine (delta mass: 242.9028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.0,"smiles":null,"spectrum_id":"CCMSLIB00017309815","spectrum_index":45962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371601 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 76.0162 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.086,"smiles":null,"spectrum_id":"CCMSLIB00017309816","spectrum_index":45963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 400.1886 Da; putative annotation: N/A; putative formula: C23H28O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.264,"smiles":null,"spectrum_id":"CCMSLIB00017309819","spectrum_index":45964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 115.0262 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.076,"smiles":null,"spectrum_id":"CCMSLIB00017309822","spectrum_index":45965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 241.0959 Da; putative annotation: N/A; putative formula: C12H19NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.245,"smiles":null,"spectrum_id":"CCMSLIB00017309824","spectrum_index":45966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 66.0833 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.326,"smiles":null,"spectrum_id":"CCMSLIB00017309826","spectrum_index":45967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(1H-Indol-5-yl)ethanone (delta mass: 45.0243 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017309829","spectrum_index":45968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 335.2583 Da; putative annotation: N/A; putative formula: C19H33N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.323,"smiles":null,"spectrum_id":"CCMSLIB00017309832","spectrum_index":45969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 129.0788 Da; putative annotation: N/A; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017309835","spectrum_index":45970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 543.4857 Da; putative annotation: N/A; putative formula: C32H65NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.556,"smiles":null,"spectrum_id":"CCMSLIB00017309837","spectrum_index":45971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 128.0357 Da; putative annotation: N/A; putative formula: C8H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.153,"smiles":null,"spectrum_id":"CCMSLIB00017309839","spectrum_index":45972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[1-(Aminomethyl)cyclopentyl]acetic acid (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.169,"smiles":null,"spectrum_id":"CCMSLIB00017309842","spectrum_index":45973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 233.1393 Da; putative annotation: N/A; putative formula: C10H15N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.21,"smiles":null,"spectrum_id":"CCMSLIB00017309845","spectrum_index":45974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 45.999 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.059,"smiles":null,"spectrum_id":"CCMSLIB00017309847","spectrum_index":45975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 14.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017309850","spectrum_index":45976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 103.9384 Da; putative annotation: N/A; putative formula: C2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.103,"smiles":null,"spectrum_id":"CCMSLIB00017309853","spectrum_index":45977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 303.1781 Da; putative annotation: N/A; putative formula: C10H17N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.343,"smiles":null,"spectrum_id":"CCMSLIB00017309856","spectrum_index":45978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 29.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017309859","spectrum_index":45979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 53.9876 Da; putative annotation: N/A; putative formula: C6H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.225,"smiles":null,"spectrum_id":"CCMSLIB00017309860","spectrum_index":45980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100147 Indole-3-acetaldehyde (delta mass: 123.0396 Da; putative annotation: N/A; putative formula: H5N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.115,"smiles":null,"spectrum_id":"CCMSLIB00017309863","spectrum_index":45981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 343.2304 Da; putative annotation: N/A; putative formula: C25H29N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.306,"smiles":null,"spectrum_id":"CCMSLIB00017309866","spectrum_index":45982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMPICILLIN (delta mass: 202.0587 Da; putative annotation: N/A; putative formula: C7H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.176,"smiles":null,"spectrum_id":"CCMSLIB00017309869","spectrum_index":45983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 313.2027 Da; putative annotation: N/A; putative formula: C14H28N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.315,"smiles":null,"spectrum_id":"CCMSLIB00017309872","spectrum_index":45984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 95.0947 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.207,"smiles":null,"spectrum_id":"CCMSLIB00017309874","spectrum_index":45985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 92.0631 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.353,"smiles":null,"spectrum_id":"CCMSLIB00017309877","spectrum_index":45986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 130.0419 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.129,"smiles":null,"spectrum_id":"CCMSLIB00017309880","spectrum_index":45987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levallorphan (delta mass: 104.0447 Da; putative annotation: N/A; putative formula: H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.246,"smiles":null,"spectrum_id":"CCMSLIB00017309882","spectrum_index":45988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carbaldehyde (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.05,"smiles":null,"spectrum_id":"CCMSLIB00017309885","spectrum_index":45989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-quinolin-4-yl(5-vinylquinuclidin-2-yl)methanol (delta mass: 185.1045 Da; putative annotation: N/A; putative formula: C9H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.285,"smiles":null,"spectrum_id":"CCMSLIB00017309888","spectrum_index":45990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Dodecylsulfanyl)ethanol (delta mass: 56.0638 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.273,"smiles":null,"spectrum_id":"CCMSLIB00017309891","spectrum_index":45991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 86.0479 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.144,"smiles":null,"spectrum_id":"CCMSLIB00017309893","spectrum_index":45992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 115.0838 Da; putative annotation: N/A; putative formula: C6H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.143,"smiles":null,"spectrum_id":"CCMSLIB00017309895","spectrum_index":45993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzyl homoveratrylamine (delta mass: 46.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.19,"smiles":null,"spectrum_id":"CCMSLIB00017309898","spectrum_index":45994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 102.0683 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.139,"smiles":null,"spectrum_id":"CCMSLIB00017309901","spectrum_index":45995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 68.0265 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.144,"smiles":null,"spectrum_id":"CCMSLIB00017309902","spectrum_index":45996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 135.0711 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.114,"smiles":null,"spectrum_id":"CCMSLIB00017309905","spectrum_index":45997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 69.013 Da; putative annotation: N/A; putative formula: C3H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.136,"smiles":null,"spectrum_id":"CCMSLIB00017309908","spectrum_index":45998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 4.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.08,"smiles":null,"spectrum_id":"CCMSLIB00017309911","spectrum_index":45999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 72.0183 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.177,"smiles":null,"spectrum_id":"CCMSLIB00017309913","spectrum_index":46000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNnT (delta mass: 363.2018 Da; putative annotation: N/A; putative formula: C16H25N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1071.46,"smiles":null,"spectrum_id":"CCMSLIB00017309915","spectrum_index":46001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 77.0268 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.129,"smiles":null,"spectrum_id":"CCMSLIB00017309918","spectrum_index":46002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 17.0002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.076,"smiles":null,"spectrum_id":"CCMSLIB00017309921","spectrum_index":46003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 104.046 Da; putative annotation: N/A; putative formula: H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.148,"smiles":null,"spectrum_id":"CCMSLIB00017309923","spectrum_index":46004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ketogluconic acid methyl ester (delta mass: 207.0749 Da; putative annotation: N/A; putative formula: C8H17NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.141,"smiles":null,"spectrum_id":"CCMSLIB00017309925","spectrum_index":46005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 834.3854 Da; putative annotation: N/A; putative formula: C48H50N8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1136.52,"smiles":null,"spectrum_id":"CCMSLIB00017309928","spectrum_index":46006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 100.016 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.113,"smiles":null,"spectrum_id":"CCMSLIB00017309931","spectrum_index":46007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 120.0596 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.172,"smiles":null,"spectrum_id":"CCMSLIB00017309934","spectrum_index":46008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 290.0422 Da; putative annotation: N/A; putative formula: C6H14N2O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.206,"smiles":null,"spectrum_id":"CCMSLIB00017309935","spectrum_index":46009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSAMINE (delta mass: 110.0374 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.124,"smiles":null,"spectrum_id":"CCMSLIB00017309938","spectrum_index":46010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 318.167 Da; putative annotation: N/A; putative formula: C19H28P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.269,"smiles":null,"spectrum_id":"CCMSLIB00017309941","spectrum_index":46011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutaecarpine CollisionEnergy:205060 (delta mass: 188.1946 Da; putative annotation: N/A; putative formula: C15H24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.308,"smiles":null,"spectrum_id":"CCMSLIB00017309943","spectrum_index":46012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 117.0425 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.108,"smiles":null,"spectrum_id":"CCMSLIB00017309946","spectrum_index":46013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 78.1183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.197,"smiles":null,"spectrum_id":"CCMSLIB00017309948","spectrum_index":46014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 108.0216 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.097,"smiles":null,"spectrum_id":"CCMSLIB00017309951","spectrum_index":46015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 142.1155 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.358,"smiles":null,"spectrum_id":"CCMSLIB00017309954","spectrum_index":46016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 310.1167 Da; putative annotation: N/A; putative formula: C14H18N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.203,"smiles":null,"spectrum_id":"CCMSLIB00017309957","spectrum_index":46017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 245.1046 Da; putative annotation: N/A; putative formula: C8H16N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.175,"smiles":null,"spectrum_id":"CCMSLIB00017309959","spectrum_index":46018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxo-1,2-dihydro-quinoline-3,4-dicarboxylic acid (delta mass: 140.9822 Da; putative annotation: N/A; putative formula: C4H3N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.022,"smiles":null,"spectrum_id":"CCMSLIB00017309961","spectrum_index":46019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.274,"smiles":null,"spectrum_id":"CCMSLIB00017309964","spectrum_index":46020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 387.2498 Da; putative annotation: N/A; putative formula: C18H29N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.326,"smiles":null,"spectrum_id":"CCMSLIB00017309967","spectrum_index":46021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 587.2059 Da; putative annotation: N/A; putative formula: C22H37NO17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.37,"smiles":null,"spectrum_id":"CCMSLIB00017309970","spectrum_index":46022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 76.0355 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.132,"smiles":null,"spectrum_id":"CCMSLIB00017309971","spectrum_index":46023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 151.0617 Da; putative annotation: N/A; putative formula: C4H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.185,"smiles":null,"spectrum_id":"CCMSLIB00017309974","spectrum_index":46024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 58.0119 Da; putative annotation: N/A; putative formula: CH3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.067,"smiles":null,"spectrum_id":"CCMSLIB00017309977","spectrum_index":46025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 55.0057 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.097,"smiles":null,"spectrum_id":"CCMSLIB00017309979","spectrum_index":46026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 106.0726 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.242,"smiles":null,"spectrum_id":"CCMSLIB00017309981","spectrum_index":46027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 33.0081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.126,"smiles":null,"spectrum_id":"CCMSLIB00017309984","spectrum_index":46028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 89.0108 Da; putative annotation: N/A; putative formula: C2H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.097,"smiles":null,"spectrum_id":"CCMSLIB00017309987","spectrum_index":46029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 119.0846 Da; putative annotation: N/A; putative formula: C7H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.101,"smiles":null,"spectrum_id":"CCMSLIB00017309990","spectrum_index":46030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 92.0388 Da; putative annotation: N/A; putative formula: C5H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.115,"smiles":null,"spectrum_id":"CCMSLIB00017309993","spectrum_index":46031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 519.2103 Da; putative annotation: N/A; putative formula: C21H38N5O4PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.297,"smiles":null,"spectrum_id":"CCMSLIB00017309996","spectrum_index":46032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 549.2532 Da; putative annotation: N/A; putative formula: C23H39N3O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.35,"smiles":null,"spectrum_id":"CCMSLIB00017309998","spectrum_index":46033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 708.8225 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1376.05,"smiles":null,"spectrum_id":"CCMSLIB00017310001","spectrum_index":46034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 285.0846 Da; putative annotation: N/A; putative formula: C12H15NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.171,"smiles":null,"spectrum_id":"CCMSLIB00017310004","spectrum_index":46035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-Ethyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)acetic acid (delta mass: 82.0007 Da; putative annotation: N/A; putative formula: C3H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.109,"smiles":null,"spectrum_id":"CCMSLIB00017310007","spectrum_index":46036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 350.0601 Da; putative annotation: N/A; putative formula: C13H21O5P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.125,"smiles":null,"spectrum_id":"CCMSLIB00017310010","spectrum_index":46037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 45.996 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.028,"smiles":null,"spectrum_id":"CCMSLIB00017310013","spectrum_index":46038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 215.2287 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.315,"smiles":null,"spectrum_id":"CCMSLIB00017310016","spectrum_index":46039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 42.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.155,"smiles":null,"spectrum_id":"CCMSLIB00017310019","spectrum_index":46040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 620.4514 Da; putative annotation: N/A; putative formula: C34H60N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.548,"smiles":null,"spectrum_id":"CCMSLIB00017310022","spectrum_index":46041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 220.1921 Da; putative annotation: N/A; putative formula: C14H24N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.294,"smiles":null,"spectrum_id":"CCMSLIB00017310025","spectrum_index":46042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 158.5606 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.663,"smiles":null,"spectrum_id":"CCMSLIB00017310028","spectrum_index":46043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 115.0724 Da; putative annotation: N/A; putative formula: H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.195,"smiles":null,"spectrum_id":"CCMSLIB00017310031","spectrum_index":46044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 439.3631 Da; putative annotation: N/A; putative formula: C22H45N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.439,"smiles":null,"spectrum_id":"CCMSLIB00017310033","spectrum_index":46045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00918 Demethoxycurcumin (delta mass: 146.0586 Da; putative annotation: N/A; putative formula: C7H14O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.181,"smiles":null,"spectrum_id":"CCMSLIB00017310036","spectrum_index":46046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 43.0324 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.124,"smiles":null,"spectrum_id":"CCMSLIB00017310039","spectrum_index":46047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 80.0478 Da; putative annotation: N/A; putative formula: C3H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.201,"smiles":null,"spectrum_id":"CCMSLIB00017310042","spectrum_index":46048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 224.189 Da; putative annotation: N/A; putative formula: C13H24N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.254,"smiles":null,"spectrum_id":"CCMSLIB00017310045","spectrum_index":46049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 73.0529 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.144,"smiles":null,"spectrum_id":"CCMSLIB00017310048","spectrum_index":46050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine - 40.0 eV (delta mass: 28.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.154,"smiles":null,"spectrum_id":"CCMSLIB00017310050","spectrum_index":46051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 30.9933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.055,"smiles":null,"spectrum_id":"CCMSLIB00017310053","spectrum_index":46052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 110.0013 Da; putative annotation: N/A; putative formula: C6H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.088,"smiles":null,"spectrum_id":"CCMSLIB00017310056","spectrum_index":46053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 549.2211 Da; putative annotation: N/A; putative formula: C27H35NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.307,"smiles":null,"spectrum_id":"CCMSLIB00017310059","spectrum_index":46054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 125.0479 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.15,"smiles":null,"spectrum_id":"CCMSLIB00017310062","spectrum_index":46055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 77.0372 Da; putative annotation: N/A; putative formula: C4H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.108,"smiles":null,"spectrum_id":"CCMSLIB00017310065","spectrum_index":46056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Pyridin-2-yl)ethanol (delta mass: 40.0311 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.107,"smiles":null,"spectrum_id":"CCMSLIB00017310068","spectrum_index":46057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 778.5548 Da; putative annotation: N/A; putative formula: C53H70N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":941.615,"smiles":null,"spectrum_id":"CCMSLIB00017310069","spectrum_index":46058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 404.294 Da; putative annotation: N/A; putative formula: C25H40O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.38,"smiles":null,"spectrum_id":"CCMSLIB00017310072","spectrum_index":46059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 168.0935 Da; putative annotation: N/A; putative formula: C13H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.206,"smiles":null,"spectrum_id":"CCMSLIB00017310075","spectrum_index":46060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.beta.-Homoglutamine (delta mass: 222.199 Da; putative annotation: N/A; putative formula: C15H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.291,"smiles":null,"spectrum_id":"CCMSLIB00017310078","spectrum_index":46061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 14.0522 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.149,"smiles":null,"spectrum_id":"CCMSLIB00017310081","spectrum_index":46062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 96.043 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.155,"smiles":null,"spectrum_id":"CCMSLIB00017310083","spectrum_index":46063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 119.0042 Da; putative annotation: N/A; putative formula: C3H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.064,"smiles":null,"spectrum_id":"CCMSLIB00017310086","spectrum_index":46064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 89.896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.967,"smiles":null,"spectrum_id":"CCMSLIB00017310089","spectrum_index":46065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7,8,9,10,11-Hexahydro-5H-cycloocta[b]indole (delta mass: 240.0845 Da; putative annotation: N/A; putative formula: C8H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.228,"smiles":null,"spectrum_id":"CCMSLIB00017310092","spectrum_index":46066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 38.0005 Da; putative annotation: N/A; putative formula: H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.097,"smiles":null,"spectrum_id":"CCMSLIB00017310094","spectrum_index":46067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 113.0479 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.15,"smiles":null,"spectrum_id":"CCMSLIB00017310097","spectrum_index":46068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 200.0593 Da; putative annotation: N/A; putative formula: C4H8N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.13,"smiles":null,"spectrum_id":"CCMSLIB00017310100","spectrum_index":46069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.128,"smiles":null,"spectrum_id":"CCMSLIB00017310103","spectrum_index":46070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 26.9992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.075,"smiles":null,"spectrum_id":"CCMSLIB00017310106","spectrum_index":46071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 80.0625 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.138,"smiles":null,"spectrum_id":"CCMSLIB00017310109","spectrum_index":46072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 24.0073 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.114,"smiles":null,"spectrum_id":"CCMSLIB00017310112","spectrum_index":46073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 156.1225 Da; putative annotation: N/A; putative formula: C4H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.229,"smiles":null,"spectrum_id":"CCMSLIB00017310113","spectrum_index":46074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 102.0429 Da; putative annotation: N/A; putative formula: C3H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.114,"smiles":null,"spectrum_id":"CCMSLIB00017310116","spectrum_index":46075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 131.0647 Da; putative annotation: N/A; putative formula: C3H9N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.119,"smiles":null,"spectrum_id":"CCMSLIB00017310119","spectrum_index":46076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 354.22 Da; putative annotation: Xysmalogenin; putative formula: C23H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.296,"smiles":null,"spectrum_id":"CCMSLIB00017310122","spectrum_index":46077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 273.1056 Da; putative annotation: Uniconazole-P; putative formula: C15H16ClN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.259,"smiles":null,"spectrum_id":"CCMSLIB00017310125","spectrum_index":46078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 246.126 Da; putative annotation: (3aR,4R,5aS,6S,9aR,9bS)-4,6-Dihydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one; putative formula: C15H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017310126","spectrum_index":46079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 119.0363 Da; putative annotation: 2-AMINOBENZOIC ACID; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.107,"smiles":null,"spectrum_id":"CCMSLIB00017310129","spectrum_index":46080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 132.0942 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.337,"smiles":null,"spectrum_id":"CCMSLIB00017310132","spectrum_index":46081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 242.1269 Da; putative annotation: N-L-.gamma.-Glutamyl-L-leucine; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.213,"smiles":null,"spectrum_id":"CCMSLIB00017310135","spectrum_index":46082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 210.1044 Da; putative annotation: 2-[4-(Benzyloxy)phenyl]ethanol; putative formula: C15H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.17,"smiles":null,"spectrum_id":"CCMSLIB00017310138","spectrum_index":46083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 58.0417 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017310141","spectrum_index":46084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norisoboldine (delta mass: 130.0478 Da; putative annotation: N/A; putative formula: C3H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.186,"smiles":null,"spectrum_id":"CCMSLIB00017310142","spectrum_index":46085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyldanofloxacin (delta mass: 23.0171 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.158,"smiles":null,"spectrum_id":"CCMSLIB00017310145","spectrum_index":46086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 154.0785 Da; putative annotation: N/A; putative formula: C12H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.202,"smiles":null,"spectrum_id":"CCMSLIB00017310148","spectrum_index":46087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 278.1612 Da; putative annotation: N/A; putative formula: C11H18N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.263,"smiles":null,"spectrum_id":"CCMSLIB00017310151","spectrum_index":46088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 222.1702 Da; putative annotation: N/A; putative formula: C9H18N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.329,"smiles":null,"spectrum_id":"CCMSLIB00017310154","spectrum_index":46089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 71.0376 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.208,"smiles":null,"spectrum_id":"CCMSLIB00017310157","spectrum_index":46090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norhydrocodone (delta mass: 63.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.212,"smiles":null,"spectrum_id":"CCMSLIB00017310159","spectrum_index":46091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 177.0789 Da; putative annotation: N/A; putative formula: C10H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.181,"smiles":null,"spectrum_id":"CCMSLIB00017310161","spectrum_index":46092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 5.0023 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.014,"smiles":null,"spectrum_id":"CCMSLIB00017310164","spectrum_index":46093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 65.0271 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.087,"smiles":null,"spectrum_id":"CCMSLIB00017310167","spectrum_index":46094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 135.0321 Da; putative annotation: N/A; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.208,"smiles":null,"spectrum_id":"CCMSLIB00017310170","spectrum_index":46095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olaquindox (delta mass: 135.0421 Da; putative annotation: N/A; putative formula: C6H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.14,"smiles":null,"spectrum_id":"CCMSLIB00017310173","spectrum_index":46096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140301 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 274.2139 Da; putative annotation: N/A; putative formula: C15H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.31,"smiles":null,"spectrum_id":"CCMSLIB00017310175","spectrum_index":46097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 38.0161 Da; putative annotation: N/A; putative formula: C3H2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.092,"smiles":null,"spectrum_id":"CCMSLIB00017310178","spectrum_index":46098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 95.0948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.249,"smiles":null,"spectrum_id":"CCMSLIB00017310181","spectrum_index":46099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 165.1034 Da; putative annotation: N/A; putative formula: C7H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.151,"smiles":null,"spectrum_id":"CCMSLIB00017310184","spectrum_index":46100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311158 Methoxytyramine (delta mass: 275.1532 Da; putative annotation: N/A; putative formula: C16H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.255,"smiles":null,"spectrum_id":"CCMSLIB00017310187","spectrum_index":46101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005785 Indole-3-carboxylic acid|1H-indole-3-carboxylic acid (delta mass: 169.445 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.5,"smiles":null,"spectrum_id":"CCMSLIB00017310190","spectrum_index":46102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 174.1862 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.227,"smiles":null,"spectrum_id":"CCMSLIB00017310193","spectrum_index":46103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380136-01!1-(2,3-dihydropyrrol-1-yl)-8,9-dihydroxy-2-methyldecane-1,3-dione (delta mass: 45.0568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.242,"smiles":null,"spectrum_id":"CCMSLIB00017310195","spectrum_index":46104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 36.9014 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.008,"smiles":null,"spectrum_id":"CCMSLIB00017310197","spectrum_index":46105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Norharmane from NIST14 (delta mass: 36.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.107,"smiles":null,"spectrum_id":"CCMSLIB00017310200","spectrum_index":46106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indolmycin (delta mass: 230.1272 Da; putative annotation: N/A; putative formula: C11H22N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.251,"smiles":null,"spectrum_id":"CCMSLIB00017310203","spectrum_index":46107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 162.0445 Da; putative annotation: N/A; putative formula: C6H11O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.103,"smiles":null,"spectrum_id":"CCMSLIB00017310206","spectrum_index":46108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 14.0159 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.113,"smiles":null,"spectrum_id":"CCMSLIB00017310209","spectrum_index":46109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 621.4614 Da; putative annotation: N/A; putative formula: C37H59N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.521,"smiles":null,"spectrum_id":"CCMSLIB00017310211","spectrum_index":46110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 42.9166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.018,"smiles":null,"spectrum_id":"CCMSLIB00017310214","spectrum_index":46111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 114.0682 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.144,"smiles":null,"spectrum_id":"CCMSLIB00017310217","spectrum_index":46112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 154.2295 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.316,"smiles":null,"spectrum_id":"CCMSLIB00017310220","spectrum_index":46113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 88.0202 Da; putative annotation: N/A; putative formula: CH4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.106,"smiles":null,"spectrum_id":"CCMSLIB00017310224","spectrum_index":46114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 100.0665 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.181,"smiles":null,"spectrum_id":"CCMSLIB00017310227","spectrum_index":46115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 64.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.998,"smiles":null,"spectrum_id":"CCMSLIB00017310230","spectrum_index":46116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 131.0998 Da; putative annotation: N/A; putative formula: C5H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.259,"smiles":null,"spectrum_id":"CCMSLIB00017310233","spectrum_index":46117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Hydroxyphenethylamine (delta mass: 25.0561 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.147,"smiles":null,"spectrum_id":"CCMSLIB00017310235","spectrum_index":46118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 12.022 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.082,"smiles":null,"spectrum_id":"CCMSLIB00017310238","spectrum_index":46119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 607.4657 Da; putative annotation: N/A; putative formula: C30H53N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.526,"smiles":null,"spectrum_id":"CCMSLIB00017310241","spectrum_index":46120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 201.0333 Da; putative annotation: N/A; putative formula: C13H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.104,"smiles":null,"spectrum_id":"CCMSLIB00017310244","spectrum_index":46121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3,4-Dimethoxyphenyl)-1H-indole (delta mass: 15.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.139,"smiles":null,"spectrum_id":"CCMSLIB00017310247","spectrum_index":46122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 110.0516 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.127,"smiles":null,"spectrum_id":"CCMSLIB00017310250","spectrum_index":46123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 586.4772 Da; putative annotation: N/A; putative formula: C27H54N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.549,"smiles":null,"spectrum_id":"CCMSLIB00017310253","spectrum_index":46124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Ser (delta mass: 30.9953 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.125,"smiles":null,"spectrum_id":"CCMSLIB00017310256","spectrum_index":46125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bufotenine (delta mass: 147.0679 Da; putative annotation: N/A; putative formula: C3H10N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.201,"smiles":null,"spectrum_id":"CCMSLIB00017310259","spectrum_index":46126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 299.1044 Da; putative annotation: N/A; putative formula: C10H21NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.207,"smiles":null,"spectrum_id":"CCMSLIB00017310261","spectrum_index":46127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 37.891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.998,"smiles":null,"spectrum_id":"CCMSLIB00017310263","spectrum_index":46128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 144.2245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.322,"smiles":null,"spectrum_id":"CCMSLIB00017310266","spectrum_index":46129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 278.0359 Da; putative annotation: N/A; putative formula: C4H6N8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.212,"smiles":null,"spectrum_id":"CCMSLIB00017310269","spectrum_index":46130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 295.22 Da; putative annotation: N/A; putative formula: C15H29N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.296,"smiles":null,"spectrum_id":"CCMSLIB00017310272","spectrum_index":46131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 212.0474 Da; putative annotation: N/A; putative formula: C13H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.092,"smiles":null,"spectrum_id":"CCMSLIB00017310274","spectrum_index":46132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.081,"smiles":null,"spectrum_id":"CCMSLIB00017310276","spectrum_index":46133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Gln (delta mass: 111.0317 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.177,"smiles":null,"spectrum_id":"CCMSLIB00017310279","spectrum_index":46134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 387.2564 Da; putative annotation: N/A; putative formula: C27H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.332,"smiles":null,"spectrum_id":"CCMSLIB00017310282","spectrum_index":46135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 94.0784 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017310284","spectrum_index":46136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 197.0893 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.191,"smiles":null,"spectrum_id":"CCMSLIB00017310286","spectrum_index":46137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 64.0314 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.102,"smiles":null,"spectrum_id":"CCMSLIB00017310289","spectrum_index":46138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cephradine (delta mass: 64.0235 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.14,"smiles":null,"spectrum_id":"CCMSLIB00017310292","spectrum_index":46139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Val (delta mass: 14.0153 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.16,"smiles":null,"spectrum_id":"CCMSLIB00017310295","spectrum_index":46140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match] (delta mass: 14.0177 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.286,"smiles":null,"spectrum_id":"CCMSLIB00017310296","spectrum_index":46141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 163.0631 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.118,"smiles":null,"spectrum_id":"CCMSLIB00017310299","spectrum_index":46142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 189.0998 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.165,"smiles":null,"spectrum_id":"CCMSLIB00017310302","spectrum_index":46143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 16.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.135,"smiles":null,"spectrum_id":"CCMSLIB00017310305","spectrum_index":46144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140304 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 11.0159 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.112,"smiles":null,"spectrum_id":"CCMSLIB00017310307","spectrum_index":46145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,4,4-Trifluorobutan-1-amine (delta mass: 22.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.078,"smiles":null,"spectrum_id":"CCMSLIB00017310309","spectrum_index":46146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 42.0665 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.173,"smiles":null,"spectrum_id":"CCMSLIB00017310312","spectrum_index":46147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 116.0477 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.222,"smiles":null,"spectrum_id":"CCMSLIB00017310315","spectrum_index":46148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltryptamine (delta mass: 171.1125 Da; putative annotation: N/A; putative formula: C6H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.236,"smiles":null,"spectrum_id":"CCMSLIB00017310316","spectrum_index":46149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 116.0886 Da; putative annotation: N/A; putative formula: C5H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.185,"smiles":null,"spectrum_id":"CCMSLIB00017310319","spectrum_index":46150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 166.0628 Da; putative annotation: N/A; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.176,"smiles":null,"spectrum_id":"CCMSLIB00017310322","spectrum_index":46151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline (delta mass: 185.1147 Da; putative annotation: N/A; putative formula: C4H11N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.175,"smiles":null,"spectrum_id":"CCMSLIB00017310325","spectrum_index":46152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 179.099 Da; putative annotation: N/A; putative formula: C9H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.195,"smiles":null,"spectrum_id":"CCMSLIB00017310328","spectrum_index":46153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 70.0055 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.055,"smiles":null,"spectrum_id":"CCMSLIB00017310330","spectrum_index":46154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.24,"smiles":null,"spectrum_id":"CCMSLIB00017310332","spectrum_index":46155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 322.3238 Da; putative annotation: N/A; putative formula: C22H42O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.405,"smiles":null,"spectrum_id":"CCMSLIB00017310335","spectrum_index":46156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301694 Harmine (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.113,"smiles":null,"spectrum_id":"CCMSLIB00017310338","spectrum_index":46157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 503.1851 Da; putative annotation: N/A; putative formula: C24H25N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.309,"smiles":null,"spectrum_id":"CCMSLIB00017310341","spectrum_index":46158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 506.1927 Da; putative annotation: N/A; putative formula: C26H22N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":849.316,"smiles":null,"spectrum_id":"CCMSLIB00017310343","spectrum_index":46159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 299.1581 Da; putative annotation: N/A; putative formula: C6H22N9O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.328,"smiles":null,"spectrum_id":"CCMSLIB00017310346","spectrum_index":46160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic K 252b (delta mass: 43.9947 Da; putative annotation: N/A; putative formula: HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.134,"smiles":null,"spectrum_id":"CCMSLIB00017310349","spectrum_index":46161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Leu-Pro from NIST14 (delta mass: 87.0312 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.186,"smiles":null,"spectrum_id":"CCMSLIB00017310352","spectrum_index":46162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU228201 10,11-Dihydro-10-Hydroxycarbazepine|Licarbazepine|5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 35.0471 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017310355","spectrum_index":46163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 128.0628 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017310357","spectrum_index":46164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 290.1884 Da; putative annotation: N/A; putative formula: C18H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.348,"smiles":null,"spectrum_id":"CCMSLIB00017310360","spectrum_index":46165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 36.9251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.079,"smiles":null,"spectrum_id":"CCMSLIB00017310363","spectrum_index":46166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 68.0252 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.106,"smiles":null,"spectrum_id":"CCMSLIB00017310366","spectrum_index":46167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 123.1226 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.207,"smiles":null,"spectrum_id":"CCMSLIB00017310369","spectrum_index":46168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 878.5001 Da; putative annotation: N/A; putative formula: C43H70N6O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1209.65,"smiles":null,"spectrum_id":"CCMSLIB00017310373","spectrum_index":46169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 519.2763 Da; putative annotation: N/A; putative formula: C29H38N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.373,"smiles":null,"spectrum_id":"CCMSLIB00017310376","spectrum_index":46170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 151.0865 Da; putative annotation: N/A; putative formula: C6H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.152,"smiles":null,"spectrum_id":"CCMSLIB00017310379","spectrum_index":46171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mer-N5075-A_35716_dereplictor_pv_5.17819e-12 (delta mass: 627.3358 Da; putative annotation: N/A; putative formula: C32H54NO7PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1225.67,"smiles":null,"spectrum_id":"CCMSLIB00017310382","spectrum_index":46172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 63.9984 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.163,"smiles":null,"spectrum_id":"CCMSLIB00017310385","spectrum_index":46173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 90.0425 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.087,"smiles":null,"spectrum_id":"CCMSLIB00017310388","spectrum_index":46174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyrosine (delta mass: 189.0789 Da; putative annotation: N/A; putative formula: C11H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.176,"smiles":null,"spectrum_id":"CCMSLIB00017310391","spectrum_index":46175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 278.2584 Da; putative annotation: N/A; putative formula: C15H30N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.319,"smiles":null,"spectrum_id":"CCMSLIB00017310394","spectrum_index":46176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 45.0204 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.135,"smiles":null,"spectrum_id":"CCMSLIB00017310397","spectrum_index":46177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 146.0366 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.102,"smiles":null,"spectrum_id":"CCMSLIB00017310400","spectrum_index":46178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 298.2144 Da; putative annotation: N/A; putative formula: C17H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.316,"smiles":null,"spectrum_id":"CCMSLIB00017310403","spectrum_index":46179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 253.1155 Da; putative annotation: N/A; putative formula: C9H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.176,"smiles":null,"spectrum_id":"CCMSLIB00017310404","spectrum_index":46180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 145.0198 Da; putative annotation: N/A; putative formula: C5H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.122,"smiles":null,"spectrum_id":"CCMSLIB00017310407","spectrum_index":46181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 274.9004 Da; putative annotation: N/A; putative formula: N5O7P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.998,"smiles":null,"spectrum_id":"CCMSLIB00017310410","spectrum_index":46182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 237.1971 Da; putative annotation: N/A; putative formula: C12H23N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.32,"smiles":null,"spectrum_id":"CCMSLIB00017310413","spectrum_index":46183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 151.0636 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.134,"smiles":null,"spectrum_id":"CCMSLIB00017310415","spectrum_index":46184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 100.1095 Da; putative annotation: N/A; putative formula: C4H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.185,"smiles":null,"spectrum_id":"CCMSLIB00017310419","spectrum_index":46185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 432.1403 Da; putative annotation: N/A; putative formula: C27H28O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":775.264,"smiles":null,"spectrum_id":"CCMSLIB00017310423","spectrum_index":46186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 10.4206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017310425","spectrum_index":46187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 219.112 Da; putative annotation: N/A; putative formula: C10H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.225,"smiles":null,"spectrum_id":"CCMSLIB00017310428","spectrum_index":46188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 151.0633 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.139,"smiles":null,"spectrum_id":"CCMSLIB00017310431","spectrum_index":46189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 131.0105 Da; putative annotation: N/A; putative formula: C6HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.082,"smiles":null,"spectrum_id":"CCMSLIB00017310434","spectrum_index":46190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 140.0972 Da; putative annotation: N/A; putative formula: C12H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.272,"smiles":null,"spectrum_id":"CCMSLIB00017310437","spectrum_index":46191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apixaban (delta mass: 348.1584 Da; putative annotation: N/A; putative formula: C20H28OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.356,"smiles":null,"spectrum_id":"CCMSLIB00017310440","spectrum_index":46192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 162.0992 Da; putative annotation: N/A; putative formula: C6H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.17,"smiles":null,"spectrum_id":"CCMSLIB00017310443","spectrum_index":46193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.144,"smiles":null,"spectrum_id":"CCMSLIB00017310446","spectrum_index":46194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 144.0207 Da; putative annotation: N/A; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.064,"smiles":null,"spectrum_id":"CCMSLIB00017310448","spectrum_index":46195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 75.1663 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.305,"smiles":null,"spectrum_id":"CCMSLIB00017310451","spectrum_index":46196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 103.0609 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.157,"smiles":null,"spectrum_id":"CCMSLIB00017310454","spectrum_index":46197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 669.6519 Da; putative annotation: N/A; putative formula: C40H79N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":891.749,"smiles":null,"spectrum_id":"CCMSLIB00017310458","spectrum_index":46198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 221.0896 Da; putative annotation: N/A; putative formula: C8H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.212,"smiles":null,"spectrum_id":"CCMSLIB00017310460","spectrum_index":46199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 131.0373 Da; putative annotation: N/A; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.108,"smiles":null,"spectrum_id":"CCMSLIB00017310463","spectrum_index":46200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 128.1199 Da; putative annotation: N/A; putative formula: C8H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.253,"smiles":null,"spectrum_id":"CCMSLIB00017310466","spectrum_index":46201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 134.0199 Da; putative annotation: N/A; putative formula: CH-2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.08,"smiles":null,"spectrum_id":"CCMSLIB00017310469","spectrum_index":46202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 357.1551 Da; putative annotation: N/A; putative formula: C24H23NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.241,"smiles":null,"spectrum_id":"CCMSLIB00017310472","spectrum_index":46203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 25.9859 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.013,"smiles":null,"spectrum_id":"CCMSLIB00017310475","spectrum_index":46204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 162.0465 Da; putative annotation: N/A; putative formula: C5H10N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.183,"smiles":null,"spectrum_id":"CCMSLIB00017310478","spectrum_index":46205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 126.0559 Da; putative annotation: N/A; putative formula: C4H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.147,"smiles":null,"spectrum_id":"CCMSLIB00017310480","spectrum_index":46206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 245.118 Da; putative annotation: N/A; putative formula: C11H20NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.18,"smiles":null,"spectrum_id":"CCMSLIB00017310483","spectrum_index":46207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU112201 Haloperidol|4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butan-1-one (delta mass: 50.0434 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.191,"smiles":null,"spectrum_id":"CCMSLIB00017310486","spectrum_index":46208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 87.0512 Da; putative annotation: N/A; putative formula: C4H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.191,"smiles":null,"spectrum_id":"CCMSLIB00017310489","spectrum_index":46209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 286.0858 Da; putative annotation: N/A; putative formula: C16H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.166,"smiles":null,"spectrum_id":"CCMSLIB00017310492","spectrum_index":46210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin - 30.0 eV (delta mass: 68.0471 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.18,"smiles":null,"spectrum_id":"CCMSLIB00017310493","spectrum_index":46211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mitoridine (delta mass: 17.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.212,"smiles":null,"spectrum_id":"CCMSLIB00017310496","spectrum_index":46212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 453.1493 Da; putative annotation: N/A; putative formula: C28H24NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.247,"smiles":null,"spectrum_id":"CCMSLIB00017310499","spectrum_index":46213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benz[a]anthracen-1-ol, 8-methoxy-3-methyl- (delta mass: 12.0324 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.155,"smiles":null,"spectrum_id":"CCMSLIB00017310502","spectrum_index":46214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 87.1088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.189,"smiles":null,"spectrum_id":"CCMSLIB00017310505","spectrum_index":46215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU161803 Ecgonine-methyl-ester (EME)|AC1L9FBF|methyl (3S,4R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate (delta mass: 22.9683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.096,"smiles":null,"spectrum_id":"CCMSLIB00017310508","spectrum_index":46216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 64.0311 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.128,"smiles":null,"spectrum_id":"CCMSLIB00017310511","spectrum_index":46217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 116.0562 Da; putative annotation: N/A; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.169,"smiles":null,"spectrum_id":"CCMSLIB00017310514","spectrum_index":46218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 116.1265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.234,"smiles":null,"spectrum_id":"CCMSLIB00017310517","spectrum_index":46219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 155.058 Da; putative annotation: N/A; putative formula: C7H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.118,"smiles":null,"spectrum_id":"CCMSLIB00017310519","spectrum_index":46220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-3-pyridinol (delta mass: 27.011 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":137.071,"smiles":null,"spectrum_id":"CCMSLIB00017310522","spectrum_index":46221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 71.0366 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.165,"smiles":null,"spectrum_id":"CCMSLIB00017310525","spectrum_index":46222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 226.1684 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.281,"smiles":null,"spectrum_id":"CCMSLIB00017310529","spectrum_index":46223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 162.0673 Da; putative annotation: 4-Hydroxy-3-(2-hydroxyethyl)acetophenone; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.143,"smiles":null,"spectrum_id":"CCMSLIB00017310533","spectrum_index":46224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 104.0262 Da; putative annotation: Benzoic acid; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.086,"smiles":null,"spectrum_id":"CCMSLIB00017310535","spectrum_index":46225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(3-Aminopropyl)-N1-methylpropane-1,3-diamine (delta mass: 146.0367 Da; putative annotation: Massbank:PR302005 3-Hydroxycinnamic acid; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.202,"smiles":null,"spectrum_id":"CCMSLIB00017310538","spectrum_index":46226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 212.0986 Da; putative annotation: 5-(2-Hydroxyethyl)-6-methyl-2-phenyl-4(3H)-pyrimidinone; putative formula: C13H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.179,"smiles":null,"spectrum_id":"CCMSLIB00017310541","spectrum_index":46227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 138.032 Da; putative annotation: 2-(Hydroxymethyl)-5-methoxy-4H-pyran-4-one; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.118,"smiles":null,"spectrum_id":"CCMSLIB00017310545","spectrum_index":46228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE (delta mass: 86.0355 Da; putative annotation: Ethyl glycolate; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.127,"smiles":null,"spectrum_id":"CCMSLIB00017310548","spectrum_index":46229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 373.1885 Da; putative annotation: N/A; putative formula: C21H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.358,"smiles":null,"spectrum_id":"CCMSLIB00017310551","spectrum_index":46230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 145.06 Da; putative annotation: N/A; putative formula: C3H7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.214,"smiles":null,"spectrum_id":"CCMSLIB00017310554","spectrum_index":46231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 166.0784 Da; putative annotation: N/A; putative formula: C13H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.202,"smiles":null,"spectrum_id":"CCMSLIB00017310557","spectrum_index":46232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 223.1936 Da; putative annotation: N/A; putative formula: C14H25NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.264,"smiles":null,"spectrum_id":"CCMSLIB00017310560","spectrum_index":46233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2,3-dihydrobenzoic acid (delta mass: 56.9741 Da; putative annotation: N/A; putative formula: CNP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.045,"smiles":null,"spectrum_id":"CCMSLIB00017310562","spectrum_index":46234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 166.9869 Da; putative annotation: N/A; putative formula: C7H5NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.141,"smiles":null,"spectrum_id":"CCMSLIB00017310565","spectrum_index":46235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 264.0356 Da; putative annotation: N/A; putative formula: C15H8N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.144,"smiles":null,"spectrum_id":"CCMSLIB00017310568","spectrum_index":46236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 62.0582 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.186,"smiles":null,"spectrum_id":"CCMSLIB00017310572","spectrum_index":46237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100301 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole (delta mass: 327.0278 Da; putative annotation: N/A; putative formula: C11H21NS5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.076,"smiles":null,"spectrum_id":"CCMSLIB00017310575","spectrum_index":46238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 35.0731 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.138,"smiles":null,"spectrum_id":"CCMSLIB00017310578","spectrum_index":46239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 242.1586 Da; putative annotation: N/A; putative formula: C17H23O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.26,"smiles":null,"spectrum_id":"CCMSLIB00017310581","spectrum_index":46240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 82.0279 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.114,"smiles":null,"spectrum_id":"CCMSLIB00017310583","spectrum_index":46241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 270.2086 Da; putative annotation: N/A; putative formula: C12H27N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.315,"smiles":null,"spectrum_id":"CCMSLIB00017310586","spectrum_index":46242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 45.0099 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.092,"smiles":null,"spectrum_id":"CCMSLIB00017310589","spectrum_index":46243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 329.3344 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.494,"smiles":null,"spectrum_id":"CCMSLIB00017310592","spectrum_index":46244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of agmatine - 40.0 eV (delta mass: 144.9709 Da; putative annotation: N/A; putative formula: CH-1N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.1,"smiles":null,"spectrum_id":"CCMSLIB00017310595","spectrum_index":46245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 228.1509 Da; putative annotation: N/A; putative formula: C10H21N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017310596","spectrum_index":46246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 62.0524 Da; putative annotation: N/A; putative formula: C6H6O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.118,"smiles":null,"spectrum_id":"CCMSLIB00017310599","spectrum_index":46247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 213.0631 Da; putative annotation: N/A; putative formula: C9H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.149,"smiles":null,"spectrum_id":"CCMSLIB00017310602","spectrum_index":46248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 38.9137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.0,"smiles":null,"spectrum_id":"CCMSLIB00017310605","spectrum_index":46249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eugenitin (delta mass: 138.0408 Da; putative annotation: N/A; putative formula: C2H2N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.122,"smiles":null,"spectrum_id":"CCMSLIB00017310608","spectrum_index":46250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 15.9334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.046,"smiles":null,"spectrum_id":"CCMSLIB00017310609","spectrum_index":46251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 31.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.144,"smiles":null,"spectrum_id":"CCMSLIB00017310612","spectrum_index":46252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000511 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 194.0394 Da; putative annotation: N/A; putative formula: C12H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.11,"smiles":null,"spectrum_id":"CCMSLIB00017310615","spectrum_index":46253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 164.0987 Da; putative annotation: N/A; putative formula: C14H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.196,"smiles":null,"spectrum_id":"CCMSLIB00017310618","spectrum_index":46254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSE 1-PHOSPHATE (delta mass: 11.0292 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.066,"smiles":null,"spectrum_id":"CCMSLIB00017310619","spectrum_index":46255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 56.0507 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.132,"smiles":null,"spectrum_id":"CCMSLIB00017310622","spectrum_index":46256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 176.0287 Da; putative annotation: N/A; putative formula: C4H9N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.12,"smiles":null,"spectrum_id":"CCMSLIB00017310625","spectrum_index":46257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one (delta mass: 176.0377 Da; putative annotation: N/A; putative formula: C12H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.119,"smiles":null,"spectrum_id":"CCMSLIB00017310628","spectrum_index":46258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 202.1259 Da; putative annotation: N/A; putative formula: C8H18N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.416,"smiles":null,"spectrum_id":"CCMSLIB00017310631","spectrum_index":46259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 35.1086 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.263,"smiles":null,"spectrum_id":"CCMSLIB00017310633","spectrum_index":46260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 409.1871 Da; putative annotation: N/A; putative formula: C18H36NO3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.273,"smiles":null,"spectrum_id":"CCMSLIB00017310636","spectrum_index":46261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 27.1821 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.154,"smiles":null,"spectrum_id":"CCMSLIB00017310639","spectrum_index":46262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 311.1219 Da; putative annotation: N/A; putative formula: C11H21NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.198,"smiles":null,"spectrum_id":"CCMSLIB00017310642","spectrum_index":46263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 283.0909 Da; putative annotation: N/A; putative formula: C12H18N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.203,"smiles":null,"spectrum_id":"CCMSLIB00017310645","spectrum_index":46264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 547.1794 Da; putative annotation: N/A; putative formula: C17H33N5O13S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.266,"smiles":null,"spectrum_id":"CCMSLIB00017310648","spectrum_index":46265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 85.0165 Da; putative annotation: N/A; putative formula: C3H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.113,"smiles":null,"spectrum_id":"CCMSLIB00017310651","spectrum_index":46266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 235.1133 Da; putative annotation: N/A; putative formula: C13H18NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.205,"smiles":null,"spectrum_id":"CCMSLIB00017310654","spectrum_index":46267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hypaphorine (delta mass: 504.334 Da; putative annotation: N/A; putative formula: C24H48N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":751.478,"smiles":null,"spectrum_id":"CCMSLIB00017310657","spectrum_index":46268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 968.4953 Da; putative annotation: N/A; putative formula: C45H72N6O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1149.57,"smiles":null,"spectrum_id":"CCMSLIB00017310660","spectrum_index":46269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 143.0378 Da; putative annotation: N/A; putative formula: C2H5N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.135,"smiles":null,"spectrum_id":"CCMSLIB00017310663","spectrum_index":46270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 42.455 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.536,"smiles":null,"spectrum_id":"CCMSLIB00017310666","spectrum_index":46271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 50.0752 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.151,"smiles":null,"spectrum_id":"CCMSLIB00017310669","spectrum_index":46272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 507.1601 Da; putative annotation: N/A; putative formula: C21H25N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.246,"smiles":null,"spectrum_id":"CCMSLIB00017310672","spectrum_index":46273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 38.0591 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.141,"smiles":null,"spectrum_id":"CCMSLIB00017310674","spectrum_index":46274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HISTIDINOL (delta mass: 105.07 Da; putative annotation: N/A; putative formula: C6H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.167,"smiles":null,"spectrum_id":"CCMSLIB00017310677","spectrum_index":46275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 133.016 Da; putative annotation: N/A; putative formula: C7H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.087,"smiles":null,"spectrum_id":"CCMSLIB00017310680","spectrum_index":46276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 129.1715 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.258,"smiles":null,"spectrum_id":"CCMSLIB00017310683","spectrum_index":46277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 148.0542 Da; putative annotation: N/A; putative formula: C2H8N6S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.141,"smiles":null,"spectrum_id":"CCMSLIB00017310686","spectrum_index":46278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 77.084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.186,"smiles":null,"spectrum_id":"CCMSLIB00017310688","spectrum_index":46279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 202.0735 Da; putative annotation: N/A; putative formula: C5H11N6OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.228,"smiles":null,"spectrum_id":"CCMSLIB00017310691","spectrum_index":46280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 10.057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.143,"smiles":null,"spectrum_id":"CCMSLIB00017310694","spectrum_index":46281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 152.0103 Da; putative annotation: N/A; putative formula: C7H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.113,"smiles":null,"spectrum_id":"CCMSLIB00017310697","spectrum_index":46282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 300.0942 Da; putative annotation: N/A; putative formula: C24H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.165,"smiles":null,"spectrum_id":"CCMSLIB00017310699","spectrum_index":46283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 225.0863 Da; putative annotation: N/A; putative formula: C8H11N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.157,"smiles":null,"spectrum_id":"CCMSLIB00017310702","spectrum_index":46284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 16.9373 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.05,"smiles":null,"spectrum_id":"CCMSLIB00017310705","spectrum_index":46285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 134.0573 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.138,"smiles":null,"spectrum_id":"CCMSLIB00017310708","spectrum_index":46286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 62.059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.198,"smiles":null,"spectrum_id":"CCMSLIB00017310710","spectrum_index":46287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 153.1155 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.218,"smiles":null,"spectrum_id":"CCMSLIB00017310713","spectrum_index":46288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 11.0091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.091,"smiles":null,"spectrum_id":"CCMSLIB00017310716","spectrum_index":46289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 374.1183 Da; putative annotation: N/A; putative formula: C22H19N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.205,"smiles":null,"spectrum_id":"CCMSLIB00017310719","spectrum_index":46290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 97.0898 Da; putative annotation: N/A; putative formula: C6H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.266,"smiles":null,"spectrum_id":"CCMSLIB00017310722","spectrum_index":46291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 442.2734 Da; putative annotation: N/A; putative formula: C28H34N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.344,"smiles":null,"spectrum_id":"CCMSLIB00017310724","spectrum_index":46292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 498.2858 Da; putative annotation: N/A; putative formula: C25H43N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.346,"smiles":null,"spectrum_id":"CCMSLIB00017310727","spectrum_index":46293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Guanidinopropionic acid (delta mass: 114.0319 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.109,"smiles":null,"spectrum_id":"CCMSLIB00017310730","spectrum_index":46294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 29.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":141.102,"smiles":null,"spectrum_id":"CCMSLIB00017310733","spectrum_index":46295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 57.021 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.15,"smiles":null,"spectrum_id":"CCMSLIB00017310736","spectrum_index":46296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 160.0523 Da; putative annotation: N/A; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.118,"smiles":null,"spectrum_id":"CCMSLIB00017310738","spectrum_index":46297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 269.2366 Da; putative annotation: N/A; putative formula: C16H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.328,"smiles":null,"spectrum_id":"CCMSLIB00017310740","spectrum_index":46298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 48.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.127,"smiles":null,"spectrum_id":"CCMSLIB00017310743","spectrum_index":46299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Untitled CollisionEnergy:205060 (delta mass: 230.1487 Da; putative annotation: N/A; putative formula: C8H18N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.314,"smiles":null,"spectrum_id":"CCMSLIB00017310745","spectrum_index":46300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 222.0676 Da; putative annotation: N/A; putative formula: C7H14N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.196,"smiles":null,"spectrum_id":"CCMSLIB00017310748","spectrum_index":46301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 71.9279 Da; putative annotation: N/A; putative formula: CH-2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.082,"smiles":null,"spectrum_id":"CCMSLIB00017310751","spectrum_index":46302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 73.0387 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.141,"smiles":null,"spectrum_id":"CCMSLIB00017310754","spectrum_index":46303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 257.1013 Da; putative annotation: N/A; putative formula: C10H15N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.166,"smiles":null,"spectrum_id":"CCMSLIB00017310757","spectrum_index":46304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 639.9243 Da; putative annotation: N/A; putative formula: C22H12N2O13S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.0,"smiles":null,"spectrum_id":"CCMSLIB00017310758","spectrum_index":46305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 114.0705 Da; putative annotation: N/A; putative formula: C5H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.173,"smiles":null,"spectrum_id":"CCMSLIB00017310761","spectrum_index":46306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 96.0034 Da; putative annotation: N/A; putative formula: C5H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.079,"smiles":null,"spectrum_id":"CCMSLIB00017310764","spectrum_index":46307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 190.994 Da; putative annotation: N/A; putative formula: C11HN3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.153,"smiles":null,"spectrum_id":"CCMSLIB00017310767","spectrum_index":46308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norboldine (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.165,"smiles":null,"spectrum_id":"CCMSLIB00017310768","spectrum_index":46309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 564.3674 Da; putative annotation: N/A; putative formula: C33H48N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.427,"smiles":null,"spectrum_id":"CCMSLIB00017310771","spectrum_index":46310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-C4:0 (delta mass: 126.104 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.259,"smiles":null,"spectrum_id":"CCMSLIB00017310774","spectrum_index":46311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 504.252 Da; putative annotation: N/A; putative formula: C32H40OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.349,"smiles":null,"spectrum_id":"CCMSLIB00017310777","spectrum_index":46312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 40.0306 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.206,"smiles":null,"spectrum_id":"CCMSLIB00017310780","spectrum_index":46313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 117.1732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.254,"smiles":null,"spectrum_id":"CCMSLIB00017310782","spectrum_index":46314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 876.425 Da; putative annotation: N/A; putative formula: C57H56N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1169.57,"smiles":null,"spectrum_id":"CCMSLIB00017310785","spectrum_index":46315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 179.0951 Da; putative annotation: N/A; putative formula: C10H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.192,"smiles":null,"spectrum_id":"CCMSLIB00017310788","spectrum_index":46316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole (delta mass: 59.0904 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.159,"smiles":null,"spectrum_id":"CCMSLIB00017310791","spectrum_index":46317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 28.964 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.04,"smiles":null,"spectrum_id":"CCMSLIB00017310794","spectrum_index":46318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolidine CollisionEnergy:102040 (delta mass: 42.0445 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.178,"smiles":null,"spectrum_id":"CCMSLIB00017310797","spectrum_index":46319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl(3-quinolinyl)methanamine (delta mass: 40.0565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.164,"smiles":null,"spectrum_id":"CCMSLIB00017310799","spectrum_index":46320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 837.0461 Da; putative annotation: N/A; putative formula: C64H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1512.29,"smiles":null,"spectrum_id":"CCMSLIB00017310802","spectrum_index":46321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 739.9006 Da; putative annotation: N/A; putative formula: C22H16N2O17S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1407.13,"smiles":null,"spectrum_id":"CCMSLIB00017310805","spectrum_index":46322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 192.1153 Da; putative annotation: N/A; putative formula: C12H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.207,"smiles":null,"spectrum_id":"CCMSLIB00017310808","spectrum_index":46323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 190.1203 Da; putative annotation: N/A; putative formula: C9H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.29,"smiles":null,"spectrum_id":"CCMSLIB00017310811","spectrum_index":46324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 119.0583 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.202,"smiles":null,"spectrum_id":"CCMSLIB00017310813","spectrum_index":46325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 97.0963 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.276,"smiles":null,"spectrum_id":"CCMSLIB00017310816","spectrum_index":46326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 159.0158 Da; putative annotation: N/A; putative formula: C5H5NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.107,"smiles":null,"spectrum_id":"CCMSLIB00017310819","spectrum_index":46327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 64.022 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.102,"smiles":null,"spectrum_id":"CCMSLIB00017310821","spectrum_index":46328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1200.5865 Da; putative annotation: N/A; putative formula: C64H84N10O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1393.66,"smiles":null,"spectrum_id":"CCMSLIB00017310823","spectrum_index":46329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoroindole-2-carboxylic acid (delta mass: 60.0242 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.07,"smiles":null,"spectrum_id":"CCMSLIB00017310826","spectrum_index":46330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 71.0564 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.32,"smiles":null,"spectrum_id":"CCMSLIB00017310829","spectrum_index":46331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of fMet CollisionEnergy:205060 (delta mass: 83.0362 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.089,"smiles":null,"spectrum_id":"CCMSLIB00017310832","spectrum_index":46332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(3-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]- (delta mass: 32.0277 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.22,"smiles":null,"spectrum_id":"CCMSLIB00017310835","spectrum_index":46333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 187.0847 Da; putative annotation: N/A; putative formula: C8H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.182,"smiles":null,"spectrum_id":"CCMSLIB00017310838","spectrum_index":46334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 147.0683 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.197,"smiles":null,"spectrum_id":"CCMSLIB00017310841","spectrum_index":46335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 76.0606 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.158,"smiles":null,"spectrum_id":"CCMSLIB00017310844","spectrum_index":46336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa - 30.0 eV (delta mass: 130.1549 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.231,"smiles":null,"spectrum_id":"CCMSLIB00017310847","spectrum_index":46337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 71.0355 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.159,"smiles":null,"spectrum_id":"CCMSLIB00017310850","spectrum_index":46338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 954.7452 Da; putative annotation: N/A; putative formula: C58H102N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1176.84,"smiles":null,"spectrum_id":"CCMSLIB00017310853","spectrum_index":46339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Glycolylneuraminic acid (delta mass: 94.0361 Da; putative annotation: N/A; putative formula: C6H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.144,"smiles":null,"spectrum_id":"CCMSLIB00017310855","spectrum_index":46340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltopentaose from NIST14 (delta mass: 364.1044 Da; putative annotation: N/A; putative formula: C17H8N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1193.39,"smiles":null,"spectrum_id":"CCMSLIB00017310858","spectrum_index":46341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 9.0612 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.148,"smiles":null,"spectrum_id":"CCMSLIB00017310860","spectrum_index":46342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 68.0622 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.211,"smiles":null,"spectrum_id":"CCMSLIB00017310863","spectrum_index":46343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 176.0323 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.123,"smiles":null,"spectrum_id":"CCMSLIB00017310866","spectrum_index":46344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 260.0287 Da; putative annotation: N/A; putative formula: C11H9N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.152,"smiles":null,"spectrum_id":"CCMSLIB00017310869","spectrum_index":46345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 81.0303 Da; putative annotation: N/A; putative formula: C3H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.175,"smiles":null,"spectrum_id":"CCMSLIB00017310871","spectrum_index":46346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Deoxypyridoxine (delta mass: 154.0027 Da; putative annotation: N/A; putative formula: C6H-2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.089,"smiles":null,"spectrum_id":"CCMSLIB00017310874","spectrum_index":46347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 28.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.037,"smiles":null,"spectrum_id":"CCMSLIB00017310877","spectrum_index":46348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 44.0171 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.066,"smiles":null,"spectrum_id":"CCMSLIB00017310880","spectrum_index":46349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU211802 Nordeprenyl|Desmethylselegiline|1-phenyl-N-prop-2-ynylpropan-2-amine (delta mass: 3.3723 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017310883","spectrum_index":46350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 318.2172 Da; putative annotation: N/A; putative formula: C16H26N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.403,"smiles":null,"spectrum_id":"CCMSLIB00017310886","spectrum_index":46351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 116.0965 Da; putative annotation: N/A; putative formula: C5H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.22,"smiles":null,"spectrum_id":"CCMSLIB00017310888","spectrum_index":46352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 226.0112 Da; putative annotation: N/A; putative formula: C9H6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.148,"smiles":null,"spectrum_id":"CCMSLIB00017310891","spectrum_index":46353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(4-Hydroxyanilino)methyl]-1-methyl-1H-indole-3-carbonitrile (delta mass: 32.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.18,"smiles":null,"spectrum_id":"CCMSLIB00017310894","spectrum_index":46354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 471.2569 Da; putative annotation: N/A; putative formula: C27H33N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.321,"smiles":null,"spectrum_id":"CCMSLIB00017310897","spectrum_index":46355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 130.0681 Da; putative annotation: N/A; putative formula: C4H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.109,"smiles":null,"spectrum_id":"CCMSLIB00017310898","spectrum_index":46356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 83.0477 Da; putative annotation: N/A; putative formula: C3H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.139,"smiles":null,"spectrum_id":"CCMSLIB00017310901","spectrum_index":46357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 276.1437 Da; putative annotation: N/A; putative formula: C10H20N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.297,"smiles":null,"spectrum_id":"CCMSLIB00017310904","spectrum_index":46358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diprotin B (delta mass: 212.1527 Da; putative annotation: N/A; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.376,"smiles":null,"spectrum_id":"CCMSLIB00017310907","spectrum_index":46359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 100.9974 Da; putative annotation: N/A; putative formula: H-1N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.079,"smiles":null,"spectrum_id":"CCMSLIB00017310909","spectrum_index":46360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 66.0438 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.108,"smiles":null,"spectrum_id":"CCMSLIB00017310912","spectrum_index":46361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 170.1105 Da; putative annotation: N/A; putative formula: C13H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.234,"smiles":null,"spectrum_id":"CCMSLIB00017310915","spectrum_index":46362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 40.0394 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.162,"smiles":null,"spectrum_id":"CCMSLIB00017310918","spectrum_index":46363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 31.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.227,"smiles":null,"spectrum_id":"CCMSLIB00017310920","spectrum_index":46364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 110.6415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.728,"smiles":null,"spectrum_id":"CCMSLIB00017310923","spectrum_index":46365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxylic acid (delta mass: 113.1456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.201,"smiles":null,"spectrum_id":"CCMSLIB00017310926","spectrum_index":46366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 192.0359 Da; putative annotation: N/A; putative formula: C9H8N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.077,"smiles":null,"spectrum_id":"CCMSLIB00017310928","spectrum_index":46367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 310.265 Da; putative annotation: N/A; putative formula: C17H35N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.378,"smiles":null,"spectrum_id":"CCMSLIB00017310931","spectrum_index":46368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 99.0682 Da; putative annotation: L-Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.192,"smiles":null,"spectrum_id":"CCMSLIB00017310934","spectrum_index":46369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 286.1928 Da; putative annotation: h_266_oxandrolone_m3; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.316,"smiles":null,"spectrum_id":"CCMSLIB00017310937","spectrum_index":46370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 184.0743 Da; putative annotation: 3-(2-Hydroxybutan-2-yl)-5-oxooxolane-3-carboxylic acid; putative formula: C9H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.249,"smiles":null,"spectrum_id":"CCMSLIB00017310939","spectrum_index":46371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 214.1019 Da; putative annotation: N/A; putative formula: C13H15N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.203,"smiles":null,"spectrum_id":"CCMSLIB00017310942","spectrum_index":46372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 171.0992 Da; putative annotation: N/A; putative formula: C3H9N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.175,"smiles":null,"spectrum_id":"CCMSLIB00017310945","spectrum_index":46373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 415.2359 Da; putative annotation: N/A; putative formula: C24H33NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.406,"smiles":null,"spectrum_id":"CCMSLIB00017310947","spectrum_index":46374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 119.0469 Da; putative annotation: N/A; putative formula: C6H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.17,"smiles":null,"spectrum_id":"CCMSLIB00017310950","spectrum_index":46375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 97.0531 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.15,"smiles":null,"spectrum_id":"CCMSLIB00017310953","spectrum_index":46376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(hydroxymethyl)-2-methyl-2-(5-oxooxolan-2-yl)-3H-chromen-4-one (delta mass: 130.1359 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.238,"smiles":null,"spectrum_id":"CCMSLIB00017310956","spectrum_index":46377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 58.0813 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.162,"smiles":null,"spectrum_id":"CCMSLIB00017310959","spectrum_index":46378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxfendazole (delta mass: 166.9873 Da; putative annotation: N/A; putative formula: C7H5NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.062,"smiles":null,"spectrum_id":"CCMSLIB00017310960","spectrum_index":46379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 210.0895 Da; putative annotation: N/A; putative formula: C11H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.202,"smiles":null,"spectrum_id":"CCMSLIB00017310963","spectrum_index":46380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one (delta mass: 17.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017310966","spectrum_index":46381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 525.2213 Da; putative annotation: N/A; putative formula: C25H35NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.297,"smiles":null,"spectrum_id":"CCMSLIB00017310969","spectrum_index":46382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 449.195 Da; putative annotation: N/A; putative formula: C25H27N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.286,"smiles":null,"spectrum_id":"CCMSLIB00017310971","spectrum_index":46383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 1178.4966 Da; putative annotation: N/A; putative formula: C92H62N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1385.58,"smiles":null,"spectrum_id":"CCMSLIB00017310973","spectrum_index":46384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 234.1569 Da; putative annotation: N/A; putative formula: C10H22N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.254,"smiles":null,"spectrum_id":"CCMSLIB00017310976","spectrum_index":46385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 122.0367 Da; putative annotation: N/A; putative formula: C7H6O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.154,"smiles":null,"spectrum_id":"CCMSLIB00017310979","spectrum_index":46386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 87.0255 Da; putative annotation: N/A; putative formula: C2H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.17,"smiles":null,"spectrum_id":"CCMSLIB00017310982","spectrum_index":46387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 88.0162 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.113,"smiles":null,"spectrum_id":"CCMSLIB00017310984","spectrum_index":46388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 292.2064 Da; putative annotation: N/A; putative formula: C17H29N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.36,"smiles":null,"spectrum_id":"CCMSLIB00017310986","spectrum_index":46389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 141.9351 Da; putative annotation: N/A; putative formula: C5H2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.016,"smiles":null,"spectrum_id":"CCMSLIB00017310989","spectrum_index":46390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ACETALDEHYDE (delta mass: 123.9763 Da; putative annotation: N/A; putative formula: CH4N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.052,"smiles":null,"spectrum_id":"CCMSLIB00017310992","spectrum_index":46391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 170.993 Da; putative annotation: N/A; putative formula: C2H6NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.02,"smiles":null,"spectrum_id":"CCMSLIB00017310994","spectrum_index":46392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 190.1722 Da; putative annotation: N/A; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.264,"smiles":null,"spectrum_id":"CCMSLIB00017310997","spectrum_index":46393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-[(2E,6E)-4-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl]benzoic acid (delta mass: 278.2254 Da; putative annotation: N/A; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.447,"smiles":null,"spectrum_id":"CCMSLIB00017311000","spectrum_index":46394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 124.0502 Da; putative annotation: N/A; putative formula: C3H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.147,"smiles":null,"spectrum_id":"CCMSLIB00017311004","spectrum_index":46395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 31.0843 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017311006","spectrum_index":46396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 125.0115 Da; putative annotation: N/A; putative formula: C5H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.092,"smiles":null,"spectrum_id":"CCMSLIB00017311009","spectrum_index":46397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.065,"smiles":null,"spectrum_id":"CCMSLIB00017311012","spectrum_index":46398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 4.0364 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.134,"smiles":null,"spectrum_id":"CCMSLIB00017311015","spectrum_index":46399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 127.082 Da; putative annotation: N/A; putative formula: C7H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.241,"smiles":null,"spectrum_id":"CCMSLIB00017311018","spectrum_index":46400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 131.059 Da; putative annotation: N/A; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.186,"smiles":null,"spectrum_id":"CCMSLIB00017311021","spectrum_index":46401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 56.0622 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.352,"smiles":null,"spectrum_id":"CCMSLIB00017311024","spectrum_index":46402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 218.0944 Da; putative annotation: N/A; putative formula: C13H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.149,"smiles":null,"spectrum_id":"CCMSLIB00017311026","spectrum_index":46403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2,9,10-trimethoxy-5,6-dihydroisoquinolino[3,2-a]isoquinolinium cation (delta mass: 289.1059 Da; putative annotation: N/A; putative formula: C14H15N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.245,"smiles":null,"spectrum_id":"CCMSLIB00017311029","spectrum_index":46404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 240.1699 Da; putative annotation: N/A; putative formula: C10H20N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.324,"smiles":null,"spectrum_id":"CCMSLIB00017311032","spectrum_index":46405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 62.0003 Da; putative annotation: N/A; putative formula: CH2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.108,"smiles":null,"spectrum_id":"CCMSLIB00017311035","spectrum_index":46406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 73.0893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.149,"smiles":null,"spectrum_id":"CCMSLIB00017311038","spectrum_index":46407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 33.008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.03,"smiles":null,"spectrum_id":"CCMSLIB00017311040","spectrum_index":46408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 64.0674 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.148,"smiles":null,"spectrum_id":"CCMSLIB00017311043","spectrum_index":46409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 31.0058 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.113,"smiles":null,"spectrum_id":"CCMSLIB00017311046","spectrum_index":46410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 202.1359 Da; putative annotation: N/A; putative formula: C14H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.41,"smiles":null,"spectrum_id":"CCMSLIB00017311049","spectrum_index":46411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 128.0377 Da; putative annotation: N/A; putative formula: C8H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.088,"smiles":null,"spectrum_id":"CCMSLIB00017311052","spectrum_index":46412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 333.2294 Da; putative annotation: N/A; putative formula: C20H31NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.321,"smiles":null,"spectrum_id":"CCMSLIB00017311054","spectrum_index":46413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 78.0427 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017311057","spectrum_index":46414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 121.0198 Da; putative annotation: N/A; putative formula: C3H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.111,"smiles":null,"spectrum_id":"CCMSLIB00017311060","spectrum_index":46415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-3-(4-piperidinyl)-1H-indole (delta mass: 18.019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017311063","spectrum_index":46416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 338.729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.815,"smiles":null,"spectrum_id":"CCMSLIB00017311066","spectrum_index":46417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 232.14 Da; putative annotation: N/A; putative formula: C14H20N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.305,"smiles":null,"spectrum_id":"CCMSLIB00017311069","spectrum_index":46418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 58.8907 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.966,"smiles":null,"spectrum_id":"CCMSLIB00017311072","spectrum_index":46419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 82.034 Da; putative annotation: N/A; putative formula: C5H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.12,"smiles":null,"spectrum_id":"CCMSLIB00017311074","spectrum_index":46420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 136.1716 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.247,"smiles":null,"spectrum_id":"CCMSLIB00017311077","spectrum_index":46421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 136.062 Da; putative annotation: N/A; putative formula: C3H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.142,"smiles":null,"spectrum_id":"CCMSLIB00017311080","spectrum_index":46422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 84.0256 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.164,"smiles":null,"spectrum_id":"CCMSLIB00017311083","spectrum_index":46423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 80.063 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.206,"smiles":null,"spectrum_id":"CCMSLIB00017311086","spectrum_index":46424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 94.0419 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.128,"smiles":null,"spectrum_id":"CCMSLIB00017311088","spectrum_index":46425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 160.085 Da; putative annotation: N/A; putative formula: C6H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.187,"smiles":null,"spectrum_id":"CCMSLIB00017311091","spectrum_index":46426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003354 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 74.0717 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.111,"smiles":null,"spectrum_id":"CCMSLIB00017311094","spectrum_index":46427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 242.1891 Da; putative annotation: N/A; putative formula: C15H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.479,"smiles":null,"spectrum_id":"CCMSLIB00017311097","spectrum_index":46428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017311100","spectrum_index":46429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 73.0529 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017311103","spectrum_index":46430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 24.0001 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.118,"smiles":null,"spectrum_id":"CCMSLIB00017311106","spectrum_index":46431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 88.0742 Da; putative annotation: N/A; putative formula: C2H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.155,"smiles":null,"spectrum_id":"CCMSLIB00017311109","spectrum_index":46432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 56.0635 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.202,"smiles":null,"spectrum_id":"CCMSLIB00017311112","spectrum_index":46433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 126.0689 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.119,"smiles":null,"spectrum_id":"CCMSLIB00017311115","spectrum_index":46434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.175,"smiles":null,"spectrum_id":"CCMSLIB00017311118","spectrum_index":46435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 63.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.123,"smiles":null,"spectrum_id":"CCMSLIB00017311120","spectrum_index":46436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 95.0849 Da; putative annotation: N/A; putative formula: C5H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.171,"smiles":null,"spectrum_id":"CCMSLIB00017311123","spectrum_index":46437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 376.1286 Da; putative annotation: N/A; putative formula: C16H25O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.215,"smiles":null,"spectrum_id":"CCMSLIB00017311126","spectrum_index":46438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 74.0516 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.211,"smiles":null,"spectrum_id":"CCMSLIB00017311129","spectrum_index":46439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 126.0681 Da; putative annotation: N/A; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.201,"smiles":null,"spectrum_id":"CCMSLIB00017311132","spectrum_index":46440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017311135","spectrum_index":46441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzyl homoveratrylamine (delta mass: 127.0778 Da; putative annotation: N/A; putative formula: C10H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.242,"smiles":null,"spectrum_id":"CCMSLIB00017311137","spectrum_index":46442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 36.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.186,"smiles":null,"spectrum_id":"CCMSLIB00017311140","spectrum_index":46443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Phenyl-1H-indol-1-yl)propanoic acid (delta mass: 26.0261 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.144,"smiles":null,"spectrum_id":"CCMSLIB00017311143","spectrum_index":46444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ARABITOL (delta mass: 64.0679 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.144,"smiles":null,"spectrum_id":"CCMSLIB00017311146","spectrum_index":46445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 123.0305 Da; putative annotation: N/A; putative formula: H6N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.091,"smiles":null,"spectrum_id":"CCMSLIB00017311149","spectrum_index":46446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 474.4445 Da; putative annotation: N/A; putative formula: C32H58O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.531,"smiles":null,"spectrum_id":"CCMSLIB00017311151","spectrum_index":46447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2,3-Dihydro-1H-perimidin-2-yl)-1,2-benzenediol (delta mass: 296.0449 Da; putative annotation: N/A; putative formula: C13H13O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.158,"smiles":null,"spectrum_id":"CCMSLIB00017311154","spectrum_index":46448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 192.0638 Da; putative annotation: N/A; putative formula: C8H16OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.166,"smiles":null,"spectrum_id":"CCMSLIB00017311156","spectrum_index":46449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 196.1705 Da; putative annotation: N/A; putative formula: C10H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.34,"smiles":null,"spectrum_id":"CCMSLIB00017311159","spectrum_index":46450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-(methylthio)- (delta mass: 18.0126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.175,"smiles":null,"spectrum_id":"CCMSLIB00017311162","spectrum_index":46451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine - 40.0 eV (delta mass: 322.1471 Da; putative annotation: N/A; putative formula: C23H18N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.249,"smiles":null,"spectrum_id":"CCMSLIB00017311165","spectrum_index":46452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 128.0587 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.096,"smiles":null,"spectrum_id":"CCMSLIB00017311168","spectrum_index":46453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 254.1304 Da; putative annotation: N/A; putative formula: C17H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.248,"smiles":null,"spectrum_id":"CCMSLIB00017311169","spectrum_index":46454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 280.11 Da; putative annotation: N/A; putative formula: C18H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.175,"smiles":null,"spectrum_id":"CCMSLIB00017311172","spectrum_index":46455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 369.2525 Da; putative annotation: N/A; putative formula: C21H39NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.313,"smiles":null,"spectrum_id":"CCMSLIB00017311175","spectrum_index":46456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cephalotaxine (delta mass: 35.0452 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.199,"smiles":null,"spectrum_id":"CCMSLIB00017311178","spectrum_index":46457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Methyl-1-piperazinyl)butanoic acid (delta mass: 169.1103 Da; putative annotation: N/A; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.254,"smiles":null,"spectrum_id":"CCMSLIB00017311180","spectrum_index":46458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 115.0691 Da; putative annotation: N/A; putative formula: H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.254,"smiles":null,"spectrum_id":"CCMSLIB00017311183","spectrum_index":46459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 154.0991 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.191,"smiles":null,"spectrum_id":"CCMSLIB00017311186","spectrum_index":46460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 235.1658 Da; putative annotation: N/A; putative formula: C9H17N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.293,"smiles":null,"spectrum_id":"CCMSLIB00017311188","spectrum_index":46461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-Methyl-DL-serine (delta mass: 284.236 Da; putative annotation: N/A; putative formula: C18H28N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.302,"smiles":null,"spectrum_id":"CCMSLIB00017311191","spectrum_index":46462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 662.1492 Da; putative annotation: N/A; putative formula: C31H34O12S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.209,"smiles":null,"spectrum_id":"CCMSLIB00017311194","spectrum_index":46463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 37.935 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.97,"smiles":null,"spectrum_id":"CCMSLIB00017311197","spectrum_index":46464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 98.0559 Da; putative annotation: N/A; putative formula: C6H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.093,"smiles":null,"spectrum_id":"CCMSLIB00017311199","spectrum_index":46465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 278.1358 Da; putative annotation: N/A; putative formula: C16H24P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.222,"smiles":null,"spectrum_id":"CCMSLIB00017311202","spectrum_index":46466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 116.0831 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.242,"smiles":null,"spectrum_id":"CCMSLIB00017311205","spectrum_index":46467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 61.9559 Da; putative annotation: N/A; putative formula: H-1O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.11,"smiles":null,"spectrum_id":"CCMSLIB00017311207","spectrum_index":46468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 101.0468 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.122,"smiles":null,"spectrum_id":"CCMSLIB00017311210","spectrum_index":46469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(9H-Carbazol-9-yl)propanoic acid (delta mass: 73.0166 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.118,"smiles":null,"spectrum_id":"CCMSLIB00017311213","spectrum_index":46470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 467.2876 Da; putative annotation: N/A; putative formula: C29H43NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.368,"smiles":null,"spectrum_id":"CCMSLIB00017311216","spectrum_index":46471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 109.0531 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.14,"smiles":null,"spectrum_id":"CCMSLIB00017311218","spectrum_index":46472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 67.9897 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.06,"smiles":null,"spectrum_id":"CCMSLIB00017311220","spectrum_index":46473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 137.069 Da; putative annotation: N/A; putative formula: C5H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.161,"smiles":null,"spectrum_id":"CCMSLIB00017311223","spectrum_index":46474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 87.9463 Da; putative annotation: N/A; putative formula: C2S2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.001,"smiles":null,"spectrum_id":"CCMSLIB00017311226","spectrum_index":46475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 82.0071 Da; putative annotation: N/A; putative formula: C3H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.119,"smiles":null,"spectrum_id":"CCMSLIB00017311229","spectrum_index":46476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 55.0052 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017311232","spectrum_index":46477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 107.0813 Da; putative annotation: N/A; putative formula: C6H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.141,"smiles":null,"spectrum_id":"CCMSLIB00017311234","spectrum_index":46478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-Binaphthyl-8,8'-dicarboxylic acid (delta mass: 337.3843 Da; putative annotation: N/A; putative formula: C22H47N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.481,"smiles":null,"spectrum_id":"CCMSLIB00017311236","spectrum_index":46479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1070.5332 Da; putative annotation: N/A; putative formula: C48H74N14O12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1263.6,"smiles":null,"spectrum_id":"CCMSLIB00017311239","spectrum_index":46480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 497.1717 Da; putative annotation: N/A; putative formula: C25H28N3O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.325,"smiles":null,"spectrum_id":"CCMSLIB00017311242","spectrum_index":46481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 106.0745 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017311244","spectrum_index":46482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 389.1548 Da; putative annotation: N/A; putative formula: C14H23N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.309,"smiles":null,"spectrum_id":"CCMSLIB00017311247","spectrum_index":46483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 274.1531 Da; putative annotation: N/A; putative formula: C14H29O-1P3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.24,"smiles":null,"spectrum_id":"CCMSLIB00017311249","spectrum_index":46484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 686.6643 Da; putative annotation: N/A; putative formula: C44H86N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.74,"smiles":null,"spectrum_id":"CCMSLIB00017311252","spectrum_index":46485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole_3_acetic_acid (delta mass: 71.0399 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.111,"smiles":null,"spectrum_id":"CCMSLIB00017311255","spectrum_index":46486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 45.0215 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017311258","spectrum_index":46487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 226.1203 Da; putative annotation: N/A; putative formula: C12H18O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.185,"smiles":null,"spectrum_id":"CCMSLIB00017311260","spectrum_index":46488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 136.0353 Da; putative annotation: N/A; putative formula: CN10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.116,"smiles":null,"spectrum_id":"CCMSLIB00017311262","spectrum_index":46489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Magnoflorine (delta mass: 1.9776 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.148,"smiles":null,"spectrum_id":"CCMSLIB00017311265","spectrum_index":46490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 32.0034 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.1,"smiles":null,"spectrum_id":"CCMSLIB00017311268","spectrum_index":46491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-carboxypropanoylamino)-3-indol-3-ylpropanoic acid CollisionEnergy:102040 (delta mass: 263.1266 Da; putative annotation: N/A; putative formula: C13H17N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.24,"smiles":null,"spectrum_id":"CCMSLIB00017311271","spectrum_index":46492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Glu-Lys (delta mass: 128.0956 Da; putative annotation: N/A; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.335,"smiles":null,"spectrum_id":"CCMSLIB00017311273","spectrum_index":46493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 606.9588 Da; putative annotation: N/A; putative formula: C17H9N3O22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.056,"smiles":null,"spectrum_id":"CCMSLIB00017311276","spectrum_index":46494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 933.9095 Da; putative annotation: N/A; putative formula: C30H22N2O21P4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1156.01,"smiles":null,"spectrum_id":"CCMSLIB00017311279","spectrum_index":46495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 172.1098 Da; putative annotation: N/A; putative formula: C9H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.212,"smiles":null,"spectrum_id":"CCMSLIB00017311281","spectrum_index":46496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 579.3033 Da; putative annotation: N/A; putative formula: C35H41N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":726.369,"smiles":null,"spectrum_id":"CCMSLIB00017311284","spectrum_index":46497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 231.1479 Da; putative annotation: N/A; putative formula: C12H25NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.271,"smiles":null,"spectrum_id":"CCMSLIB00017311287","spectrum_index":46498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ARABITOL (delta mass: 232.074 Da; putative annotation: N/A; putative formula: C6H12N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.15,"smiles":null,"spectrum_id":"CCMSLIB00017311290","spectrum_index":46499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminophenylboronic acid (delta mass: 75.0432 Da; putative annotation: N/A; putative formula: CH5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.115,"smiles":null,"spectrum_id":"CCMSLIB00017311292","spectrum_index":46500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 39.0473 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017311295","spectrum_index":46501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of E-N-Deoxyfructosyllysine (delta mass: 81.0576 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.223,"smiles":null,"spectrum_id":"CCMSLIB00017311298","spectrum_index":46502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 60.0 eV (delta mass: 297.1481 Da; putative annotation: N/A; putative formula: C17H19N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.25,"smiles":null,"spectrum_id":"CCMSLIB00017311301","spectrum_index":46503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 75.0374 Da; putative annotation: N/A; putative formula: CH6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.186,"smiles":null,"spectrum_id":"CCMSLIB00017311303","spectrum_index":46504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 138.0314 Da; putative annotation: N/A; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.112,"smiles":null,"spectrum_id":"CCMSLIB00017311306","spectrum_index":46505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylphenylalanine (delta mass: 56.0259 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.123,"smiles":null,"spectrum_id":"CCMSLIB00017311309","spectrum_index":46506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 185.214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.285,"smiles":null,"spectrum_id":"CCMSLIB00017311312","spectrum_index":46507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 27.0692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.124,"smiles":null,"spectrum_id":"CCMSLIB00017311314","spectrum_index":46508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 39.0106 Da; putative annotation: N/A; putative formula: C2HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.071,"smiles":null,"spectrum_id":"CCMSLIB00017311317","spectrum_index":46509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy-5-pentyl-2-prenylphenol (delta mass: 116.0837 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.284,"smiles":null,"spectrum_id":"CCMSLIB00017311320","spectrum_index":46510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Dimethyl-5-indolinesulfonamide (delta mass: 39.0537 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.139,"smiles":null,"spectrum_id":"CCMSLIB00017311323","spectrum_index":46511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380084-01_C21H30O4_Benzo[b]cyclopenta[e]pyran-8(3H)-one, 3a,5,6,7,9,9a-hexahydro-7-hydroxy-1-[(4E)-6-hydroxy-1,5-dimethyl-4-hexen-1-yl]-3a-methyl- (delta mass: 74.0519 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.274,"smiles":null,"spectrum_id":"CCMSLIB00017311325","spectrum_index":46512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decitabine (delta mass: 58.0453 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.138,"smiles":null,"spectrum_id":"CCMSLIB00017311328","spectrum_index":46513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 129.0441 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.167,"smiles":null,"spectrum_id":"CCMSLIB00017311330","spectrum_index":46514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 125.0867 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.173,"smiles":null,"spectrum_id":"CCMSLIB00017311334","spectrum_index":46515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 51.011 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.149,"smiles":null,"spectrum_id":"CCMSLIB00017311337","spectrum_index":46516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 111.1112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017311340","spectrum_index":46517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 9.943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.05,"smiles":null,"spectrum_id":"CCMSLIB00017311343","spectrum_index":46518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 36.0365 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.159,"smiles":null,"spectrum_id":"CCMSLIB00017311346","spectrum_index":46519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 86.2149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.39,"smiles":null,"spectrum_id":"CCMSLIB00017311348","spectrum_index":46520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 234.126 Da; putative annotation: N/A; putative formula: C14H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.217,"smiles":null,"spectrum_id":"CCMSLIB00017311351","spectrum_index":46521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carbonitrile (delta mass: 62.0302 Da; putative annotation: N/A; putative formula: C4H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.091,"smiles":null,"spectrum_id":"CCMSLIB00017311354","spectrum_index":46522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.129,"smiles":null,"spectrum_id":"CCMSLIB00017311357","spectrum_index":46523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 283.2871 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.363,"smiles":null,"spectrum_id":"CCMSLIB00017311360","spectrum_index":46524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 294.2919 Da; putative annotation: N/A; putative formula: C20H38O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.373,"smiles":null,"spectrum_id":"CCMSLIB00017311362","spectrum_index":46525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 91.0268 Da; putative annotation: N/A; putative formula: C2H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.113,"smiles":null,"spectrum_id":"CCMSLIB00017311365","spectrum_index":46526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 143.0564 Da; putative annotation: 3-Aminoadipic acid; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.143,"smiles":null,"spectrum_id":"CCMSLIB00017311368","spectrum_index":46527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 260.0834 Da; putative annotation: 1-(Morpholin-4-ylsulfonyl)piperidine-4-carboxylic acid; putative formula: C10H16N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.184,"smiles":null,"spectrum_id":"CCMSLIB00017311371","spectrum_index":46528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 147.0682 Da; putative annotation: 2-Amino-4'-methoxyacetophenone; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.165,"smiles":null,"spectrum_id":"CCMSLIB00017311373","spectrum_index":46529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 119.0362 Da; putative annotation: Anthranilic acid; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.107,"smiles":null,"spectrum_id":"CCMSLIB00017311376","spectrum_index":46530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 92.0258 Da; putative annotation: Massbank:RP012001 Pyrocatechol|benzene-1,2-diol; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017311379","spectrum_index":46531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 116.0466 Da; putative annotation: 2-Deoxy-D-ribose; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.112,"smiles":null,"spectrum_id":"CCMSLIB00017311382","spectrum_index":46532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 161.0685 Da; putative annotation: D-Mannosamine; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.129,"smiles":null,"spectrum_id":"CCMSLIB00017311385","spectrum_index":46533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephromopsic acid (delta mass: 132.0934 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.346,"smiles":null,"spectrum_id":"CCMSLIB00017311388","spectrum_index":46534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 253.0884 Da; putative annotation: N/A; putative formula: C11H15N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.212,"smiles":null,"spectrum_id":"CCMSLIB00017311390","spectrum_index":46535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 18.0176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.082,"smiles":null,"spectrum_id":"CCMSLIB00017311393","spectrum_index":46536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 226.1933 Da; putative annotation: N/A; putative formula: C14H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.295,"smiles":null,"spectrum_id":"CCMSLIB00017311396","spectrum_index":46537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 57.0223 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.082,"smiles":null,"spectrum_id":"CCMSLIB00017311399","spectrum_index":46538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 213.1021 Da; putative annotation: N/A; putative formula: C11H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.209,"smiles":null,"spectrum_id":"CCMSLIB00017311402","spectrum_index":46539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 300.1573 Da; putative annotation: N/A; putative formula: C15H24O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.249,"smiles":null,"spectrum_id":"CCMSLIB00017311405","spectrum_index":46540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 407.1129 Da; putative annotation: N/A; putative formula: C22H13N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.193,"smiles":null,"spectrum_id":"CCMSLIB00017311407","spectrum_index":46541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloropropyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 304.0422 Da; putative annotation: N/A; putative formula: C9H8N10O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.106,"smiles":null,"spectrum_id":"CCMSLIB00017311410","spectrum_index":46542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apabetalone (delta mass: 135.0382 Da; putative annotation: N/A; putative formula: C3H10N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.198,"smiles":null,"spectrum_id":"CCMSLIB00017311413","spectrum_index":46543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 285.2304 Da; putative annotation: N/A; putative formula: C16H31NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.267,"smiles":null,"spectrum_id":"CCMSLIB00017311416","spectrum_index":46544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 707.2778 Da; putative annotation: N/A; putative formula: C39H41N5O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.364,"smiles":null,"spectrum_id":"CCMSLIB00017311419","spectrum_index":46545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 17.9211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.059,"smiles":null,"spectrum_id":"CCMSLIB00017311421","spectrum_index":46546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 373.189 Da; putative annotation: N/A; putative formula: C21H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.286,"smiles":null,"spectrum_id":"CCMSLIB00017311424","spectrum_index":46547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Glu (delta mass: 193.0629 Da; putative annotation: N/A; putative formula: C4H11N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.15,"smiles":null,"spectrum_id":"CCMSLIB00017311427","spectrum_index":46548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 82.0778 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.222,"smiles":null,"spectrum_id":"CCMSLIB00017311430","spectrum_index":46549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 25.0134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017311433","spectrum_index":46550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 182.0943 Da; putative annotation: N/A; putative formula: C10H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.154,"smiles":null,"spectrum_id":"CCMSLIB00017311436","spectrum_index":46551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 992.5931 Da; putative annotation: N/A; putative formula: C49H72N18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1214.69,"smiles":null,"spectrum_id":"CCMSLIB00017311439","spectrum_index":46552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mannitol (delta mass: 364.0583 Da; putative annotation: N/A; putative formula: C20H12O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.145,"smiles":null,"spectrum_id":"CCMSLIB00017311442","spectrum_index":46553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 302.0517 Da; putative annotation: N/A; putative formula: C9H22O3P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.164,"smiles":null,"spectrum_id":"CCMSLIB00017311444","spectrum_index":46554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin F (delta mass: 96.033 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.312,"smiles":null,"spectrum_id":"CCMSLIB00017311447","spectrum_index":46555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 123.9945 Da; putative annotation: N/A; putative formula: CH4N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.285,"smiles":null,"spectrum_id":"CCMSLIB00017311450","spectrum_index":46556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 248.1162 Da; putative annotation: N/A; putative formula: C13H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.27,"smiles":null,"spectrum_id":"CCMSLIB00017311453","spectrum_index":46557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Fluoro-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 113.0785 Da; putative annotation: N/A; putative formula: C6H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.176,"smiles":null,"spectrum_id":"CCMSLIB00017311456","spectrum_index":46558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 22.028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.093,"smiles":null,"spectrum_id":"CCMSLIB00017311458","spectrum_index":46559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 24.0206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017311461","spectrum_index":46560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Gln (delta mass: 114.0412 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.145,"smiles":null,"spectrum_id":"CCMSLIB00017311464","spectrum_index":46561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 45.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.197,"smiles":null,"spectrum_id":"CCMSLIB00017311467","spectrum_index":46562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 111.0993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.17,"smiles":null,"spectrum_id":"CCMSLIB00017311469","spectrum_index":46563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 58.0056 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.065,"smiles":null,"spectrum_id":"CCMSLIB00017311472","spectrum_index":46564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 84.0573 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.16,"smiles":null,"spectrum_id":"CCMSLIB00017311476","spectrum_index":46565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 156.1031 Da; putative annotation: N/A; putative formula: C6H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.21,"smiles":null,"spectrum_id":"CCMSLIB00017311478","spectrum_index":46566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 45.059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.119,"smiles":null,"spectrum_id":"CCMSLIB00017311481","spectrum_index":46567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 176.1344 Da; putative annotation: N/A; putative formula: CH12N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.242,"smiles":null,"spectrum_id":"CCMSLIB00017311484","spectrum_index":46568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 224.1941 Da; putative annotation: N/A; putative formula: C18H24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.28,"smiles":null,"spectrum_id":"CCMSLIB00017311487","spectrum_index":46569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 77.0263 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017311490","spectrum_index":46570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Thr (delta mass: 276.1548 Da; putative annotation: N/A; putative formula: C17H24OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.247,"smiles":null,"spectrum_id":"CCMSLIB00017311493","spectrum_index":46571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 67.0452 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.142,"smiles":null,"spectrum_id":"CCMSLIB00017311496","spectrum_index":46572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1023.0431 Da; putative annotation: N/A; putative formula: C56H33NO5S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1245.14,"smiles":null,"spectrum_id":"CCMSLIB00017311499","spectrum_index":46573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 46.0304 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.171,"smiles":null,"spectrum_id":"CCMSLIB00017311501","spectrum_index":46574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 218.0342 Da; putative annotation: N/A; putative formula: C7H10N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.115,"smiles":null,"spectrum_id":"CCMSLIB00017311504","spectrum_index":46575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 24.9003 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.997,"smiles":null,"spectrum_id":"CCMSLIB00017311506","spectrum_index":46576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 273.1689 Da; putative annotation: N/A; putative formula: C12H23N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.324,"smiles":null,"spectrum_id":"CCMSLIB00017311509","spectrum_index":46577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 631.1983 Da; putative annotation: N/A; putative formula: C25H29N9O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.29,"smiles":null,"spectrum_id":"CCMSLIB00017311512","spectrum_index":46578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 515.2366 Da; putative annotation: N/A; putative formula: C24H37NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.318,"smiles":null,"spectrum_id":"CCMSLIB00017311514","spectrum_index":46579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 15.893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017311517","spectrum_index":46580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 171.0225 Da; putative annotation: N/A; putative formula: C4H7N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.166,"smiles":null,"spectrum_id":"CCMSLIB00017311520","spectrum_index":46581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(4-Chlorophenyl)-5-nitro-2-piperidinone (delta mass: 163.0212 Da; putative annotation: N/A; putative formula: C7H5N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.074,"smiles":null,"spectrum_id":"CCMSLIB00017311523","spectrum_index":46582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of p-Phenylenediamine (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.107,"smiles":null,"spectrum_id":"CCMSLIB00017311525","spectrum_index":46583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 351.1112 Da; putative annotation: N/A; putative formula: C12H23N3O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.297,"smiles":null,"spectrum_id":"CCMSLIB00017311527","spectrum_index":46584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 204.0981 Da; putative annotation: N/A; putative formula: C6H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.2,"smiles":null,"spectrum_id":"CCMSLIB00017311530","spectrum_index":46585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 230.1724 Da; putative annotation: N/A; putative formula: C13H28O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.274,"smiles":null,"spectrum_id":"CCMSLIB00017311533","spectrum_index":46586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 346.1381 Da; putative annotation: N/A; putative formula: C26H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.225,"smiles":null,"spectrum_id":"CCMSLIB00017311536","spectrum_index":46587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 46.0057 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.15,"smiles":null,"spectrum_id":"CCMSLIB00017311537","spectrum_index":46588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 41.0601 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.162,"smiles":null,"spectrum_id":"CCMSLIB00017311541","spectrum_index":46589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 65.0334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.109,"smiles":null,"spectrum_id":"CCMSLIB00017311545","spectrum_index":46590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 46.0423 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017311547","spectrum_index":46591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 448.2191 Da; putative annotation: N/A; putative formula: C20H32N8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.332,"smiles":null,"spectrum_id":"CCMSLIB00017311550","spectrum_index":46592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 113.0849 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017311552","spectrum_index":46593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 16.9789 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.096,"smiles":null,"spectrum_id":"CCMSLIB00017311554","spectrum_index":46594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentamethylene bisacetamide (delta mass: 117.0423 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.186,"smiles":null,"spectrum_id":"CCMSLIB00017311557","spectrum_index":46595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 639.2899 Da; putative annotation: N/A; putative formula: C32H41N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.355,"smiles":null,"spectrum_id":"CCMSLIB00017311560","spectrum_index":46596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 54.9691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.071,"smiles":null,"spectrum_id":"CCMSLIB00017311563","spectrum_index":46597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 160.9855 Da; putative annotation: N/A; putative formula: C6H-1N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.056,"smiles":null,"spectrum_id":"CCMSLIB00017311566","spectrum_index":46598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 301.6958 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.819,"smiles":null,"spectrum_id":"CCMSLIB00017311569","spectrum_index":46599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 70.035 Da; putative annotation: N/A; putative formula: C4H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.007,"smiles":null,"spectrum_id":"CCMSLIB00017311571","spectrum_index":46600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 15.1776 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.342,"smiles":null,"spectrum_id":"CCMSLIB00017311573","spectrum_index":46601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 246.2924 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.379,"smiles":null,"spectrum_id":"CCMSLIB00017311576","spectrum_index":46602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 175.0594 Da; putative annotation: N/A; putative formula: C5H9N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.119,"smiles":null,"spectrum_id":"CCMSLIB00017311579","spectrum_index":46603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 36.0347 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.21,"smiles":null,"spectrum_id":"CCMSLIB00017311582","spectrum_index":46604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 36.0365 Da; putative annotation: N/A; putative formula: C4H4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017311584","spectrum_index":46605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 221.1714 Da; putative annotation: N/A; putative formula: C14H24NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.325,"smiles":null,"spectrum_id":"CCMSLIB00017311586","spectrum_index":46606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Phosphogluconic acid (delta mass: 109.9912 Da; putative annotation: N/A; putative formula: C5H3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.023,"smiles":null,"spectrum_id":"CCMSLIB00017311589","spectrum_index":46607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Aminobutyl)urea (delta mass: 41.9994 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.113,"smiles":null,"spectrum_id":"CCMSLIB00017311592","spectrum_index":46608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 343.1651 Da; putative annotation: N/A; putative formula: C10H21N11OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.247,"smiles":null,"spectrum_id":"CCMSLIB00017311595","spectrum_index":46609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-His (delta mass: 113.0845 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.245,"smiles":null,"spectrum_id":"CCMSLIB00017311598","spectrum_index":46610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 371.1426 Da; putative annotation: N/A; putative formula: C11H13N15O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.297,"smiles":null,"spectrum_id":"CCMSLIB00017311600","spectrum_index":46611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 82.0267 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.129,"smiles":null,"spectrum_id":"CCMSLIB00017311603","spectrum_index":46612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 107.0366 Da; putative annotation: N/A; putative formula: H6N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.128,"smiles":null,"spectrum_id":"CCMSLIB00017311606","spectrum_index":46613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 110.0514 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.175,"smiles":null,"spectrum_id":"CCMSLIB00017311609","spectrum_index":46614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 180.0627 Da; putative annotation: N/A; putative formula: C10H14O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.112,"smiles":null,"spectrum_id":"CCMSLIB00017311611","spectrum_index":46615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Pyrimidinylmethanol (delta mass: 64.0121 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.067,"smiles":null,"spectrum_id":"CCMSLIB00017311614","spectrum_index":46616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 88.0161 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017311617","spectrum_index":46617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 103.0635 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.16,"smiles":null,"spectrum_id":"CCMSLIB00017311620","spectrum_index":46618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 249.2396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.316,"smiles":null,"spectrum_id":"CCMSLIB00017311622","spectrum_index":46619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 73.0306 Da; putative annotation: N/A; putative formula: C6H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.117,"smiles":null,"spectrum_id":"CCMSLIB00017311624","spectrum_index":46620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 110.0365 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.16,"smiles":null,"spectrum_id":"CCMSLIB00017311627","spectrum_index":46621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250803 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 182.0659 Da; putative annotation: N/A; putative formula: C4H6N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.126,"smiles":null,"spectrum_id":"CCMSLIB00017311630","spectrum_index":46622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of aminoadipic-acid-C4:0 (delta mass: 52.0309 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.149,"smiles":null,"spectrum_id":"CCMSLIB00017311633","spectrum_index":46623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 104.007 Da; putative annotation: N/A; putative formula: C2H6N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.13,"smiles":null,"spectrum_id":"CCMSLIB00017311635","spectrum_index":46624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 274.1055 Da; putative annotation: N/A; putative formula: C7H15N8O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.181,"smiles":null,"spectrum_id":"CCMSLIB00017311638","spectrum_index":46625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084606 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 20.0236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.078,"smiles":null,"spectrum_id":"CCMSLIB00017311641","spectrum_index":46626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 36.0218 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.186,"smiles":null,"spectrum_id":"CCMSLIB00017311644","spectrum_index":46627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 407.1891 Da; putative annotation: N/A; putative formula: C21H25N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.276,"smiles":null,"spectrum_id":"CCMSLIB00017311647","spectrum_index":46628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.155,"smiles":null,"spectrum_id":"CCMSLIB00017311649","spectrum_index":46629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-BUTYRIC ACID (delta mass: 174.0489 Da; putative annotation: N/A; putative formula: C3H6N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.151,"smiles":null,"spectrum_id":"CCMSLIB00017311652","spectrum_index":46630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 230.103 Da; putative annotation: N/A; putative formula: C9H10N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.227,"smiles":null,"spectrum_id":"CCMSLIB00017311655","spectrum_index":46631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Threoninamide (delta mass: 9.0005 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":128.082,"smiles":null,"spectrum_id":"CCMSLIB00017311658","spectrum_index":46632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 32.0284 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.094,"smiles":null,"spectrum_id":"CCMSLIB00017311660","spectrum_index":46633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamyl-S-(C3H5)-Cysteine sulfoxide (delta mass: 666.2213 Da; putative annotation: N/A; putative formula: C37H34N2O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.317,"smiles":null,"spectrum_id":"CCMSLIB00017311662","spectrum_index":46634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 46.0045 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.138,"smiles":null,"spectrum_id":"CCMSLIB00017311665","spectrum_index":46635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 359.2722 Da; putative annotation: N/A; putative formula: C25H33N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.344,"smiles":null,"spectrum_id":"CCMSLIB00017311668","spectrum_index":46636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 60.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.181,"smiles":null,"spectrum_id":"CCMSLIB00017311671","spectrum_index":46637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 168.0538 Da; putative annotation: N/A; putative formula: C7H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.151,"smiles":null,"spectrum_id":"CCMSLIB00017311673","spectrum_index":46638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 560.3719 Da; putative annotation: N/A; putative formula: C28H49N8O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":767.458,"smiles":null,"spectrum_id":"CCMSLIB00017311675","spectrum_index":46639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 379.1637 Da; putative annotation: N/A; putative formula: C12H25N7O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":752.328,"smiles":null,"spectrum_id":"CCMSLIB00017311678","spectrum_index":46640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cannabinol (delta mass: 78.0316 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.232,"smiles":null,"spectrum_id":"CCMSLIB00017311681","spectrum_index":46641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 697.5382 Da; putative annotation: N/A; putative formula: C42H71N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.614,"smiles":null,"spectrum_id":"CCMSLIB00017311684","spectrum_index":46642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 700.5478 Da; putative annotation: N/A; putative formula: C45H80O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.623,"smiles":null,"spectrum_id":"CCMSLIB00017311685","spectrum_index":46643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 18.0066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.108,"smiles":null,"spectrum_id":"CCMSLIB00017311688","spectrum_index":46644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 199.0402 Da; putative annotation: N/A; putative formula: C8H10NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.293,"smiles":null,"spectrum_id":"CCMSLIB00017311691","spectrum_index":46645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 44.0013 Da; putative annotation: N/A; putative formula: N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.083,"smiles":null,"spectrum_id":"CCMSLIB00017311694","spectrum_index":46646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (delta mass: 114.0109 Da; putative annotation: N/A; putative formula: C8H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.1,"smiles":null,"spectrum_id":"CCMSLIB00017311697","spectrum_index":46647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 191.1154 Da; putative annotation: N/A; putative formula: C8H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.201,"smiles":null,"spectrum_id":"CCMSLIB00017311698","spectrum_index":46648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 61.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.186,"smiles":null,"spectrum_id":"CCMSLIB00017311701","spectrum_index":46649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 20.0 eV (delta mass: 267.096 Da; putative annotation: N/A; putative formula: C12H18N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.133,"smiles":null,"spectrum_id":"CCMSLIB00017311704","spectrum_index":46650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 219.0733 Da; putative annotation: N/A; putative formula: C12H15NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.171,"smiles":null,"spectrum_id":"CCMSLIB00017311707","spectrum_index":46651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 221.1093 Da; putative annotation: N/A; putative formula: C9H21NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.211,"smiles":null,"spectrum_id":"CCMSLIB00017311710","spectrum_index":46652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-deoxyfructosylleucylisoleucine (delta mass: 162.0535 Da; putative annotation: N/A; putative formula: C7H14S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.292,"smiles":null,"spectrum_id":"CCMSLIB00017311713","spectrum_index":46653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 68.0475 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017311716","spectrum_index":46654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 49.9834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.081,"smiles":null,"spectrum_id":"CCMSLIB00017311718","spectrum_index":46655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 279.147 Da; putative annotation: N/A; putative formula: C15H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.296,"smiles":null,"spectrum_id":"CCMSLIB00017311720","spectrum_index":46656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-uridine (delta mass: 126.0353 Da; putative annotation: N/A; putative formula: C5H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.112,"smiles":null,"spectrum_id":"CCMSLIB00017311723","spectrum_index":46657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 260.1411 Da; putative annotation: N/A; putative formula: C16H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.227,"smiles":null,"spectrum_id":"CCMSLIB00017311726","spectrum_index":46658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 109.064 Da; putative annotation: N/A; putative formula: C5H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.193,"smiles":null,"spectrum_id":"CCMSLIB00017311729","spectrum_index":46659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 68.1717 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.347,"smiles":null,"spectrum_id":"CCMSLIB00017311731","spectrum_index":46660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 101.0728 Da; putative annotation: N/A; putative formula: C2H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.228,"smiles":null,"spectrum_id":"CCMSLIB00017311733","spectrum_index":46661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380224-01!1,7-bis(3,4-dihydroxyphenyl)-6-methoxyheptan-3-one (delta mass: 213.1001 Da; putative annotation: N/A; putative formula: C10H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.265,"smiles":null,"spectrum_id":"CCMSLIB00017311736","spectrum_index":46662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mitoridine (delta mass: 17.0703 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.246,"smiles":null,"spectrum_id":"CCMSLIB00017311739","spectrum_index":46663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luciferin (delta mass: 106.1756 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.181,"smiles":null,"spectrum_id":"CCMSLIB00017311742","spectrum_index":46664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 106.0059 Da; putative annotation: N/A; putative formula: C6H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.049,"smiles":null,"spectrum_id":"CCMSLIB00017311744","spectrum_index":46665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 88.016 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.092,"smiles":null,"spectrum_id":"CCMSLIB00017311747","spectrum_index":46666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 35.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.108,"smiles":null,"spectrum_id":"CCMSLIB00017311749","spectrum_index":46667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 71.0372 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017311752","spectrum_index":46668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 27.9836 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.096,"smiles":null,"spectrum_id":"CCMSLIB00017311755","spectrum_index":46669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT106523 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole|2-(4-methyl-1,3-thiazol-5-yl)ethanol (delta mass: 31.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.111,"smiles":null,"spectrum_id":"CCMSLIB00017311758","spectrum_index":46670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Gln (delta mass: 111.0317 Da; putative annotation: DL-Pyroglutamic acid; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.156,"smiles":null,"spectrum_id":"CCMSLIB00017311759","spectrum_index":46671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 295.1193 Da; putative annotation: Feruloyltyramine; putative formula: C18H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.19,"smiles":null,"spectrum_id":"CCMSLIB00017311762","spectrum_index":46672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 103.0632 Da; putative annotation: Tris(hydroxymethyl)aminomethane; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.134,"smiles":null,"spectrum_id":"CCMSLIB00017311765","spectrum_index":46673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 184.0664 Da; putative annotation: 3-(2-Nitro-1-propenyl)indole; putative formula: C11H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.132,"smiles":null,"spectrum_id":"CCMSLIB00017311768","spectrum_index":46674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 242.0943 Da; putative annotation: Parishin C; putative formula: C15H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017311770","spectrum_index":46675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[(3,4,5-Trimethoxyphenyl)methyl]pyridin-2-amine (delta mass: 14.041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.18,"smiles":null,"spectrum_id":"CCMSLIB00017311772","spectrum_index":46676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 55.0504 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017311775","spectrum_index":46677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 55.9205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.97,"smiles":null,"spectrum_id":"CCMSLIB00017311778","spectrum_index":46678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Diethyl-1,3,4,9-tetrahydro-4-oxo-pyrano[3,4-b]indole-1-acetic acid methyl ester (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.17,"smiles":null,"spectrum_id":"CCMSLIB00017311780","spectrum_index":46679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 76.0676 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.138,"smiles":null,"spectrum_id":"CCMSLIB00017311784","spectrum_index":46680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 738.6634 Da; putative annotation: N/A; putative formula: C48H86N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":924.735,"smiles":null,"spectrum_id":"CCMSLIB00017311785","spectrum_index":46681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 340.1774 Da; putative annotation: N/A; putative formula: C14H25N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.274,"smiles":null,"spectrum_id":"CCMSLIB00017311788","spectrum_index":46682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 229.1316 Da; putative annotation: N/A; putative formula: C6H16N9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.223,"smiles":null,"spectrum_id":"CCMSLIB00017311791","spectrum_index":46683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 221.1625 Da; putative annotation: N/A; putative formula: C11H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.285,"smiles":null,"spectrum_id":"CCMSLIB00017311794","spectrum_index":46684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 40.0313 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.19,"smiles":null,"spectrum_id":"CCMSLIB00017311797","spectrum_index":46685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000511 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 31.0885 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.159,"smiles":null,"spectrum_id":"CCMSLIB00017311800","spectrum_index":46686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 207.1242 Da; putative annotation: N/A; putative formula: C8H13N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.221,"smiles":null,"spectrum_id":"CCMSLIB00017311803","spectrum_index":46687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 289.1024 Da; putative annotation: N/A; putative formula: C9H15N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.168,"smiles":null,"spectrum_id":"CCMSLIB00017311806","spectrum_index":46688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.181,"smiles":null,"spectrum_id":"CCMSLIB00017311808","spectrum_index":46689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 336.23 Da; putative annotation: N/A; putative formula: C20H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.326,"smiles":null,"spectrum_id":"CCMSLIB00017311811","spectrum_index":46690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.055,"smiles":null,"spectrum_id":"CCMSLIB00017311814","spectrum_index":46691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 2.991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.109,"smiles":null,"spectrum_id":"CCMSLIB00017311816","spectrum_index":46692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 417.1908 Da; putative annotation: N/A; putative formula: C22H31N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.277,"smiles":null,"spectrum_id":"CCMSLIB00017311819","spectrum_index":46693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Man3 a (delta mass: 107.0359 Da; putative annotation: N/A; putative formula: H6N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1018.37,"smiles":null,"spectrum_id":"CCMSLIB00017311822","spectrum_index":46694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4-(Difluoromethoxy)-3-methoxyphenyl]methanamine (delta mass: 249.2869 Da; putative annotation: N/A; putative formula: C18H35NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.37,"smiles":null,"spectrum_id":"CCMSLIB00017311824","spectrum_index":46695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 54.0075 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.13,"smiles":null,"spectrum_id":"CCMSLIB00017311827","spectrum_index":46696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 176.0319 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.118,"smiles":null,"spectrum_id":"CCMSLIB00017311830","spectrum_index":46697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4H-Pyrrolo[3,2-c]pyridin-4-one, 1,5,6,7-tetrahydro-2-[2-(3-quinolinyl)-4-pyridinyl]- (delta mass: 162.043 Da; putative annotation: N/A; putative formula: C8H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.183,"smiles":null,"spectrum_id":"CCMSLIB00017311833","spectrum_index":46698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 392.2712 Da; putative annotation: N/A; putative formula: C19H40N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.347,"smiles":null,"spectrum_id":"CCMSLIB00017311835","spectrum_index":46699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethoxy-1-propanol (delta mass: 26.9747 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.066,"smiles":null,"spectrum_id":"CCMSLIB00017311838","spectrum_index":46700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 60.0326 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.156,"smiles":null,"spectrum_id":"CCMSLIB00017311841","spectrum_index":46701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 44.0153 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.149,"smiles":null,"spectrum_id":"CCMSLIB00017311844","spectrum_index":46702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 131.0579 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.123,"smiles":null,"spectrum_id":"CCMSLIB00017311847","spectrum_index":46703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Methyl-1-piperazinyl)butanoic acid (delta mass: 79.0437 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.188,"smiles":null,"spectrum_id":"CCMSLIB00017311850","spectrum_index":46704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 564.3812 Da; putative annotation: N/A; putative formula: C36H52O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.452,"smiles":null,"spectrum_id":"CCMSLIB00017311852","spectrum_index":46705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 373.076 Da; putative annotation: N/A; putative formula: C16H24NOPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.162,"smiles":null,"spectrum_id":"CCMSLIB00017311855","spectrum_index":46706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 374.0273 Da; putative annotation: N/A; putative formula: C17H10O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.114,"smiles":null,"spectrum_id":"CCMSLIB00017311858","spectrum_index":46707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 775.2265 Da; putative annotation: N/A; putative formula: C56H29N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1144.34,"smiles":null,"spectrum_id":"CCMSLIB00017311861","spectrum_index":46708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 110.0366 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.102,"smiles":null,"spectrum_id":"CCMSLIB00017311863","spectrum_index":46709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-tert-Butyl-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 258.1591 Da; putative annotation: N/A; putative formula: C13H26N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.313,"smiles":null,"spectrum_id":"CCMSLIB00017311866","spectrum_index":46710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol - 30.0 eV (delta mass: 83.1095 Da; putative annotation: N/A; putative formula: C6H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.269,"smiles":null,"spectrum_id":"CCMSLIB00017311869","spectrum_index":46711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 131.0951 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.192,"smiles":null,"spectrum_id":"CCMSLIB00017311872","spectrum_index":46712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 103.0292 Da; putative annotation: N/A; putative formula: C2H6N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.07,"smiles":null,"spectrum_id":"CCMSLIB00017311875","spectrum_index":46713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 289.1146 Da; putative annotation: N/A; putative formula: C9H11N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.17,"smiles":null,"spectrum_id":"CCMSLIB00017311877","spectrum_index":46714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 51.9904 Da; putative annotation: N/A; putative formula: C3HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.077,"smiles":null,"spectrum_id":"CCMSLIB00017311880","spectrum_index":46715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 238.024 Da; putative annotation: N/A; putative formula: C10H2N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.1,"smiles":null,"spectrum_id":"CCMSLIB00017311883","spectrum_index":46716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 288.0725 Da; putative annotation: N/A; putative formula: C18H12N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.134,"smiles":null,"spectrum_id":"CCMSLIB00017311886","spectrum_index":46717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5S)-5-hydroxy-1,7-diphenylheptan-3-one (delta mass: 73.0249 Da; putative annotation: N/A; putative formula: CH3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.194,"smiles":null,"spectrum_id":"CCMSLIB00017311889","spectrum_index":46718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 28.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.173,"smiles":null,"spectrum_id":"CCMSLIB00017311891","spectrum_index":46719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 69.0195 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.1,"smiles":null,"spectrum_id":"CCMSLIB00017311894","spectrum_index":46720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 96.0602 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.35,"smiles":null,"spectrum_id":"CCMSLIB00017311897","spectrum_index":46721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 27.1037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.206,"smiles":null,"spectrum_id":"CCMSLIB00017311900","spectrum_index":46722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 138.0439 Da; putative annotation: N/A; putative formula: C6H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.146,"smiles":null,"spectrum_id":"CCMSLIB00017311902","spectrum_index":46723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 40.0311 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017311904","spectrum_index":46724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(?)-ampicillin - 30.0 eV (delta mass: 103.0267 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.144,"smiles":null,"spectrum_id":"CCMSLIB00017311907","spectrum_index":46725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 108.0145 Da; putative annotation: N/A; putative formula: C5H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.111,"smiles":null,"spectrum_id":"CCMSLIB00017311910","spectrum_index":46726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-Ile (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.233,"smiles":null,"spectrum_id":"CCMSLIB00017311913","spectrum_index":46727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 110.0516 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.127,"smiles":null,"spectrum_id":"CCMSLIB00017311915","spectrum_index":46728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 114.0877 Da; putative annotation: N/A; putative formula: C7H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.258,"smiles":null,"spectrum_id":"CCMSLIB00017311918","spectrum_index":46729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 77.0535 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.15,"smiles":null,"spectrum_id":"CCMSLIB00017311920","spectrum_index":46730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 54.0602 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.12,"smiles":null,"spectrum_id":"CCMSLIB00017311923","spectrum_index":46731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 53.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.237,"smiles":null,"spectrum_id":"CCMSLIB00017311926","spectrum_index":46732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 316.1944 Da; putative annotation: N/A; putative formula: C22H24N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.281,"smiles":null,"spectrum_id":"CCMSLIB00017311929","spectrum_index":46733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 103.0464 Da; putative annotation: N/A; putative formula: C4H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.144,"smiles":null,"spectrum_id":"CCMSLIB00017311931","spectrum_index":46734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 75.0528 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.087,"smiles":null,"spectrum_id":"CCMSLIB00017311934","spectrum_index":46735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 13.0317 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.16,"smiles":null,"spectrum_id":"CCMSLIB00017311937","spectrum_index":46736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 56.0264 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.092,"smiles":null,"spectrum_id":"CCMSLIB00017311939","spectrum_index":46737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 86.052 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.17,"smiles":null,"spectrum_id":"CCMSLIB00017311942","spectrum_index":46738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-[(4-methyl-1-piperazinyl)carbonyl]-1H-indole (delta mass: 45.9951 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.155,"smiles":null,"spectrum_id":"CCMSLIB00017311945","spectrum_index":46739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 30.0505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.11,"smiles":null,"spectrum_id":"CCMSLIB00017311948","spectrum_index":46740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1041.6448 Da; putative annotation: N/A; putative formula: C49H83N15O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1222.72,"smiles":null,"spectrum_id":"CCMSLIB00017311951","spectrum_index":46741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 187.1206 Da; putative annotation: N/A; putative formula: C9H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.191,"smiles":null,"spectrum_id":"CCMSLIB00017311953","spectrum_index":46742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 146.0724 Da; putative annotation: N/A; putative formula: C4H11N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.274,"smiles":null,"spectrum_id":"CCMSLIB00017311955","spectrum_index":46743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 447.2264 Da; putative annotation: N/A; putative formula: C25H37NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.302,"smiles":null,"spectrum_id":"CCMSLIB00017311958","spectrum_index":46744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00544 Cochlioquinone A (delta mass: 53.0481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.359,"smiles":null,"spectrum_id":"CCMSLIB00017311961","spectrum_index":46745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 173.9545 Da; putative annotation: N/A; putative formula: C5H3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.108,"smiles":null,"spectrum_id":"CCMSLIB00017311964","spectrum_index":46746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 134.0973 Da; putative annotation: N/A; putative formula: C7H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.157,"smiles":null,"spectrum_id":"CCMSLIB00017311966","spectrum_index":46747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 142.0358 Da; putative annotation: N/A; putative formula: CH2N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.122,"smiles":null,"spectrum_id":"CCMSLIB00017311968","spectrum_index":46748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.113,"smiles":null,"spectrum_id":"CCMSLIB00017311971","spectrum_index":46749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017311974","spectrum_index":46750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltopentaose from NIST14 (delta mass: 132.0528 Da; putative annotation: N/A; putative formula: C6H13O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":961.335,"smiles":null,"spectrum_id":"CCMSLIB00017311977","spectrum_index":46751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 420.2428 Da; putative annotation: N/A; putative formula: C24H37O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":793.407,"smiles":null,"spectrum_id":"CCMSLIB00017311980","spectrum_index":46752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 989.3437 Da; putative annotation: N/A; putative formula: C36H63NO30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1211.44,"smiles":null,"spectrum_id":"CCMSLIB00017311982","spectrum_index":46753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 17.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.223,"smiles":null,"spectrum_id":"CCMSLIB00017311984","spectrum_index":46754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxymorphinan (delta mass: 128.1742 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.344,"smiles":null,"spectrum_id":"CCMSLIB00017311987","spectrum_index":46755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 586.3875 Da; putative annotation: N/A; putative formula: C36H58O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.448,"smiles":null,"spectrum_id":"CCMSLIB00017311990","spectrum_index":46756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine methyl ester (delta mass: 140.1195 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.194,"smiles":null,"spectrum_id":"CCMSLIB00017311993","spectrum_index":46757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 130.027 Da; putative annotation: N/A; putative formula: C5H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.092,"smiles":null,"spectrum_id":"CCMSLIB00017311996","spectrum_index":46758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 52.0308 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.091,"smiles":null,"spectrum_id":"CCMSLIB00017311999","spectrum_index":46759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 142.0628 Da; putative annotation: N/A; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.181,"smiles":null,"spectrum_id":"CCMSLIB00017312000","spectrum_index":46760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 180.005 Da; putative annotation: N/A; putative formula: C2H5N4O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.091,"smiles":null,"spectrum_id":"CCMSLIB00017312003","spectrum_index":46761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 101.0268 Da; putative annotation: N/A; putative formula: C7H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.15,"smiles":null,"spectrum_id":"CCMSLIB00017312006","spectrum_index":46762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of galanthamine (delta mass: 150.055 Da; putative annotation: N/A; putative formula: C6H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.214,"smiles":null,"spectrum_id":"CCMSLIB00017312009","spectrum_index":46763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid; LC-tDDA; CE40 (delta mass: 787.4607 Da; putative annotation: N/A; putative formula: C39H57N13O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":899.5,"smiles":null,"spectrum_id":"CCMSLIB00017312012","spectrum_index":46764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 7.9686 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.076,"smiles":null,"spectrum_id":"CCMSLIB00017312014","spectrum_index":46765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 224.0325 Da; putative annotation: N/A; putative formula: C11H6F2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.124,"smiles":null,"spectrum_id":"CCMSLIB00017312016","spectrum_index":46766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydro-10-phenophosphazinol 10-oxide (delta mass: 238.9948 Da; putative annotation: N/A; putative formula: C13H6NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.047,"smiles":null,"spectrum_id":"CCMSLIB00017312019","spectrum_index":46767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(5-Chloro-2-methyl-1H-indol-3-yl)ethanamine (delta mass: 17.0342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.118,"smiles":null,"spectrum_id":"CCMSLIB00017312022","spectrum_index":46768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 102.0512 Da; putative annotation: N/A; putative formula: C5H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.226,"smiles":null,"spectrum_id":"CCMSLIB00017312024","spectrum_index":46769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 78.0102 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.134,"smiles":null,"spectrum_id":"CCMSLIB00017312027","spectrum_index":46770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 189.173 Da; putative annotation: N/A; putative formula: C6H19N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.275,"smiles":null,"spectrum_id":"CCMSLIB00017312031","spectrum_index":46771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diethylene glycol (delta mass: 56.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.112,"smiles":null,"spectrum_id":"CCMSLIB00017312034","spectrum_index":46772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Glucosamine CollisionEnergy:102040 (delta mass: 430.6999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.797,"smiles":null,"spectrum_id":"CCMSLIB00017312037","spectrum_index":46773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 35.0299 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.147,"smiles":null,"spectrum_id":"CCMSLIB00017312038","spectrum_index":46774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 50.0154 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017312041","spectrum_index":46775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrindole (delta mass: 199.1209 Da; putative annotation: N/A; putative formula: C10H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.323,"smiles":null,"spectrum_id":"CCMSLIB00017312044","spectrum_index":46776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 968.499 Da; putative annotation: N/A; putative formula: C63H64N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1149.57,"smiles":null,"spectrum_id":"CCMSLIB00017312047","spectrum_index":46777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 20.0 eV (delta mass: 737.7095 Da; putative annotation: N/A; putative formula: C47H95NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1047.82,"smiles":null,"spectrum_id":"CCMSLIB00017312050","spectrum_index":46778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 11.004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.075,"smiles":null,"spectrum_id":"CCMSLIB00017312052","spectrum_index":46779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 195.1267 Da; putative annotation: N/A; putative formula: C11H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.224,"smiles":null,"spectrum_id":"CCMSLIB00017312055","spectrum_index":46780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 197.0421 Da; putative annotation: N/A; putative formula: C9H12NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.113,"smiles":null,"spectrum_id":"CCMSLIB00017312058","spectrum_index":46781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 199.235 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.404,"smiles":null,"spectrum_id":"CCMSLIB00017312061","spectrum_index":46782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-.alpha.-Tocopherol (delta mass: 211.0687 Da; putative annotation: N/A; putative formula: C6H13NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.457,"smiles":null,"spectrum_id":"CCMSLIB00017312064","spectrum_index":46783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 99.052 Da; putative annotation: N/A; putative formula: C5H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.132,"smiles":null,"spectrum_id":"CCMSLIB00017312067","spectrum_index":46784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyr-Val (delta mass: 99.0694 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.219,"smiles":null,"spectrum_id":"CCMSLIB00017312069","spectrum_index":46785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C10:0 (delta mass: 56.0669 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.31,"smiles":null,"spectrum_id":"CCMSLIB00017312072","spectrum_index":46786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin E (delta mass: 56.0996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.29,"smiles":null,"spectrum_id":"CCMSLIB00017312075","spectrum_index":46787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 125.0446 Da; putative annotation: N/A; putative formula: C2H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.171,"smiles":null,"spectrum_id":"CCMSLIB00017312077","spectrum_index":46788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 74.0577 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.233,"smiles":null,"spectrum_id":"CCMSLIB00017312080","spectrum_index":46789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 246.1532 Da; putative annotation: N/A; putative formula: C10H24N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.307,"smiles":null,"spectrum_id":"CCMSLIB00017312083","spectrum_index":46790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Pro (delta mass: 71.0369 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.166,"smiles":null,"spectrum_id":"CCMSLIB00017312086","spectrum_index":46791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 270.1463 Da; putative annotation: N/A; putative formula: C14H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.269,"smiles":null,"spectrum_id":"CCMSLIB00017312089","spectrum_index":46792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Trp (delta mass: 99.0691 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.214,"smiles":null,"spectrum_id":"CCMSLIB00017312092","spectrum_index":46793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 301.167 Da; putative annotation: N/A; putative formula: C12H24N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.247,"smiles":null,"spectrum_id":"CCMSLIB00017312095","spectrum_index":46794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 242.1301 Da; putative annotation: N/A; putative formula: C10H19N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.168,"smiles":null,"spectrum_id":"CCMSLIB00017312098","spectrum_index":46795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of colchicine (delta mass: 75.0896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.265,"smiles":null,"spectrum_id":"CCMSLIB00017312102","spectrum_index":46796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 69.0556 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.137,"smiles":null,"spectrum_id":"CCMSLIB00017312104","spectrum_index":46797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 336.0356 Da; putative annotation: N/A; putative formula: C21H8N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.195,"smiles":null,"spectrum_id":"CCMSLIB00017312107","spectrum_index":46798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 125.0369 Da; putative annotation: N/A; putative formula: C8H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.144,"smiles":null,"spectrum_id":"CCMSLIB00017312110","spectrum_index":46799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 64.0414 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.133,"smiles":null,"spectrum_id":"CCMSLIB00017312113","spectrum_index":46800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 28.0012 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017312116","spectrum_index":46801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 136.1259 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.165,"smiles":null,"spectrum_id":"CCMSLIB00017312119","spectrum_index":46802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 88.0679 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.295,"smiles":null,"spectrum_id":"CCMSLIB00017312122","spectrum_index":46803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 138.1027 Da; putative annotation: N/A; putative formula: C5H10N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.23,"smiles":null,"spectrum_id":"CCMSLIB00017312125","spectrum_index":46804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 303.1489 Da; putative annotation: N/A; putative formula: C18H17N5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.236,"smiles":null,"spectrum_id":"CCMSLIB00017312127","spectrum_index":46805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 644.2783 Da; putative annotation: N/A; putative formula: C34H40N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":807.338,"smiles":null,"spectrum_id":"CCMSLIB00017312130","spectrum_index":46806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 960.575 Da; putative annotation: N/A; putative formula: C60H80O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1182.67,"smiles":null,"spectrum_id":"CCMSLIB00017312133","spectrum_index":46807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 129.0425 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.113,"smiles":null,"spectrum_id":"CCMSLIB00017312136","spectrum_index":46808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 71.037 Da; putative annotation: D-ALANINE; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.108,"smiles":null,"spectrum_id":"CCMSLIB00017312139","spectrum_index":46809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 113.084 Da; putative annotation: L-(+)-Leucine - 40.0 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.213,"smiles":null,"spectrum_id":"CCMSLIB00017312142","spectrum_index":46810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 120.0579 Da; putative annotation: R-(-)-Phenyl-1,2-ethanediol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.155,"smiles":null,"spectrum_id":"CCMSLIB00017312145","spectrum_index":46811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 262.2284 Da; putative annotation: Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.304,"smiles":null,"spectrum_id":"CCMSLIB00017312148","spectrum_index":46812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 371.2826 Da; putative annotation: Phe-C15:0; putative formula: C24H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.379,"smiles":null,"spectrum_id":"CCMSLIB00017312150","spectrum_index":46813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 69.0576 Da; putative annotation: Morpholine; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.128,"smiles":null,"spectrum_id":"CCMSLIB00017312152","spectrum_index":46814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380917-01!5,7-dihydroxy-2-(2-methylpropyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 396.1396 Da; putative annotation: Benzyl 6-O-(4-carboxy-3-hydroxy-3-methylbutanoyl)-.beta.-D-glucopyranoside; putative formula: C19H24O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":793.289,"smiles":null,"spectrum_id":"CCMSLIB00017312155","spectrum_index":46815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 302.2245 Da; putative annotation: 5-[(Z)-5-Hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid; putative formula: C20H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.295,"smiles":null,"spectrum_id":"CCMSLIB00017312158","spectrum_index":46816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 112.2076 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.289,"smiles":null,"spectrum_id":"CCMSLIB00017312161","spectrum_index":46817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Benzyl-1H-indol-5-ylamine (delta mass: 58.0254 Da; putative annotation: N/A; putative formula: C3H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.148,"smiles":null,"spectrum_id":"CCMSLIB00017312164","spectrum_index":46818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 339.2055 Da; putative annotation: N/A; putative formula: C19H33NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.375,"smiles":null,"spectrum_id":"CCMSLIB00017312167","spectrum_index":46819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 146.0944 Da; putative annotation: N/A; putative formula: C7H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.207,"smiles":null,"spectrum_id":"CCMSLIB00017312169","spectrum_index":46820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 152.0837 Da; putative annotation: N/A; putative formula: C9H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.134,"smiles":null,"spectrum_id":"CCMSLIB00017312171","spectrum_index":46821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 125.9618 Da; putative annotation: N/A; putative formula: C3H-1N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.116,"smiles":null,"spectrum_id":"CCMSLIB00017312174","spectrum_index":46822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 17.009 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.122,"smiles":null,"spectrum_id":"CCMSLIB00017312177","spectrum_index":46823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3R)-2-(((S)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(5-chloropyridin-2-yl)-3-methylpentanamide (delta mass: 56.2126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.46,"smiles":null,"spectrum_id":"CCMSLIB00017312180","spectrum_index":46824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-.beta.-D-ribofuranosyl-1H-imidazole-4-carboxamide (delta mass: 180.0559 Da; putative annotation: N/A; putative formula: C7H9N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.16,"smiles":null,"spectrum_id":"CCMSLIB00017312183","spectrum_index":46825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 74.0375 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.16,"smiles":null,"spectrum_id":"CCMSLIB00017312185","spectrum_index":46826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 74.0794 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.181,"smiles":null,"spectrum_id":"CCMSLIB00017312188","spectrum_index":46827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Monoacetylmorphine (delta mass: 154.0742 Da; putative annotation: N/A; putative formula: C7H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.228,"smiles":null,"spectrum_id":"CCMSLIB00017312191","spectrum_index":46828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 163.1568 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.269,"smiles":null,"spectrum_id":"CCMSLIB00017312194","spectrum_index":46829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 92.0626 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.211,"smiles":null,"spectrum_id":"CCMSLIB00017312197","spectrum_index":46830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 108.0923 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.298,"smiles":null,"spectrum_id":"CCMSLIB00017312200","spectrum_index":46831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 56.0268 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.186,"smiles":null,"spectrum_id":"CCMSLIB00017312203","spectrum_index":46832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 36.1797 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.245,"smiles":null,"spectrum_id":"CCMSLIB00017312206","spectrum_index":46833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 165.9454 Da; putative annotation: N/A; putative formula: C7H3O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.005,"smiles":null,"spectrum_id":"CCMSLIB00017312208","spectrum_index":46834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE (delta mass: 76.0637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.155,"smiles":null,"spectrum_id":"CCMSLIB00017312211","spectrum_index":46835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 71.0369 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.145,"smiles":null,"spectrum_id":"CCMSLIB00017312214","spectrum_index":46836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 264.6718 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.758,"smiles":null,"spectrum_id":"CCMSLIB00017312217","spectrum_index":46837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 756.404 Da; putative annotation: N/A; putative formula: C50H52N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1087.56,"smiles":null,"spectrum_id":"CCMSLIB00017312220","spectrum_index":46838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 165.1729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.264,"smiles":null,"spectrum_id":"CCMSLIB00017312223","spectrum_index":46839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 79.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.197,"smiles":null,"spectrum_id":"CCMSLIB00017312226","spectrum_index":46840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 45.1698 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.345,"smiles":null,"spectrum_id":"CCMSLIB00017312228","spectrum_index":46841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 192.1881 Da; putative annotation: N/A; putative formula: C14H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.285,"smiles":null,"spectrum_id":"CCMSLIB00017312231","spectrum_index":46842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 165.0789 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.149,"smiles":null,"spectrum_id":"CCMSLIB00017312234","spectrum_index":46843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 384.3364 Da; putative annotation: N/A; putative formula: C23H40N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.433,"smiles":null,"spectrum_id":"CCMSLIB00017312237","spectrum_index":46844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 475.3102 Da; putative annotation: N/A; putative formula: C32H37N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.386,"smiles":null,"spectrum_id":"CCMSLIB00017312239","spectrum_index":46845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 282.0931 Da; putative annotation: N/A; putative formula: C15H22O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.19,"smiles":null,"spectrum_id":"CCMSLIB00017312242","spectrum_index":46846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 126.122 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.181,"smiles":null,"spectrum_id":"CCMSLIB00017312245","spectrum_index":46847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7,8-Trimethyl-2-(.beta.-carboxyethyl)-6-hydroxychroman (delta mass: 178.0762 Da; putative annotation: N/A; putative formula: C7H15O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.22,"smiles":null,"spectrum_id":"CCMSLIB00017312247","spectrum_index":46848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 26.9953 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.086,"smiles":null,"spectrum_id":"CCMSLIB00017312251","spectrum_index":46849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 326.1212 Da; putative annotation: N/A; putative formula: C12H22O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.229,"smiles":null,"spectrum_id":"CCMSLIB00017312254","spectrum_index":46850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one [IIN-based: Match] (delta mass: 244.0019 Da; putative annotation: N/A; putative formula: C13H8OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.104,"smiles":null,"spectrum_id":"CCMSLIB00017312257","spectrum_index":46851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 103.0633 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.09,"smiles":null,"spectrum_id":"CCMSLIB00017312260","spectrum_index":46852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 113.0483 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.135,"smiles":null,"spectrum_id":"CCMSLIB00017312263","spectrum_index":46853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 50.0488 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.13,"smiles":null,"spectrum_id":"CCMSLIB00017312266","spectrum_index":46854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-tetrahydro-6-methoxy-1-oxo-beta-carboline (delta mass: 67.0181 Da; putative annotation: N/A; putative formula: C2HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.115,"smiles":null,"spectrum_id":"CCMSLIB00017312271","spectrum_index":46855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S)-4-Amino-2-hydroxybutanoic acid (delta mass: 222.2029 Da; putative annotation: N/A; putative formula: C15H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.268,"smiles":null,"spectrum_id":"CCMSLIB00017312273","spectrum_index":46856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxyphenethylamine (delta mass: 11.0043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.096,"smiles":null,"spectrum_id":"CCMSLIB00017312276","spectrum_index":46857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 133.0525 Da; putative annotation: N/A; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.123,"smiles":null,"spectrum_id":"CCMSLIB00017312279","spectrum_index":46858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 291.6375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.698,"smiles":null,"spectrum_id":"CCMSLIB00017312282","spectrum_index":46859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 526.1481 Da; putative annotation: N/A; putative formula: C19H32N2O11P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1499.47,"smiles":null,"spectrum_id":"CCMSLIB00017312285","spectrum_index":46860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 746.2641 Da; putative annotation: N/A; putative formula: C30H50N6O8P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1251.44,"smiles":null,"spectrum_id":"CCMSLIB00017312288","spectrum_index":46861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 115.0267 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.155,"smiles":null,"spectrum_id":"CCMSLIB00017312291","spectrum_index":46862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 250.0408 Da; putative annotation: N/A; putative formula: C14H6N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.127,"smiles":null,"spectrum_id":"CCMSLIB00017312293","spectrum_index":46863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 97.8271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.909,"smiles":null,"spectrum_id":"CCMSLIB00017312295","spectrum_index":46864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 22.077 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.242,"smiles":null,"spectrum_id":"CCMSLIB00017312298","spectrum_index":46865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 126.0313 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.118,"smiles":null,"spectrum_id":"CCMSLIB00017312301","spectrum_index":46866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 51.0102 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.086,"smiles":null,"spectrum_id":"CCMSLIB00017312304","spectrum_index":46867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 62.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.097,"smiles":null,"spectrum_id":"CCMSLIB00017312306","spectrum_index":46868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 163.0628 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.085,"smiles":null,"spectrum_id":"CCMSLIB00017312308","spectrum_index":46869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (1S,15S,17S)-17-[(1S)-1-hydroxyethyl]-3,13-diazapentacyclo[13.3.1.0,?.0?,?.0,?]nonadeca-2(10),4,6,8-tetraene-1-carboxylate (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.212,"smiles":null,"spectrum_id":"CCMSLIB00017312311","spectrum_index":46870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.103,"smiles":null,"spectrum_id":"CCMSLIB00017312314","spectrum_index":46871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 50.0572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.217,"smiles":null,"spectrum_id":"CCMSLIB00017312317","spectrum_index":46872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 15.0111 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.175,"smiles":null,"spectrum_id":"CCMSLIB00017312320","spectrum_index":46873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of glucitol-4-gucopyanoside (delta mass: 40.0446 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.184,"smiles":null,"spectrum_id":"CCMSLIB00017312323","spectrum_index":46874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 322.2214 Da; putative annotation: N/A; putative formula: C23H31O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.318,"smiles":null,"spectrum_id":"CCMSLIB00017312325","spectrum_index":46875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 68.0408 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.106,"smiles":null,"spectrum_id":"CCMSLIB00017312327","spectrum_index":46876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 36.9971 Da; putative annotation: N/A; putative formula: C2H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.073,"smiles":null,"spectrum_id":"CCMSLIB00017312330","spectrum_index":46877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 77.0261 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.123,"smiles":null,"spectrum_id":"CCMSLIB00017312333","spectrum_index":46878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 65.0377 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.119,"smiles":null,"spectrum_id":"CCMSLIB00017312336","spectrum_index":46879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norboldine (delta mass: 460.2377 Da; putative annotation: N/A; putative formula: C26H37O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.376,"smiles":null,"spectrum_id":"CCMSLIB00017312337","spectrum_index":46880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 26.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.112,"smiles":null,"spectrum_id":"CCMSLIB00017312340","spectrum_index":46881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 106.0594 Da; putative annotation: N/A; putative formula: H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.186,"smiles":null,"spectrum_id":"CCMSLIB00017312343","spectrum_index":46882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthoxyacetic acid (delta mass: 46.005 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.075,"smiles":null,"spectrum_id":"CCMSLIB00017312346","spectrum_index":46883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine 5'-diphosphate (delta mass: 247.9466 Da; putative annotation: N/A; putative formula: C7H6O4P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.983,"smiles":null,"spectrum_id":"CCMSLIB00017312349","spectrum_index":46884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 24.9993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.201,"smiles":null,"spectrum_id":"CCMSLIB00017312350","spectrum_index":46885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-5,6-dihydroxy-6-methyl-7-oxocyclopenta[c]pyridine-5-carboxylate (delta mass: 45.0814 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.262,"smiles":null,"spectrum_id":"CCMSLIB00017312353","spectrum_index":46886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 151.1296 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.206,"smiles":null,"spectrum_id":"CCMSLIB00017312356","spectrum_index":46887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ketogluconic acid methyl ester (delta mass: 179.095 Da; putative annotation: N/A; putative formula: C10H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.161,"smiles":null,"spectrum_id":"CCMSLIB00017312359","spectrum_index":46888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatin (delta mass: 74.0006 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.087,"smiles":null,"spectrum_id":"CCMSLIB00017312362","spectrum_index":46889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 273.1063 Da; putative annotation: N/A; putative formula: C11H20N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.166,"smiles":null,"spectrum_id":"CCMSLIB00017312363","spectrum_index":46890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 823.4394 Da; putative annotation: N/A; putative formula: C45H53N13O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1004.51,"smiles":null,"spectrum_id":"CCMSLIB00017312366","spectrum_index":46891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 313.2259 Da; putative annotation: N/A; putative formula: C18H35NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.323,"smiles":null,"spectrum_id":"CCMSLIB00017312369","spectrum_index":46892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 28.0746 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.187,"smiles":null,"spectrum_id":"CCMSLIB00017312372","spectrum_index":46893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 107.0748 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.109,"smiles":null,"spectrum_id":"CCMSLIB00017312374","spectrum_index":46894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 95.0737 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.144,"smiles":null,"spectrum_id":"CCMSLIB00017312376","spectrum_index":46895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 397.1912 Da; putative annotation: N/A; putative formula: C22H28N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.345,"smiles":null,"spectrum_id":"CCMSLIB00017312379","spectrum_index":46896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 198.1265 Da; putative annotation: N/A; putative formula: C12H14N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.218,"smiles":null,"spectrum_id":"CCMSLIB00017312382","spectrum_index":46897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-RIBOSE 5-PHOSPHATE (delta mass: 42.0013 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.028,"smiles":null,"spectrum_id":"CCMSLIB00017312385","spectrum_index":46898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 130.003 Da; putative annotation: N/A; putative formula: C4H6N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.083,"smiles":null,"spectrum_id":"CCMSLIB00017312387","spectrum_index":46899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.133,"smiles":null,"spectrum_id":"CCMSLIB00017312389","spectrum_index":46900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 465.2726 Da; putative annotation: N/A; putative formula: C20H44N5OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.353,"smiles":null,"spectrum_id":"CCMSLIB00017312392","spectrum_index":46901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 92.0273 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.151,"smiles":null,"spectrum_id":"CCMSLIB00017312395","spectrum_index":46902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 78.066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.152,"smiles":null,"spectrum_id":"CCMSLIB00017312398","spectrum_index":46903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 50.9394 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.057,"smiles":null,"spectrum_id":"CCMSLIB00017312401","spectrum_index":46904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 53.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017312403","spectrum_index":46905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 81.1038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.185,"smiles":null,"spectrum_id":"CCMSLIB00017312406","spectrum_index":46906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 28.0319 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.14,"smiles":null,"spectrum_id":"CCMSLIB00017312409","spectrum_index":46907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 18.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.091,"smiles":null,"spectrum_id":"CCMSLIB00017312411","spectrum_index":46908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 278.2295 Da; putative annotation: N/A; putative formula: C17H31N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.311,"smiles":null,"spectrum_id":"CCMSLIB00017312414","spectrum_index":46909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 157.0374 Da; putative annotation: N/A; putative formula: C6H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.124,"smiles":null,"spectrum_id":"CCMSLIB00017312417","spectrum_index":46910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORADRENALINE (delta mass: 61.089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.17,"smiles":null,"spectrum_id":"CCMSLIB00017312420","spectrum_index":46911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 66.0832 Da; putative annotation: N/A; putative formula: C6H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017312421","spectrum_index":46912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 159.0896 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.186,"smiles":null,"spectrum_id":"CCMSLIB00017312424","spectrum_index":46913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 156.0409 Da; putative annotation: N/A; putative formula: C11H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.112,"smiles":null,"spectrum_id":"CCMSLIB00017312427","spectrum_index":46914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 66.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.085,"smiles":null,"spectrum_id":"CCMSLIB00017312430","spectrum_index":46915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 358.1919 Da; putative annotation: N/A; putative formula: C19H27N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.29,"smiles":null,"spectrum_id":"CCMSLIB00017312432","spectrum_index":46916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 165.0869 Da; putative annotation: N/A; putative formula: C4H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.184,"smiles":null,"spectrum_id":"CCMSLIB00017312434","spectrum_index":46917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(6,7-diethoxy(1,2,3,4-tetrahydroisoquinolyl))-6-methoxyphenol CollisionEnergy:102040\"\" (delta mass: 18.0835 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.269,"smiles":null,"spectrum_id":"CCMSLIB00017312437","spectrum_index":46918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 377.7506 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.811,"smiles":null,"spectrum_id":"CCMSLIB00017312440","spectrum_index":46919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carboxylic acid, ethyl ester (delta mass: 17.0509 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.137,"smiles":null,"spectrum_id":"CCMSLIB00017312443","spectrum_index":46920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET020002 CLE_291.1026_12.2|Clensiopenterol|1-(4-amino-3,5-dichlorophenyl)-2-(3-methylbutylamino)ethanol (delta mass: 42.0132 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.116,"smiles":null,"spectrum_id":"CCMSLIB00017312445","spectrum_index":46921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-7-methoxy-9H-pyrido[3,4-b]indol-8-yl)-2-methyl- (delta mass: 143.0948 Da; putative annotation: N/A; putative formula: C7H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.19,"smiles":null,"spectrum_id":"CCMSLIB00017312447","spectrum_index":46922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 12.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.108,"smiles":null,"spectrum_id":"CCMSLIB00017312450","spectrum_index":46923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 661.9543 Da; putative annotation: N/A; putative formula: C19H14N6O13S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":884.052,"smiles":null,"spectrum_id":"CCMSLIB00017312453","spectrum_index":46924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1,N1-dimethyl-N2-phenyl-1,2-ethanediamine (delta mass: 37.9402 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.079,"smiles":null,"spectrum_id":"CCMSLIB00017312455","spectrum_index":46925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 102.0104 Da; putative annotation: N/A; putative formula: C7H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.081,"smiles":null,"spectrum_id":"CCMSLIB00017312457","spectrum_index":46926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N2-Formyl Lysine (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.145,"smiles":null,"spectrum_id":"CCMSLIB00017312460","spectrum_index":46927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 274.1604 Da; putative annotation: N/A; putative formula: C14H26O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.283,"smiles":null,"spectrum_id":"CCMSLIB00017312463","spectrum_index":46928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(5-Chloro-2-methyl-1H-indol-3-yl)ethanamine (delta mass: 126.0504 Da; putative annotation: N/A; putative formula: C7H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.134,"smiles":null,"spectrum_id":"CCMSLIB00017312466","spectrum_index":46929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 116.0628 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.16,"smiles":null,"spectrum_id":"CCMSLIB00017312469","spectrum_index":46930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 651.1433 Da; putative annotation: N/A; putative formula: C34H29N5O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.219,"smiles":null,"spectrum_id":"CCMSLIB00017312470","spectrum_index":46931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 152.0682 Da; putative annotation: N/A; putative formula: C2H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.149,"smiles":null,"spectrum_id":"CCMSLIB00017312473","spectrum_index":46932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 43.0787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.191,"smiles":null,"spectrum_id":"CCMSLIB00017312476","spectrum_index":46933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 698.5622 Da; putative annotation: N/A; putative formula: C36H76N8OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":858.638,"smiles":null,"spectrum_id":"CCMSLIB00017312479","spectrum_index":46934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 197.0885 Da; putative annotation: N/A; putative formula: C3H7N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.258,"smiles":null,"spectrum_id":"CCMSLIB00017312481","spectrum_index":46935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 205.1684 Da; putative annotation: N/A; putative formula: C11H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.271,"smiles":null,"spectrum_id":"CCMSLIB00017312483","spectrum_index":46936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00417 Camptothecin (delta mass: 155.9983 Da; putative annotation: N/A; putative formula: C7HN4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.117,"smiles":null,"spectrum_id":"CCMSLIB00017312486","spectrum_index":46937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 176.0622 Da; putative annotation: N/A; putative formula: C6H12N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.191,"smiles":null,"spectrum_id":"CCMSLIB00017312489","spectrum_index":46938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 211.1517 Da; putative annotation: N/A; putative formula: C11H21N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017312492","spectrum_index":46939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.alpha.-L-fucopyranosyl)-D-glucopyranose (delta mass: 1128.6514 Da; putative annotation: N/A; putative formula: C50H84N18O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1496.81,"smiles":null,"spectrum_id":"CCMSLIB00017312494","spectrum_index":46940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 299.9266 Da; putative annotation: N/A; putative formula: C8H4N4OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.18,"smiles":null,"spectrum_id":"CCMSLIB00017312496","spectrum_index":46941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 174.0642 Da; putative annotation: N/A; putative formula: C6H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.14,"smiles":null,"spectrum_id":"CCMSLIB00017312499","spectrum_index":46942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 116.9345 Da; putative annotation: N/A; putative formula: C2H-1NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.036,"smiles":null,"spectrum_id":"CCMSLIB00017312502","spectrum_index":46943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 18.0015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.193,"smiles":null,"spectrum_id":"CCMSLIB00017312505","spectrum_index":46944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 32.999 Da; putative annotation: N/A; putative formula: C3H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017312508","spectrum_index":46945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 14.0193 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.117,"smiles":null,"spectrum_id":"CCMSLIB00017312511","spectrum_index":46946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 111.0898 Da; putative annotation: N/A; putative formula: C4H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.202,"smiles":null,"spectrum_id":"CCMSLIB00017312512","spectrum_index":46947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 123.054 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.134,"smiles":null,"spectrum_id":"CCMSLIB00017312515","spectrum_index":46948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 223.1086 Da; putative annotation: N/A; putative formula: C7H18N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.31,"smiles":null,"spectrum_id":"CCMSLIB00017312518","spectrum_index":46949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paxilline (delta mass: 112.0421 Da; putative annotation: N/A; putative formula: C8H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.29,"smiles":null,"spectrum_id":"CCMSLIB00017312521","spectrum_index":46950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hydroquinidine (delta mass: 10.0933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.3,"smiles":null,"spectrum_id":"CCMSLIB00017312524","spectrum_index":46951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 111.0448 Da; putative annotation: N/A; putative formula: C4H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.125,"smiles":null,"spectrum_id":"CCMSLIB00017312525","spectrum_index":46952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 84.0505 Da; putative annotation: N/A; putative formula: C5H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.189,"smiles":null,"spectrum_id":"CCMSLIB00017312528","spectrum_index":46953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 36.0625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.138,"smiles":null,"spectrum_id":"CCMSLIB00017312531","spectrum_index":46954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 144.067 Da; putative annotation: N/A; putative formula: C9H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.148,"smiles":null,"spectrum_id":"CCMSLIB00017312534","spectrum_index":46955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 229.1662 Da; putative annotation: N/A; putative formula: C8H19N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.221,"smiles":null,"spectrum_id":"CCMSLIB00017312536","spectrum_index":46956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 170.0692 Da; putative annotation: N-Acetyl-L-glutamine; putative formula: C7H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.203,"smiles":null,"spectrum_id":"CCMSLIB00017312538","spectrum_index":46957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 112.0522 Da; putative annotation: 4-Oxohexanoic acid; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.143,"smiles":null,"spectrum_id":"CCMSLIB00017312541","spectrum_index":46958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 161.0662 Da; putative annotation: 2-Amino-2-deoxy-D-glucopyranose; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.19,"smiles":null,"spectrum_id":"CCMSLIB00017312544","spectrum_index":46959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 251.1019 Da; putative annotation: His-Asn; putative formula: C10H13N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.199,"smiles":null,"spectrum_id":"CCMSLIB00017312547","spectrum_index":46960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 256.1783 Da; putative annotation: 17.alpha.-Nandrolone; putative formula: C18H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.353,"smiles":null,"spectrum_id":"CCMSLIB00017312550","spectrum_index":46961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 127.0873 Da; putative annotation: N/A; putative formula: C4H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.163,"smiles":null,"spectrum_id":"CCMSLIB00017312552","spectrum_index":46962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 153.0221 Da; putative annotation: N/A; putative formula: C3H3N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.087,"smiles":null,"spectrum_id":"CCMSLIB00017312554","spectrum_index":46963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 411.1742 Da; putative annotation: N/A; putative formula: C16H29NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.255,"smiles":null,"spectrum_id":"CCMSLIB00017312557","spectrum_index":46964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 60.0274 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.104,"smiles":null,"spectrum_id":"CCMSLIB00017312560","spectrum_index":46965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Pro (delta mass: 210.1259 Da; putative annotation: N/A; putative formula: C12H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.292,"smiles":null,"spectrum_id":"CCMSLIB00017312563","spectrum_index":46966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dulcitol (delta mass: 573.3844 Da; putative annotation: N/A; putative formula: C26H51N7O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.471,"smiles":null,"spectrum_id":"CCMSLIB00017312565","spectrum_index":46967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 291.0956 Da; putative annotation: N/A; putative formula: C11H17NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.219,"smiles":null,"spectrum_id":"CCMSLIB00017312568","spectrum_index":46968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Formyl-L-tryptophan (delta mass: 42.0217 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.114,"smiles":null,"spectrum_id":"CCMSLIB00017312570","spectrum_index":46969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 104.0948 Da; putative annotation: N/A; putative formula: H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.16,"smiles":null,"spectrum_id":"CCMSLIB00017312573","spectrum_index":46970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 411.1378 Da; putative annotation: N/A; putative formula: C21H17N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.203,"smiles":null,"spectrum_id":"CCMSLIB00017312576","spectrum_index":46971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 781.3902 Da; putative annotation: N/A; putative formula: C40H55N5O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":988.477,"smiles":null,"spectrum_id":"CCMSLIB00017312579","spectrum_index":46972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylecgonine (delta mass: 55.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.196,"smiles":null,"spectrum_id":"CCMSLIB00017312582","spectrum_index":46973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 212.142 Da; putative annotation: N/A; putative formula: C13H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.233,"smiles":null,"spectrum_id":"CCMSLIB00017312584","spectrum_index":46974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 84.0215 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.134,"smiles":null,"spectrum_id":"CCMSLIB00017312586","spectrum_index":46975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 115.0634 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.161,"smiles":null,"spectrum_id":"CCMSLIB00017312589","spectrum_index":46976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 80.0736 Da; putative annotation: N/A; putative formula: C5H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.16,"smiles":null,"spectrum_id":"CCMSLIB00017312592","spectrum_index":46977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 77.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.098,"smiles":null,"spectrum_id":"CCMSLIB00017312595","spectrum_index":46978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 146.0692 Da; putative annotation: N/A; putative formula: C5H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.14,"smiles":null,"spectrum_id":"CCMSLIB00017312597","spectrum_index":46979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 50.0523 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.195,"smiles":null,"spectrum_id":"CCMSLIB00017312599","spectrum_index":46980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nonen-1-ol, (Z)- (delta mass: 66.0477 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.191,"smiles":null,"spectrum_id":"CCMSLIB00017312602","spectrum_index":46981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.108,"smiles":null,"spectrum_id":"CCMSLIB00017312605","spectrum_index":46982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 119.1309 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.3,"smiles":null,"spectrum_id":"CCMSLIB00017312608","spectrum_index":46983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 113.1815 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.263,"smiles":null,"spectrum_id":"CCMSLIB00017312611","spectrum_index":46984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 60.968 Da; putative annotation: N/A; putative formula: NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.117,"smiles":null,"spectrum_id":"CCMSLIB00017312613","spectrum_index":46985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ADENOSINE 3',5'-DIPHOSPHATE - 20.0 eV (delta mass: 257.0511 Da; putative annotation: N/A; putative formula: C14H11NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.088,"smiles":null,"spectrum_id":"CCMSLIB00017312616","spectrum_index":46986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 369.2043 Da; putative annotation: N/A; putative formula: C21H27N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.27,"smiles":null,"spectrum_id":"CCMSLIB00017312618","spectrum_index":46987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 141.0468 Da; putative annotation: N/A; putative formula: C4H7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.149,"smiles":null,"spectrum_id":"CCMSLIB00017312621","spectrum_index":46988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 198.1667 Da; putative annotation: N/A; putative formula: C11H23N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.232,"smiles":null,"spectrum_id":"CCMSLIB00017312624","spectrum_index":46989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 50.0 eV (delta mass: 90.0795 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.181,"smiles":null,"spectrum_id":"CCMSLIB00017312627","spectrum_index":46990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 70.0415 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.17,"smiles":null,"spectrum_id":"CCMSLIB00017312630","spectrum_index":46991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 340.179 Da; putative annotation: N/A; putative formula: C20H24N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.234,"smiles":null,"spectrum_id":"CCMSLIB00017312631","spectrum_index":46992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 256.3153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.474,"smiles":null,"spectrum_id":"CCMSLIB00017312634","spectrum_index":46993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 581.5562 Da; putative annotation: N/A; putative formula: C37H75NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.627,"smiles":null,"spectrum_id":"CCMSLIB00017312637","spectrum_index":46994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-7-carboxylic acid (delta mass: 103.0647 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.128,"smiles":null,"spectrum_id":"CCMSLIB00017312640","spectrum_index":46995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 273.1204 Da; putative annotation: N/A; putative formula: C16H21NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.191,"smiles":null,"spectrum_id":"CCMSLIB00017312643","spectrum_index":46996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Lys (delta mass: 100.0168 Da; putative annotation: N/A; putative formula: C5N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.198,"smiles":null,"spectrum_id":"CCMSLIB00017312645","spectrum_index":46997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 40.9137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017312647","spectrum_index":46998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(9-Oxodecyl)acetamide (delta mass: 60.0031 Da; putative annotation: N/A; putative formula: C2H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.183,"smiles":null,"spectrum_id":"CCMSLIB00017312650","spectrum_index":46999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA017003 Sotalol|N-[4-[1-hydroxy-2-(isopropylamino)ethyl]phenyl]methanesulfonamide (delta mass: 92.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.171,"smiles":null,"spectrum_id":"CCMSLIB00017312653","spectrum_index":47000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 106.0574 Da; putative annotation: N/A; putative formula: H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.197,"smiles":null,"spectrum_id":"CCMSLIB00017312656","spectrum_index":47001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)benzamide (delta mass: 46.0047 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.138,"smiles":null,"spectrum_id":"CCMSLIB00017312659","spectrum_index":47002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 554.3624 Da; putative annotation: N/A; putative formula: C35H46N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":849.465,"smiles":null,"spectrum_id":"CCMSLIB00017312660","spectrum_index":47003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385352-01!7-methoxy-9,10-dihydrophenanthrene-2,5-diol (delta mass: 72.0599 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.161,"smiles":null,"spectrum_id":"CCMSLIB00017312663","spectrum_index":47004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 73.0629 Da; putative annotation: N/A; putative formula: C2H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.123,"smiles":null,"spectrum_id":"CCMSLIB00017312666","spectrum_index":47005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Dichlorotyrosine (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.998,"smiles":null,"spectrum_id":"CCMSLIB00017312669","spectrum_index":47006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 50.0251 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.159,"smiles":null,"spectrum_id":"CCMSLIB00017312671","spectrum_index":47007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU228201 10,11-Dihydro-10-Hydroxycarbazepine|Licarbazepine|5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 461.1372 Da; putative annotation: N/A; putative formula: C20H23N5O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.25,"smiles":null,"spectrum_id":"CCMSLIB00017312673","spectrum_index":47008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 116.1311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.28,"smiles":null,"spectrum_id":"CCMSLIB00017312676","spectrum_index":47009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 27.9956 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.238,"smiles":null,"spectrum_id":"CCMSLIB00017312679","spectrum_index":47010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (delta mass: 162.0498 Da; putative annotation: N/A; putative formula: C2H6N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.194,"smiles":null,"spectrum_id":"CCMSLIB00017312682","spectrum_index":47011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 35.0467 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.133,"smiles":null,"spectrum_id":"CCMSLIB00017312684","spectrum_index":47012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 48.0299 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.32,"smiles":null,"spectrum_id":"CCMSLIB00017312686","spectrum_index":47013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 83.0336 Da; putative annotation: N/A; putative formula: HN7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.125,"smiles":null,"spectrum_id":"CCMSLIB00017312689","spectrum_index":47014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 576.5252 Da; putative annotation: N/A; putative formula: C37H64N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.597,"smiles":null,"spectrum_id":"CCMSLIB00017312692","spectrum_index":47015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-4-(trifluoromethyl)- (delta mass: 31.0455 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017312695","spectrum_index":47016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 69.0573 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.154,"smiles":null,"spectrum_id":"CCMSLIB00017312698","spectrum_index":47017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 266.152 Da; putative annotation: N/A; putative formula: C15H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.223,"smiles":null,"spectrum_id":"CCMSLIB00017312700","spectrum_index":47018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Quinazolinamine, 2-cyclohexyl-6-methoxy-N-[1-(1-methylethyl)-4-piperidinyl]-7-[3-(1-pyrrolidinyl)propoxy]- (delta mass: 69.0576 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.438,"smiles":null,"spectrum_id":"CCMSLIB00017312703","spectrum_index":47019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 425.3034 Da; putative annotation: N/A; putative formula: C26H39N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.463,"smiles":null,"spectrum_id":"CCMSLIB00017312706","spectrum_index":47020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 134.0945 Da; putative annotation: N/A; putative formula: C7H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.191,"smiles":null,"spectrum_id":"CCMSLIB00017312709","spectrum_index":47021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 286.1604 Da; putative annotation: N/A; putative formula: C15H26O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.22,"smiles":null,"spectrum_id":"CCMSLIB00017312712","spectrum_index":47022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C4:0 (delta mass: 320.2714 Da; putative annotation: N/A; putative formula: C21H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.478,"smiles":null,"spectrum_id":"CCMSLIB00017312715","spectrum_index":47023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 135.9238 Da; putative annotation: N/A; putative formula: C2H3O-1P3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.995,"smiles":null,"spectrum_id":"CCMSLIB00017312718","spectrum_index":47024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 173.0686 Da; putative annotation: N/A; putative formula: C7H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.134,"smiles":null,"spectrum_id":"CCMSLIB00017312721","spectrum_index":47025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 82.0415 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.143,"smiles":null,"spectrum_id":"CCMSLIB00017312724","spectrum_index":47026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 130.0418 Da; putative annotation: N/A; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.112,"smiles":null,"spectrum_id":"CCMSLIB00017312726","spectrum_index":47027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 41.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.138,"smiles":null,"spectrum_id":"CCMSLIB00017312729","spectrum_index":47028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 192.0425 Da; putative annotation: N/A; putative formula: C10H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.129,"smiles":null,"spectrum_id":"CCMSLIB00017312732","spectrum_index":47029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Granisetron (delta mass: 77.046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.248,"smiles":null,"spectrum_id":"CCMSLIB00017312735","spectrum_index":47030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 131.9981 Da; putative annotation: N/A; putative formula: C4H5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.1,"smiles":null,"spectrum_id":"CCMSLIB00017312738","spectrum_index":47031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 381.1951 Da; putative annotation: N/A; putative formula: C24H31NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.271,"smiles":null,"spectrum_id":"CCMSLIB00017312741","spectrum_index":47032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 116.0835 Da; putative annotation: N/A; putative formula: C6H12O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.149,"smiles":null,"spectrum_id":"CCMSLIB00017312744","spectrum_index":47033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 52.9894 Da; putative annotation: N/A; putative formula: C2H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.039,"smiles":null,"spectrum_id":"CCMSLIB00017312746","spectrum_index":47034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cori ester (alpha-anomer) - 30.0 eV (delta mass: 107.0042 Da; putative annotation: N/A; putative formula: C2H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.041,"smiles":null,"spectrum_id":"CCMSLIB00017312748","spectrum_index":47035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2,3-Dihydro-1H-perimidin-2-yl)-1,2-benzenediol (delta mass: 298.0608 Da; putative annotation: N/A; putative formula: C13H15O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.174,"smiles":null,"spectrum_id":"CCMSLIB00017312751","spectrum_index":47036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 557.0807 Da; putative annotation: N/A; putative formula: C18H27N3O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.204,"smiles":null,"spectrum_id":"CCMSLIB00017312754","spectrum_index":47037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 184.0211 Da; putative annotation: N/A; putative formula: C9H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.062,"smiles":null,"spectrum_id":"CCMSLIB00017312756","spectrum_index":47038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 110.0198 Da; putative annotation: N/A; putative formula: C6H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.085,"smiles":null,"spectrum_id":"CCMSLIB00017312759","spectrum_index":47039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 182.0346 Da; putative annotation: N/A; putative formula: C5H11O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.137,"smiles":null,"spectrum_id":"CCMSLIB00017312762","spectrum_index":47040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 316.2167 Da; putative annotation: N/A; putative formula: C17H33O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.329,"smiles":null,"spectrum_id":"CCMSLIB00017312764","spectrum_index":47041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU092703 Indole-3-butyric acid|4-(1H-indol-3-yl)butanoic acid (delta mass: 172.1097 Da; putative annotation: N/A; putative formula: C9H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.212,"smiles":null,"spectrum_id":"CCMSLIB00017312766","spectrum_index":47042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 64.0428 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.161,"smiles":null,"spectrum_id":"CCMSLIB00017312769","spectrum_index":47043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017312772","spectrum_index":47044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 308.1625 Da; putative annotation: N/A; putative formula: C17H24O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.264,"smiles":null,"spectrum_id":"CCMSLIB00017312775","spectrum_index":47045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acaranoic acid (delta mass: 42.0827 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.304,"smiles":null,"spectrum_id":"CCMSLIB00017312777","spectrum_index":47046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 32.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.118,"smiles":null,"spectrum_id":"CCMSLIB00017312780","spectrum_index":47047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylbutanoic acid (delta mass: 38.0137 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":156.1,"smiles":null,"spectrum_id":"CCMSLIB00017312783","spectrum_index":47048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[2-(3,4-dimethoxyphenyl)ethyl]-2-chloroacetamide CollisionEnergy:102040\"\" (delta mass: 56.1061 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.195,"smiles":null,"spectrum_id":"CCMSLIB00017312784","spectrum_index":47049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 36.0393 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.11,"smiles":null,"spectrum_id":"CCMSLIB00017312787","spectrum_index":47050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxylic acid (delta mass: 17.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.107,"smiles":null,"spectrum_id":"CCMSLIB00017312790","spectrum_index":47051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 261.032 Da; putative annotation: N/A; putative formula: C9H13NO4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.069,"smiles":null,"spectrum_id":"CCMSLIB00017312793","spectrum_index":47052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 28.0353 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017312796","spectrum_index":47053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 463.2935 Da; putative annotation: N/A; putative formula: C26H41NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.354,"smiles":null,"spectrum_id":"CCMSLIB00017312798","spectrum_index":47054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 135.1022 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.256,"smiles":null,"spectrum_id":"CCMSLIB00017312801","spectrum_index":47055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal (delta mass: 40.0505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.1,"smiles":null,"spectrum_id":"CCMSLIB00017312804","spectrum_index":47056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 68.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.118,"smiles":null,"spectrum_id":"CCMSLIB00017312806","spectrum_index":47057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 368.2188 Da; putative annotation: N/A; putative formula: C24H34O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.305,"smiles":null,"spectrum_id":"CCMSLIB00017312808","spectrum_index":47058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Ala (delta mass: 78.0134 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.1,"smiles":null,"spectrum_id":"CCMSLIB00017312811","spectrum_index":47059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glycine, 1,1'-(1,8-dioxo-1,8-octanediyl)bis[glycyl- (delta mass: 82.0806 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.263,"smiles":null,"spectrum_id":"CCMSLIB00017312814","spectrum_index":47060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 299.2825 Da; putative annotation: N/A; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.343,"smiles":null,"spectrum_id":"CCMSLIB00017312816","spectrum_index":47061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 181.2248 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.384,"smiles":null,"spectrum_id":"CCMSLIB00017312819","spectrum_index":47062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 150.0537 Da; putative annotation: N/A; putative formula: C6H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.14,"smiles":null,"spectrum_id":"CCMSLIB00017312822","spectrum_index":47063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.103,"smiles":null,"spectrum_id":"CCMSLIB00017312824","spectrum_index":47064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 40.02 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.146,"smiles":null,"spectrum_id":"CCMSLIB00017312827","spectrum_index":47065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 266.2611 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.363,"smiles":null,"spectrum_id":"CCMSLIB00017312830","spectrum_index":47066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 291.2795 Da; putative annotation: N/A; putative formula: C17H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.34,"smiles":null,"spectrum_id":"CCMSLIB00017312833","spectrum_index":47067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptamine (delta mass: 49.0077 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.115,"smiles":null,"spectrum_id":"CCMSLIB00017312836","spectrum_index":47068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 301.1156 Da; putative annotation: N/A; putative formula: C13H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.229,"smiles":null,"spectrum_id":"CCMSLIB00017312839","spectrum_index":47069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 284.1879 Da; putative annotation: N/A; putative formula: C12H25N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.338,"smiles":null,"spectrum_id":"CCMSLIB00017312842","spectrum_index":47070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 160.0426 Da; putative annotation: N/A; putative formula: C12H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.101,"smiles":null,"spectrum_id":"CCMSLIB00017312844","spectrum_index":47071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-pyruvic acid (delta mass: 157.0791 Da; putative annotation: N/A; putative formula: C5H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.145,"smiles":null,"spectrum_id":"CCMSLIB00017312847","spectrum_index":47072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 115.0269 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.077,"smiles":null,"spectrum_id":"CCMSLIB00017312850","spectrum_index":47073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 362.0592 Da; putative annotation: N/A; putative formula: C25H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.13,"smiles":null,"spectrum_id":"CCMSLIB00017312853","spectrum_index":47074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 42.0099 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.121,"smiles":null,"spectrum_id":"CCMSLIB00017312855","spectrum_index":47075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(Benzyloxy)-1H-indole-3-carbaldehyde (delta mass: 126.064 Da; putative annotation: N/A; putative formula: C3H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.166,"smiles":null,"spectrum_id":"CCMSLIB00017312857","spectrum_index":47076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 779.6307 Da; putative annotation: N/A; putative formula: C47H81N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.701,"smiles":null,"spectrum_id":"CCMSLIB00017312860","spectrum_index":47077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-beta-D-galactosamine - 40.0 eV (delta mass: 551.0692 Da; putative annotation: N/A; putative formula: C24H21N7OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.166,"smiles":null,"spectrum_id":"CCMSLIB00017312863","spectrum_index":47078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 38.0442 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.105,"smiles":null,"spectrum_id":"CCMSLIB00017312866","spectrum_index":47079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 106.0386 Da; putative annotation: N/A; putative formula: C3H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.182,"smiles":null,"spectrum_id":"CCMSLIB00017312869","spectrum_index":47080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 130.0778 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.148,"smiles":null,"spectrum_id":"CCMSLIB00017312871","spectrum_index":47081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1080.3014 Da; putative annotation: N/A; putative formula: C68H40N8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1302.4,"smiles":null,"spectrum_id":"CCMSLIB00017312873","spectrum_index":47082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 730.4286 Da; putative annotation: N/A; putative formula: C54H54N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.504,"smiles":null,"spectrum_id":"CCMSLIB00017312876","spectrum_index":47083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 505.203 Da; putative annotation: N/A; putative formula: C20H35N5O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.3,"smiles":null,"spectrum_id":"CCMSLIB00017312879","spectrum_index":47084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 566.1945 Da; putative annotation: N/A; putative formula: C26H36N2O8P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.255,"smiles":null,"spectrum_id":"CCMSLIB00017312882","spectrum_index":47085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 129.1515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.28,"smiles":null,"spectrum_id":"CCMSLIB00017312884","spectrum_index":47086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 362.1947 Da; putative annotation: N/A; putative formula: C20H31N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.37,"smiles":null,"spectrum_id":"CCMSLIB00017312887","spectrum_index":47087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 250.1091 Da; putative annotation: N/A; putative formula: C10H23N2O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.233,"smiles":null,"spectrum_id":"CCMSLIB00017312890","spectrum_index":47088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (delta mass: 266.0785 Da; putative annotation: N/A; putative formula: C13H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.222,"smiles":null,"spectrum_id":"CCMSLIB00017312892","spectrum_index":47089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 313.2258 Da; putative annotation: N/A; putative formula: C18H35NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.291,"smiles":null,"spectrum_id":"CCMSLIB00017312895","spectrum_index":47090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 165.0517 Da; putative annotation: N/A; putative formula: C3H3N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.092,"smiles":null,"spectrum_id":"CCMSLIB00017312898","spectrum_index":47091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 303.2789 Da; putative annotation: N/A; putative formula: C18H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.344,"smiles":null,"spectrum_id":"CCMSLIB00017312901","spectrum_index":47092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 303.1924 Da; putative annotation: N/A; putative formula: C13H21N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.284,"smiles":null,"spectrum_id":"CCMSLIB00017312903","spectrum_index":47093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 118.0994 Da; putative annotation: N/A; putative formula: C2H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.19,"smiles":null,"spectrum_id":"CCMSLIB00017312906","spectrum_index":47094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 74.1298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.258,"smiles":null,"spectrum_id":"CCMSLIB00017312908","spectrum_index":47095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 116.0077 Da; putative annotation: N/A; putative formula: N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.115,"smiles":null,"spectrum_id":"CCMSLIB00017312911","spectrum_index":47096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 159.0516 Da; putative annotation: N/A; putative formula: C10H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.216,"smiles":null,"spectrum_id":"CCMSLIB00017312914","spectrum_index":47097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 105.0422 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.211,"smiles":null,"spectrum_id":"CCMSLIB00017312917","spectrum_index":47098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 372.2674 Da; putative annotation: N/A; putative formula: C25H32N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.365,"smiles":null,"spectrum_id":"CCMSLIB00017312919","spectrum_index":47099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU161803 Ecgonine-methyl-ester (EME)|AC1L9FBF|methyl (3S,4R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate (delta mass: 350.0841 Da; putative annotation: N/A; putative formula: C26H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.212,"smiles":null,"spectrum_id":"CCMSLIB00017312922","spectrum_index":47100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 113.0842 Da; putative annotation: L-Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017312925","spectrum_index":47101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 159.0528 Da; putative annotation: 2,2'-(2-Hydroxyethylazanediyl)diacetic acid; putative formula: C6H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.139,"smiles":null,"spectrum_id":"CCMSLIB00017312928","spectrum_index":47102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 432.1069 Da; putative annotation: Astilbin; putative formula: C21H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.183,"smiles":null,"spectrum_id":"CCMSLIB00017312931","spectrum_index":47103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 146.0732 Da; putative annotation: 4-Phenylbutyric acid; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017312933","spectrum_index":47104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 97.0527 Da; putative annotation: Massbank:CE000624 Proline; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017312936","spectrum_index":47105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 114.0316 Da; putative annotation: Ethyl hydrogen malonate; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.092,"smiles":null,"spectrum_id":"CCMSLIB00017312939","spectrum_index":47106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 99.0685 Da; putative annotation: DL-Norvaline; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017312942","spectrum_index":47107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 163.1071 Da; putative annotation: N/A; putative formula: C4H13N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.209,"smiles":null,"spectrum_id":"CCMSLIB00017312945","spectrum_index":47108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 55.9575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.028,"smiles":null,"spectrum_id":"CCMSLIB00017312948","spectrum_index":47109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.133,"smiles":null,"spectrum_id":"CCMSLIB00017312949","spectrum_index":47110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 293.134 Da; putative annotation: N/A; putative formula: C9H19N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.288,"smiles":null,"spectrum_id":"CCMSLIB00017312952","spectrum_index":47111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dobutamine (delta mass: 32.0116 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.187,"smiles":null,"spectrum_id":"CCMSLIB00017312955","spectrum_index":47112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 157.0356 Da; putative annotation: N/A; putative formula: C10H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.117,"smiles":null,"spectrum_id":"CCMSLIB00017312958","spectrum_index":47113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cordycepin (delta mass: 252.0855 Da; putative annotation: N/A; putative formula: C10H20O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.195,"smiles":null,"spectrum_id":"CCMSLIB00017312961","spectrum_index":47114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 18.8099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.913,"smiles":null,"spectrum_id":"CCMSLIB00017312962","spectrum_index":47115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 465.1905 Da; putative annotation: N/A; putative formula: C18H27N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.313,"smiles":null,"spectrum_id":"CCMSLIB00017312965","spectrum_index":47116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 329.0751 Da; putative annotation: N/A; putative formula: C16H16N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.187,"smiles":null,"spectrum_id":"CCMSLIB00017312968","spectrum_index":47117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 254.0881 Da; putative annotation: N/A; putative formula: C15H14N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.217,"smiles":null,"spectrum_id":"CCMSLIB00017312971","spectrum_index":47118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 261.1073 Da; putative annotation: N/A; putative formula: C8H15N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.204,"smiles":null,"spectrum_id":"CCMSLIB00017312974","spectrum_index":47119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-FORMYL-METHIONINE (delta mass: 103.0456 Da; putative annotation: N/A; putative formula: C4H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.099,"smiles":null,"spectrum_id":"CCMSLIB00017312977","spectrum_index":47120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxyamphetamine (delta mass: 72.0364 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.18,"smiles":null,"spectrum_id":"CCMSLIB00017312979","spectrum_index":47121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 146.0409 Da; putative annotation: N/A; putative formula: C6H12P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.089,"smiles":null,"spectrum_id":"CCMSLIB00017312982","spectrum_index":47122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 160.0653 Da; putative annotation: N/A; putative formula: C7H13O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.136,"smiles":null,"spectrum_id":"CCMSLIB00017312985","spectrum_index":47123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indole-3-carbonitrile (delta mass: 103.1157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.167,"smiles":null,"spectrum_id":"CCMSLIB00017312987","spectrum_index":47124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 164.1528 Da; putative annotation: N/A; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.211,"smiles":null,"spectrum_id":"CCMSLIB00017312989","spectrum_index":47125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 37.0321 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.15,"smiles":null,"spectrum_id":"CCMSLIB00017312992","spectrum_index":47126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 82.0788 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.369,"smiles":null,"spectrum_id":"CCMSLIB00017312995","spectrum_index":47127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 3-amino-4-methoxyindole-2-carboxylate CollisionEnergy:102040 (delta mass: 14.0082 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.1,"smiles":null,"spectrum_id":"CCMSLIB00017312998","spectrum_index":47128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 86.0377 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.108,"smiles":null,"spectrum_id":"CCMSLIB00017313001","spectrum_index":47129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 32.0339 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.199,"smiles":null,"spectrum_id":"CCMSLIB00017313003","spectrum_index":47130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-tert-Butyl-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 46.0053 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.159,"smiles":null,"spectrum_id":"CCMSLIB00017313006","spectrum_index":47131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl-4-fluoroindole-2-carboxylate (delta mass: 101.0332 Da; putative annotation: N/A; putative formula: CH3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.11,"smiles":null,"spectrum_id":"CCMSLIB00017313009","spectrum_index":47132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 103.0627 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.113,"smiles":null,"spectrum_id":"CCMSLIB00017313011","spectrum_index":47133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 116.006 Da; putative annotation: N/A; putative formula: C3H6N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.103,"smiles":null,"spectrum_id":"CCMSLIB00017313014","spectrum_index":47134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 17.4816 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.579,"smiles":null,"spectrum_id":"CCMSLIB00017313017","spectrum_index":47135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 177.0456 Da; putative annotation: N/A; putative formula: C8H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.184,"smiles":null,"spectrum_id":"CCMSLIB00017313020","spectrum_index":47136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 22.9904 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.108,"smiles":null,"spectrum_id":"CCMSLIB00017313023","spectrum_index":47137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Pro (delta mass: 97.0508 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.201,"smiles":null,"spectrum_id":"CCMSLIB00017313024","spectrum_index":47138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 116.0692 Da; putative annotation: N/A; putative formula: C3H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.148,"smiles":null,"spectrum_id":"CCMSLIB00017313027","spectrum_index":47139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 739.4651 Da; putative annotation: N/A; putative formula: C41H53N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.567,"smiles":null,"spectrum_id":"CCMSLIB00017313030","spectrum_index":47140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 184.181 Da; putative annotation: N/A; putative formula: C8H20N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.361,"smiles":null,"spectrum_id":"CCMSLIB00017313033","spectrum_index":47141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003358 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 14.0092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.048,"smiles":null,"spectrum_id":"CCMSLIB00017313036","spectrum_index":47142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Methoxy-5H-dibenzo[b,f]azepine (delta mass: 14.013 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.12,"smiles":null,"spectrum_id":"CCMSLIB00017313038","spectrum_index":47143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 872.4604 Da; putative annotation: N/A; putative formula: C37H64N10O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1203.61,"smiles":null,"spectrum_id":"CCMSLIB00017313041","spectrum_index":47144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 13.4036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.5,"smiles":null,"spectrum_id":"CCMSLIB00017313044","spectrum_index":47145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 219.0539 Da; putative annotation: N/A; putative formula: C4H9N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.156,"smiles":null,"spectrum_id":"CCMSLIB00017313046","spectrum_index":47146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 118.0625 Da; putative annotation: N/A; putative formula: C5H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.248,"smiles":null,"spectrum_id":"CCMSLIB00017313049","spectrum_index":47147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 472.2138 Da; putative annotation: N/A; putative formula: C24H40O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.368,"smiles":null,"spectrum_id":"CCMSLIB00017313052","spectrum_index":47148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 12.9993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.091,"smiles":null,"spectrum_id":"CCMSLIB00017313054","spectrum_index":47149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 62.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.118,"smiles":null,"spectrum_id":"CCMSLIB00017313057","spectrum_index":47150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 12.8833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.98,"smiles":null,"spectrum_id":"CCMSLIB00017313060","spectrum_index":47151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 107.0368 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.123,"smiles":null,"spectrum_id":"CCMSLIB00017313063","spectrum_index":47152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 76.0513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.13,"smiles":null,"spectrum_id":"CCMSLIB00017313066","spectrum_index":47153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 239.1834 Da; putative annotation: N/A; putative formula: C13H25N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.259,"smiles":null,"spectrum_id":"CCMSLIB00017313068","spectrum_index":47154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-mannosamine - 40.0 eV (delta mass: 868.4682 Da; putative annotation: N/A; putative formula: C42H68N4O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1090.57,"smiles":null,"spectrum_id":"CCMSLIB00017313071","spectrum_index":47155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 94.0055 Da; putative annotation: N/A; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.066,"smiles":null,"spectrum_id":"CCMSLIB00017313074","spectrum_index":47156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 50.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.19,"smiles":null,"spectrum_id":"CCMSLIB00017313077","spectrum_index":47157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 28.0443 Da; putative annotation: N/A; putative formula: CH4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.13,"smiles":null,"spectrum_id":"CCMSLIB00017313080","spectrum_index":47158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 326.1703 Da; putative annotation: N/A; putative formula: C13H22N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.23,"smiles":null,"spectrum_id":"CCMSLIB00017313082","spectrum_index":47159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-3-pyridazinol (delta mass: 18.0147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.07,"smiles":null,"spectrum_id":"CCMSLIB00017313085","spectrum_index":47160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 351.2534 Da; putative annotation: N/A; putative formula: C20H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.319,"smiles":null,"spectrum_id":"CCMSLIB00017313088","spectrum_index":47161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 103.0633 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.187,"smiles":null,"spectrum_id":"CCMSLIB00017313091","spectrum_index":47162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 76.0174 Da; putative annotation: N/A; putative formula: C3N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.115,"smiles":null,"spectrum_id":"CCMSLIB00017313094","spectrum_index":47163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 95.9139 Da; putative annotation: N/A; putative formula: S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.925,"smiles":null,"spectrum_id":"CCMSLIB00017313096","spectrum_index":47164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301108 L-Oxonoreleagnine (delta mass: 96.0217 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.108,"smiles":null,"spectrum_id":"CCMSLIB00017313099","spectrum_index":47165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 366.1725 Da; putative annotation: N/A; putative formula: C16H32O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.264,"smiles":null,"spectrum_id":"CCMSLIB00017313102","spectrum_index":47166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsoline (delta mass: 49.0166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.134,"smiles":null,"spectrum_id":"CCMSLIB00017313105","spectrum_index":47167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 89.0264 Da; putative annotation: N/A; putative formula: C6H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.092,"smiles":null,"spectrum_id":"CCMSLIB00017313108","spectrum_index":47168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 184.1464 Da; putative annotation: N/A; putative formula: C11H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.191,"smiles":null,"spectrum_id":"CCMSLIB00017313110","spectrum_index":47169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 189.0829 Da; putative annotation: N/A; putative formula: C8H15NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.18,"smiles":null,"spectrum_id":"CCMSLIB00017313113","spectrum_index":47170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 51.9886 Da; putative annotation: N/A; putative formula: C3HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.085,"smiles":null,"spectrum_id":"CCMSLIB00017313116","spectrum_index":47171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 33.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.107,"smiles":null,"spectrum_id":"CCMSLIB00017313119","spectrum_index":47172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 72.039 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.078,"smiles":null,"spectrum_id":"CCMSLIB00017313122","spectrum_index":47173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 159.0217 Da; putative annotation: N/A; putative formula: C3H5N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.102,"smiles":null,"spectrum_id":"CCMSLIB00017313124","spectrum_index":47174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 86.0522 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017313127","spectrum_index":47175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norharmane (delta mass: 45.0071 Da; putative annotation: N/A; putative formula: CH3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.083,"smiles":null,"spectrum_id":"CCMSLIB00017313130","spectrum_index":47176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 38.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017313133","spectrum_index":47177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 504.1328 Da; putative annotation: N/A; putative formula: C24H24O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1171.36,"smiles":null,"spectrum_id":"CCMSLIB00017313136","spectrum_index":47178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 232.1436 Da; putative annotation: N/A; putative formula: C11H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.288,"smiles":null,"spectrum_id":"CCMSLIB00017313138","spectrum_index":47179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 448.7463 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.87,"smiles":null,"spectrum_id":"CCMSLIB00017313142","spectrum_index":47180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 461.1962 Da; putative annotation: N/A; putative formula: C27H31N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.287,"smiles":null,"spectrum_id":"CCMSLIB00017313144","spectrum_index":47181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 108.0563 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.242,"smiles":null,"spectrum_id":"CCMSLIB00017313147","spectrum_index":47182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carboxylic acid, ethyl ester (delta mass: 15.9949 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.081,"smiles":null,"spectrum_id":"CCMSLIB00017313150","spectrum_index":47183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 92.0838 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.149,"smiles":null,"spectrum_id":"CCMSLIB00017313153","spectrum_index":47184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 612.1844 Da; putative annotation: N/A; putative formula: C31H32O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":792.271,"smiles":null,"spectrum_id":"CCMSLIB00017313156","spectrum_index":47185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 51.047 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.118,"smiles":null,"spectrum_id":"CCMSLIB00017313158","spectrum_index":47186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(2-Nitrophenyl)-1,2-ethanediamine (delta mass: 106.0346 Da; putative annotation: N/A; putative formula: C7H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.127,"smiles":null,"spectrum_id":"CCMSLIB00017313161","spectrum_index":47187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 133.9722 Da; putative annotation: N/A; putative formula: CH2N4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.131,"smiles":null,"spectrum_id":"CCMSLIB00017313164","spectrum_index":47188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetamide (delta mass: 101.0851 Da; putative annotation: N/A; putative formula: C5H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.172,"smiles":null,"spectrum_id":"CCMSLIB00017313167","spectrum_index":47189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 374.207 Da; putative annotation: N/A; putative formula: C26H30S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.287,"smiles":null,"spectrum_id":"CCMSLIB00017313170","spectrum_index":47190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 709.3113 Da; putative annotation: N/A; putative formula: C39H43N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":903.429,"smiles":null,"spectrum_id":"CCMSLIB00017313173","spectrum_index":47191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 329.0683 Da; putative annotation: N/A; putative formula: C12H15N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.095,"smiles":null,"spectrum_id":"CCMSLIB00017313175","spectrum_index":47192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 44.0511 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.148,"smiles":null,"spectrum_id":"CCMSLIB00017313178","spectrum_index":47193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-methyl-4-(pyridin-2-yl)but-3-yn-2-ol (delta mass: 141.1402 Da; putative annotation: N/A; putative formula: C6H15N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.232,"smiles":null,"spectrum_id":"CCMSLIB00017313181","spectrum_index":47194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-7-carboxaldehyde (delta mass: 17.0268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.087,"smiles":null,"spectrum_id":"CCMSLIB00017313184","spectrum_index":47195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 165.1399 Da; putative annotation: N/A; putative formula: C8H15N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.231,"smiles":null,"spectrum_id":"CCMSLIB00017313187","spectrum_index":47196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 14.0136 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.11,"smiles":null,"spectrum_id":"CCMSLIB00017313188","spectrum_index":47197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 341.1586 Da; putative annotation: N/A; putative formula: C15H23N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.271,"smiles":null,"spectrum_id":"CCMSLIB00017313191","spectrum_index":47198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML01293 5-Methyltryptamine (delta mass: 38.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.165,"smiles":null,"spectrum_id":"CCMSLIB00017313194","spectrum_index":47199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 737.2537 Da; putative annotation: N/A; putative formula: C37H44N3O9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1404.48,"smiles":null,"spectrum_id":"CCMSLIB00017313197","spectrum_index":47200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 234.1104 Da; putative annotation: N/A; putative formula: C10H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.186,"smiles":null,"spectrum_id":"CCMSLIB00017313200","spectrum_index":47201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 62.0297 Da; putative annotation: N/A; putative formula: C4H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.127,"smiles":null,"spectrum_id":"CCMSLIB00017313202","spectrum_index":47202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 16.1242 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.251,"smiles":null,"spectrum_id":"CCMSLIB00017313205","spectrum_index":47203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Roccellaric acid (delta mass: 16.0334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.286,"smiles":null,"spectrum_id":"CCMSLIB00017313207","spectrum_index":47204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 372.3032 Da; putative annotation: N/A; putative formula: C25H40O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.379,"smiles":null,"spectrum_id":"CCMSLIB00017313210","spectrum_index":47205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1251.7149 Da; putative annotation: N/A; putative formula: C67H105N5O13S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1473.81,"smiles":null,"spectrum_id":"CCMSLIB00017313213","spectrum_index":47206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 158.0801 Da; putative annotation: N/A; putative formula: C5H10N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.234,"smiles":null,"spectrum_id":"CCMSLIB00017313216","spectrum_index":47207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 127.0121 Da; putative annotation: N/A; putative formula: C2HN5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.135,"smiles":null,"spectrum_id":"CCMSLIB00017313219","spectrum_index":47208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 101.0585 Da; putative annotation: N/A; putative formula: C3H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.155,"smiles":null,"spectrum_id":"CCMSLIB00017313221","spectrum_index":47209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 101.0628 Da; putative annotation: N/A; putative formula: C8H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.107,"smiles":null,"spectrum_id":"CCMSLIB00017313224","spectrum_index":47210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 99.9832 Da; putative annotation: N/A; putative formula: C2HN2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.064,"smiles":null,"spectrum_id":"CCMSLIB00017313227","spectrum_index":47211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 33.9941 Da; putative annotation: N/A; putative formula: C2H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.07,"smiles":null,"spectrum_id":"CCMSLIB00017313229","spectrum_index":47212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 70.0989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.144,"smiles":null,"spectrum_id":"CCMSLIB00017313232","spectrum_index":47213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 128.0989 Da; putative annotation: N/A; putative formula: C11H12O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.154,"smiles":null,"spectrum_id":"CCMSLIB00017313235","spectrum_index":47214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_prop_2_en_1_yl__1H_indole_3_carboxylic_acid (delta mass: 157.0383 Da; putative annotation: N/A; putative formula: C7H11NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.125,"smiles":null,"spectrum_id":"CCMSLIB00017313238","spectrum_index":47215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 228.0688 Da; putative annotation: N/A; putative formula: C16H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.15,"smiles":null,"spectrum_id":"CCMSLIB00017313241","spectrum_index":47216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 29.0521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.138,"smiles":null,"spectrum_id":"CCMSLIB00017313243","spectrum_index":47217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300852 Speciosine (delta mass: 18.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.238,"smiles":null,"spectrum_id":"CCMSLIB00017313245","spectrum_index":47218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 28.0059 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.086,"smiles":null,"spectrum_id":"CCMSLIB00017313248","spectrum_index":47219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 77.0372 Da; putative annotation: N/A; putative formula: C4H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.102,"smiles":null,"spectrum_id":"CCMSLIB00017313251","spectrum_index":47220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 179.0143 Da; putative annotation: N/A; putative formula: C8H6NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.08,"smiles":null,"spectrum_id":"CCMSLIB00017313254","spectrum_index":47221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine (delta mass: 329.0483 Da; putative annotation: N/A; putative formula: C16H7N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.152,"smiles":null,"spectrum_id":"CCMSLIB00017313256","spectrum_index":47222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 167.0756 Da; putative annotation: N/A; putative formula: C9H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.178,"smiles":null,"spectrum_id":"CCMSLIB00017313259","spectrum_index":47223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 198.0758 Da; putative annotation: N/A; putative formula: C7H10N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.25,"smiles":null,"spectrum_id":"CCMSLIB00017313262","spectrum_index":47224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-isoleucine (delta mass: 138.1404 Da; putative annotation: N/A; putative formula: C10H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.237,"smiles":null,"spectrum_id":"CCMSLIB00017313265","spectrum_index":47225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CloxacillinNa (delta mass: 239.1459 Da; putative annotation: N/A; putative formula: C12H21N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.219,"smiles":null,"spectrum_id":"CCMSLIB00017313268","spectrum_index":47226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine (delta mass: 523.2755 Da; putative annotation: N/A; putative formula: C23H37N7O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.425,"smiles":null,"spectrum_id":"CCMSLIB00017313271","spectrum_index":47227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 579.2476 Da; putative annotation: N/A; putative formula: C33H41NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.318,"smiles":null,"spectrum_id":"CCMSLIB00017313274","spectrum_index":47228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Gly-Lys (delta mass: 142.0738 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.287,"smiles":null,"spectrum_id":"CCMSLIB00017313277","spectrum_index":47229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 161.1167 Da; putative annotation: N/A; putative formula: C6H15N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.266,"smiles":null,"spectrum_id":"CCMSLIB00017313280","spectrum_index":47230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-ALLOTHREONINE - 70.0 eV (delta mass: 67.0423 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.108,"smiles":null,"spectrum_id":"CCMSLIB00017313283","spectrum_index":47231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 121.0374 Da; putative annotation: N/A; putative formula: C3H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.155,"smiles":null,"spectrum_id":"CCMSLIB00017313285","spectrum_index":47232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 213.168 Da; putative annotation: N/A; putative formula: C11H23N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.337,"smiles":null,"spectrum_id":"CCMSLIB00017313288","spectrum_index":47233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-alpha-D-glucosamine - 40.0 eV (delta mass: 744.6628 Da; putative annotation: N/A; putative formula: C48H88O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":966.76,"smiles":null,"spectrum_id":"CCMSLIB00017313290","spectrum_index":47234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 332.2098 Da; putative annotation: N/A; putative formula: C19H28N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.275,"smiles":null,"spectrum_id":"CCMSLIB00017313294","spectrum_index":47235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 57.0246 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.127,"smiles":null,"spectrum_id":"CCMSLIB00017313297","spectrum_index":47236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro (delta mass: 147.0683 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.16,"smiles":null,"spectrum_id":"CCMSLIB00017313300","spectrum_index":47237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 53.0542 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.103,"smiles":null,"spectrum_id":"CCMSLIB00017313303","spectrum_index":47238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 991.5171 Da; putative annotation: N/A; putative formula: C61H73N3O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1213.61,"smiles":null,"spectrum_id":"CCMSLIB00017313306","spectrum_index":47239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 122.0791 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.143,"smiles":null,"spectrum_id":"CCMSLIB00017313309","spectrum_index":47240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 322.1992 Da; putative annotation: N/A; putative formula: C15H30O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.369,"smiles":null,"spectrum_id":"CCMSLIB00017313312","spectrum_index":47241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-3-pyridinol (delta mass: 26.0012 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.061,"smiles":null,"spectrum_id":"CCMSLIB00017313314","spectrum_index":47242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 23.9751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.098,"smiles":null,"spectrum_id":"CCMSLIB00017313317","spectrum_index":47243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 165.0749 Da; putative annotation: N/A; putative formula: C4H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.198,"smiles":null,"spectrum_id":"CCMSLIB00017313320","spectrum_index":47244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 72.0394 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.108,"smiles":null,"spectrum_id":"CCMSLIB00017313323","spectrum_index":47245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 255.1547 Da; putative annotation: N/A; putative formula: C17H22NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.225,"smiles":null,"spectrum_id":"CCMSLIB00017313326","spectrum_index":47246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 156.0589 Da; putative annotation: N/A; putative formula: C4H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.135,"smiles":null,"spectrum_id":"CCMSLIB00017313328","spectrum_index":47247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zinterol (delta mass: 17.0332 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.202,"smiles":null,"spectrum_id":"CCMSLIB00017313331","spectrum_index":47248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 92.0832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.242,"smiles":null,"spectrum_id":"CCMSLIB00017313334","spectrum_index":47249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 104.0984 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.273,"smiles":null,"spectrum_id":"CCMSLIB00017313337","spectrum_index":47250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norisoboldine (delta mass: 17.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.154,"smiles":null,"spectrum_id":"CCMSLIB00017313340","spectrum_index":47251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aristolactam (delta mass: 44.0236 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.1,"smiles":null,"spectrum_id":"CCMSLIB00017313342","spectrum_index":47252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 136.0719 Da; putative annotation: N/A; putative formula: C9H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.152,"smiles":null,"spectrum_id":"CCMSLIB00017313345","spectrum_index":47253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-nitrobenzyl)ethanamine (delta mass: 114.0619 Da; putative annotation: N/A; putative formula: C5H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.181,"smiles":null,"spectrum_id":"CCMSLIB00017313348","spectrum_index":47254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glaziovine (delta mass: 73.0415 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.185,"smiles":null,"spectrum_id":"CCMSLIB00017313350","spectrum_index":47255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 89.0304 Da; putative annotation: N/A; putative formula: C3H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.112,"smiles":null,"spectrum_id":"CCMSLIB00017313353","spectrum_index":47256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510507 Tyramine|4-(2-aminoethyl)phenol (delta mass: 461.148 Da; putative annotation: N/A; putative formula: C18H29N3O7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.239,"smiles":null,"spectrum_id":"CCMSLIB00017313356","spectrum_index":47257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 222.0783 Da; putative annotation: N/A; putative formula: C8H11N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.212,"smiles":null,"spectrum_id":"CCMSLIB00017313359","spectrum_index":47258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Botran (delta mass: 110.0408 Da; putative annotation: N/A; putative formula: C5H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.013,"smiles":null,"spectrum_id":"CCMSLIB00017313362","spectrum_index":47259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 64.1141 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.18,"smiles":null,"spectrum_id":"CCMSLIB00017313365","spectrum_index":47260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 154.0746 Da; putative annotation: N/A; putative formula: C7H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.188,"smiles":null,"spectrum_id":"CCMSLIB00017313368","spectrum_index":47261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 63.0674 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.32,"smiles":null,"spectrum_id":"CCMSLIB00017313371","spectrum_index":47262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Val (delta mass: 113.0842 Da; putative annotation: 2-Amino-2-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.254,"smiles":null,"spectrum_id":"CCMSLIB00017313373","spectrum_index":47263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 108.0211 Da; putative annotation: 5-(Hydroxymethyl)-2-furaldehyde; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017313377","spectrum_index":47264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N'-(7-Fluoropyrrolo[1,2-a]quinoxalin-4-yl)pyrazinohydrazide (delta mass: 286.0863 Da; putative annotation: oxypeucedanin hydrate; putative formula: C16H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.191,"smiles":null,"spectrum_id":"CCMSLIB00017313379","spectrum_index":47265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 337.2253 Da; putative annotation: Asp-C14:1; putative formula: C19H31NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.328,"smiles":null,"spectrum_id":"CCMSLIB00017313381","spectrum_index":47266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 166.0589 Da; putative annotation: 1H-Imidazole-4,5-dicarbohydrazide; putative formula: C5H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.16,"smiles":null,"spectrum_id":"CCMSLIB00017313383","spectrum_index":47267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 276.0841 Da; putative annotation: (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one; putative formula: C11H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.208,"smiles":null,"spectrum_id":"CCMSLIB00017313385","spectrum_index":47268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 267.257 Da; putative annotation: Heptadecasphing-4-enine; putative formula: C17H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.354,"smiles":null,"spectrum_id":"CCMSLIB00017313387","spectrum_index":47269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 131.0956 Da; putative annotation: Triethanolamine; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.192,"smiles":null,"spectrum_id":"CCMSLIB00017313389","spectrum_index":47270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 437.3142 Da; putative annotation: N/A; putative formula: C25H43NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.484,"smiles":null,"spectrum_id":"CCMSLIB00017313390","spectrum_index":47271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 146.0404 Da; putative annotation: N/A; putative formula: C6H10O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.163,"smiles":null,"spectrum_id":"CCMSLIB00017313392","spectrum_index":47272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne Acetate (delta mass: 246.2349 Da; putative annotation: N/A; putative formula: C18H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.488,"smiles":null,"spectrum_id":"CCMSLIB00017313394","spectrum_index":47273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxymorphinan (delta mass: 271.1489 Da; putative annotation: N/A; putative formula: C17H22NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.318,"smiles":null,"spectrum_id":"CCMSLIB00017313396","spectrum_index":47274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 307.0534 Da; putative annotation: N/A; putative formula: C8HN15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.145,"smiles":null,"spectrum_id":"CCMSLIB00017313398","spectrum_index":47275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 105.0417 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.101,"smiles":null,"spectrum_id":"CCMSLIB00017313400","spectrum_index":47276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 93.0177 Da; putative annotation: N/A; putative formula: H3N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.104,"smiles":null,"spectrum_id":"CCMSLIB00017313401","spectrum_index":47277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 142.0662 Da; putative annotation: N/A; putative formula: C6H11N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.126,"smiles":null,"spectrum_id":"CCMSLIB00017313403","spectrum_index":47278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 139.9876 Da; putative annotation: N/A; putative formula: C2H5O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.058,"smiles":null,"spectrum_id":"CCMSLIB00017313405","spectrum_index":47279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 236.1747 Da; putative annotation: N/A; putative formula: C11H20N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.235,"smiles":null,"spectrum_id":"CCMSLIB00017313407","spectrum_index":47280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 881.4765 Da; putative annotation: N/A; putative formula: C58H63N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1062.55,"smiles":null,"spectrum_id":"CCMSLIB00017313409","spectrum_index":47281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 270.2373 Da; putative annotation: N/A; putative formula: C17H34S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.313,"smiles":null,"spectrum_id":"CCMSLIB00017313410","spectrum_index":47282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 220.2152 Da; putative annotation: N/A; putative formula: C16H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.327,"smiles":null,"spectrum_id":"CCMSLIB00017313412","spectrum_index":47283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 62.0281 Da; putative annotation: N/A; putative formula: C4H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.083,"smiles":null,"spectrum_id":"CCMSLIB00017313414","spectrum_index":47284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 34.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.153,"smiles":null,"spectrum_id":"CCMSLIB00017313416","spectrum_index":47285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 956.8425 Da; putative annotation: N/A; putative formula: C62H108N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.94,"smiles":null,"spectrum_id":"CCMSLIB00017313418","spectrum_index":47286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipivefrine (delta mass: 27.9985 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.21,"smiles":null,"spectrum_id":"CCMSLIB00017313420","spectrum_index":47287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 339.2418 Da; putative annotation: N/A; putative formula: C20H37NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.322,"smiles":null,"spectrum_id":"CCMSLIB00017313421","spectrum_index":47288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 14.015 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.158,"smiles":null,"spectrum_id":"CCMSLIB00017313423","spectrum_index":47289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 43.0419 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.123,"smiles":null,"spectrum_id":"CCMSLIB00017313425","spectrum_index":47290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 282.0453 Da; putative annotation: N/A; putative formula: C9H11N6OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.111,"smiles":null,"spectrum_id":"CCMSLIB00017313427","spectrum_index":47291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 24.0032 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.095,"smiles":null,"spectrum_id":"CCMSLIB00017313429","spectrum_index":47292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-3-deazaadenosine (delta mass: 336.106 Da; putative annotation: N/A; putative formula: C16H21N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.176,"smiles":null,"spectrum_id":"CCMSLIB00017313431","spectrum_index":47293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 122.1092 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.174,"smiles":null,"spectrum_id":"CCMSLIB00017313433","spectrum_index":47294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 200.0086 Da; putative annotation: N/A; putative formula: C4H9O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.079,"smiles":null,"spectrum_id":"CCMSLIB00017313435","spectrum_index":47295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 106.6184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.788,"smiles":null,"spectrum_id":"CCMSLIB00017313436","spectrum_index":47296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 282.6465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.723,"smiles":null,"spectrum_id":"CCMSLIB00017313438","spectrum_index":47297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 124.5933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.732,"smiles":null,"spectrum_id":"CCMSLIB00017313440","spectrum_index":47298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU288203 Carboline|9H-pyrido[2,3-b]indole (delta mass: 143.0542 Da; putative annotation: N/A; putative formula: C2H5N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.13,"smiles":null,"spectrum_id":"CCMSLIB00017313441","spectrum_index":47299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 38.0501 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.272,"smiles":null,"spectrum_id":"CCMSLIB00017313443","spectrum_index":47300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid (delta mass: 156.013 Da; putative annotation: N/A; putative formula: C10H5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.071,"smiles":null,"spectrum_id":"CCMSLIB00017313445","spectrum_index":47301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1007.439 Da; putative annotation: N/A; putative formula: C59H65N3O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1188.51,"smiles":null,"spectrum_id":"CCMSLIB00017313447","spectrum_index":47302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 144.0415 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.149,"smiles":null,"spectrum_id":"CCMSLIB00017313448","spectrum_index":47303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 16.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.123,"smiles":null,"spectrum_id":"CCMSLIB00017313450","spectrum_index":47304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 376.9725 Da; putative annotation: N/A; putative formula: C8H11NO12S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.04,"smiles":null,"spectrum_id":"CCMSLIB00017313452","spectrum_index":47305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hydroquinidine (delta mass: 545.3339 Da; putative annotation: N/A; putative formula: C28H39N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.541,"smiles":null,"spectrum_id":"CCMSLIB00017313454","spectrum_index":47306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.337,"smiles":null,"spectrum_id":"CCMSLIB00017313456","spectrum_index":47307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300424 Speciophylline (delta mass: 232.0742 Da; putative annotation: N/A; putative formula: C6H12N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.255,"smiles":null,"spectrum_id":"CCMSLIB00017313457","spectrum_index":47308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cephaeline (delta mass: 171.0706 Da; putative annotation: N/A; putative formula: C8H13NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.361,"smiles":null,"spectrum_id":"CCMSLIB00017313459","spectrum_index":47309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolidine (delta mass: 129.0428 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.176,"smiles":null,"spectrum_id":"CCMSLIB00017313461","spectrum_index":47310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 415.2103 Da; putative annotation: N/A; putative formula: C24H34NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.302,"smiles":null,"spectrum_id":"CCMSLIB00017313463","spectrum_index":47311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mer-N5075-A_35716_dereplictor_pv_5.17819e-12 (delta mass: 239.1148 Da; putative annotation: N/A; putative formula: C12H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":837.45,"smiles":null,"spectrum_id":"CCMSLIB00017313465","spectrum_index":47312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol CollisionEnergy:102040 (delta mass: 200.0475 Da; putative annotation: N/A; putative formula: C12H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.123,"smiles":null,"spectrum_id":"CCMSLIB00017313467","spectrum_index":47313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 86.0401 Da; putative annotation: N/A; putative formula: C3H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.163,"smiles":null,"spectrum_id":"CCMSLIB00017313469","spectrum_index":47314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 145.0528 Da; putative annotation: N/A; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.118,"smiles":null,"spectrum_id":"CCMSLIB00017313471","spectrum_index":47315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 94.1143 Da; putative annotation: N/A; putative formula: C8H14O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.18,"smiles":null,"spectrum_id":"CCMSLIB00017313473","spectrum_index":47316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 180.1152 Da; putative annotation: N/A; putative formula: C11H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.202,"smiles":null,"spectrum_id":"CCMSLIB00017313474","spectrum_index":47317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 36.0 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017313476","spectrum_index":47318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 119.0376 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.108,"smiles":null,"spectrum_id":"CCMSLIB00017313478","spectrum_index":47319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-guanidinobutanamide (delta mass: 26.0332 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.142,"smiles":null,"spectrum_id":"CCMSLIB00017313480","spectrum_index":47320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.19,"smiles":null,"spectrum_id":"CCMSLIB00017313482","spectrum_index":47321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-2-ol (delta mass: 130.1476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.208,"smiles":null,"spectrum_id":"CCMSLIB00017313484","spectrum_index":47322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 40.0424 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.165,"smiles":null,"spectrum_id":"CCMSLIB00017313486","spectrum_index":47323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 34.0392 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.099,"smiles":null,"spectrum_id":"CCMSLIB00017313488","spectrum_index":47324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 43.1042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.169,"smiles":null,"spectrum_id":"CCMSLIB00017313490","spectrum_index":47325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5_hydroxy_tryptophol (delta mass: 25.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.144,"smiles":null,"spectrum_id":"CCMSLIB00017313492","spectrum_index":47326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 60.021 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017313494","spectrum_index":47327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 90.0291 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.188,"smiles":null,"spectrum_id":"CCMSLIB00017313496","spectrum_index":47328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 117.0428 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.145,"smiles":null,"spectrum_id":"CCMSLIB00017313498","spectrum_index":47329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 559.2477 Da; putative annotation: N/A; putative formula: C28H33N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.371,"smiles":null,"spectrum_id":"CCMSLIB00017313500","spectrum_index":47330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 415.1476 Da; putative annotation: N/A; putative formula: C18H25NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.218,"smiles":null,"spectrum_id":"CCMSLIB00017313502","spectrum_index":47331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 382.7254 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.849,"smiles":null,"spectrum_id":"CCMSLIB00017313503","spectrum_index":47332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 30.0126 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.126,"smiles":null,"spectrum_id":"CCMSLIB00017313505","spectrum_index":47333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hymenidin (delta mass: 121.0633 Da; putative annotation: N/A; putative formula: H8N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.093,"smiles":null,"spectrum_id":"CCMSLIB00017313507","spectrum_index":47334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 167.2617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.441,"smiles":null,"spectrum_id":"CCMSLIB00017313509","spectrum_index":47335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 178.1197 Da; putative annotation: N/A; putative formula: C12H18O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.289,"smiles":null,"spectrum_id":"CCMSLIB00017313511","spectrum_index":47336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 102.0365 Da; putative annotation: N/A; putative formula: C2H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.134,"smiles":null,"spectrum_id":"CCMSLIB00017313513","spectrum_index":47337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 340.0931 Da; putative annotation: N/A; putative formula: C13H25O4PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.216,"smiles":null,"spectrum_id":"CCMSLIB00017313515","spectrum_index":47338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Methylsulfanyl)-9H-pyrimido[4,5-b]indole (delta mass: 59.441 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.5,"smiles":null,"spectrum_id":"CCMSLIB00017313517","spectrum_index":47339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 230.0943 Da; putative annotation: N/A; putative formula: C14H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.17,"smiles":null,"spectrum_id":"CCMSLIB00017313518","spectrum_index":47340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 236.0541 Da; putative annotation: N/A; putative formula: C9H16O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.156,"smiles":null,"spectrum_id":"CCMSLIB00017313520","spectrum_index":47341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 198.0676 Da; putative annotation: N/A; putative formula: C13H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.165,"smiles":null,"spectrum_id":"CCMSLIB00017313522","spectrum_index":47342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 171.1616 Da; putative annotation: N/A; putative formula: C10H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.237,"smiles":null,"spectrum_id":"CCMSLIB00017313524","spectrum_index":47343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 95.0198 Da; putative annotation: N/A; putative formula: C5H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.111,"smiles":null,"spectrum_id":"CCMSLIB00017313525","spectrum_index":47344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 255.1726 Da; putative annotation: N/A; putative formula: C10H22N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.27,"smiles":null,"spectrum_id":"CCMSLIB00017313527","spectrum_index":47345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 83.0559 Da; putative annotation: N/A; putative formula: C2H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.121,"smiles":null,"spectrum_id":"CCMSLIB00017313529","spectrum_index":47346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 399.2608 Da; putative annotation: N/A; putative formula: C25H37NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.321,"smiles":null,"spectrum_id":"CCMSLIB00017313531","spectrum_index":47347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 242.188 Da; putative annotation: N/A; putative formula: C14H26O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.28,"smiles":null,"spectrum_id":"CCMSLIB00017313532","spectrum_index":47348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 207.0895 Da; putative annotation: N/A; putative formula: C11H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.186,"smiles":null,"spectrum_id":"CCMSLIB00017313534","spectrum_index":47349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7,8a-dihydroxy-1-methoxy-7-methyl-1H-isochromene-6,8-dione (delta mass: 80.0698 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.211,"smiles":null,"spectrum_id":"CCMSLIB00017313536","spectrum_index":47350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Granisetron (delta mass: 104.0724 Da; putative annotation: N/A; putative formula: C7H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.275,"smiles":null,"spectrum_id":"CCMSLIB00017313538","spectrum_index":47351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 439.1906 Da; putative annotation: N/A; putative formula: C20H25N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.273,"smiles":null,"spectrum_id":"CCMSLIB00017313540","spectrum_index":47352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 82.0044 Da; putative annotation: N/A; putative formula: C4H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.096,"smiles":null,"spectrum_id":"CCMSLIB00017313542","spectrum_index":47353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 349.1373 Da; putative annotation: N/A; putative formula: C14H23NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.302,"smiles":null,"spectrum_id":"CCMSLIB00017313544","spectrum_index":47354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 74.0371 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.217,"smiles":null,"spectrum_id":"CCMSLIB00017313546","spectrum_index":47355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 68.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.17,"smiles":null,"spectrum_id":"CCMSLIB00017313548","spectrum_index":47356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 137.0837 Da; putative annotation: N/A; putative formula: C8H11NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.159,"smiles":null,"spectrum_id":"CCMSLIB00017313550","spectrum_index":47357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 236.0836 Da; putative annotation: N/A; putative formula: C16H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017313552","spectrum_index":47358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 285.048 Da; putative annotation: N/A; putative formula: C11H11NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.139,"smiles":null,"spectrum_id":"CCMSLIB00017313554","spectrum_index":47359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 65.0251 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.143,"smiles":null,"spectrum_id":"CCMSLIB00017313556","spectrum_index":47360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4,5-Trimethoxyphenyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol (delta mass: 32.0417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.191,"smiles":null,"spectrum_id":"CCMSLIB00017313558","spectrum_index":47361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 238.2298 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.316,"smiles":null,"spectrum_id":"CCMSLIB00017313560","spectrum_index":47362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 41.0637 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.139,"smiles":null,"spectrum_id":"CCMSLIB00017313562","spectrum_index":47363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 100.0314 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.18,"smiles":null,"spectrum_id":"CCMSLIB00017313564","spectrum_index":47364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 16.1004 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.187,"smiles":null,"spectrum_id":"CCMSLIB00017313566","spectrum_index":47365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000511 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 16.0809 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.152,"smiles":null,"spectrum_id":"CCMSLIB00017313568","spectrum_index":47366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 131.9939 Da; putative annotation: N/A; putative formula: C2H4N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.096,"smiles":null,"spectrum_id":"CCMSLIB00017313570","spectrum_index":47367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 48.0249 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.2,"smiles":null,"spectrum_id":"CCMSLIB00017313571","spectrum_index":47368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 129.0937 Da; putative annotation: N/A; putative formula: C10H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.18,"smiles":null,"spectrum_id":"CCMSLIB00017313573","spectrum_index":47369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 70.053 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.129,"smiles":null,"spectrum_id":"CCMSLIB00017313575","spectrum_index":47370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 154.0995 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.149,"smiles":null,"spectrum_id":"CCMSLIB00017313577","spectrum_index":47371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 68.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.059,"smiles":null,"spectrum_id":"CCMSLIB00017313579","spectrum_index":47372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-isoleucine (delta mass: 116.0476 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.144,"smiles":null,"spectrum_id":"CCMSLIB00017313581","spectrum_index":47373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 56.9962 Da; putative annotation: N/A; putative formula: H-1N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.093,"smiles":null,"spectrum_id":"CCMSLIB00017313583","spectrum_index":47374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 17.0253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.254,"smiles":null,"spectrum_id":"CCMSLIB00017313585","spectrum_index":47375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Hydroxywarfarin (delta mass: 146.0582 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.165,"smiles":null,"spectrum_id":"CCMSLIB00017313587","spectrum_index":47376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 198.1623 Da; putative annotation: N/A; putative formula: C12H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.202,"smiles":null,"spectrum_id":"CCMSLIB00017313589","spectrum_index":47377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1049.6108 Da; putative annotation: N/A; putative formula: C48H87N7O18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1271.71,"smiles":null,"spectrum_id":"CCMSLIB00017313591","spectrum_index":47378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 58.0777 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.127,"smiles":null,"spectrum_id":"CCMSLIB00017313593","spectrum_index":47379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 84.9646 Da; putative annotation: N/A; putative formula: C2HNO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.144,"smiles":null,"spectrum_id":"CCMSLIB00017313595","spectrum_index":47380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reticuline (delta mass: 44.0257 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.196,"smiles":null,"spectrum_id":"CCMSLIB00017313596","spectrum_index":47381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 292.1292 Da; putative annotation: N/A; putative formula: C13H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.197,"smiles":null,"spectrum_id":"CCMSLIB00017313598","spectrum_index":47382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 64.0667 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.357,"smiles":null,"spectrum_id":"CCMSLIB00017313600","spectrum_index":47383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 71.0733 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.113,"smiles":null,"spectrum_id":"CCMSLIB00017313602","spectrum_index":47384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 181.9483 Da; putative annotation: N/A; putative formula: C7H2O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.013,"smiles":null,"spectrum_id":"CCMSLIB00017313604","spectrum_index":47385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 583.2637 Da; putative annotation: N/A; putative formula: C29H45NO7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.35,"smiles":null,"spectrum_id":"CCMSLIB00017313606","spectrum_index":47386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 84.057 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.294,"smiles":null,"spectrum_id":"CCMSLIB00017313608","spectrum_index":47387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 30.0 eV (delta mass: 305.2583 Da; putative annotation: N/A; putative formula: C17H31N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.36,"smiles":null,"spectrum_id":"CCMSLIB00017313610","spectrum_index":47388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 90.0315 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.191,"smiles":null,"spectrum_id":"CCMSLIB00017313612","spectrum_index":47389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 113.0836 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.154,"smiles":null,"spectrum_id":"CCMSLIB00017313614","spectrum_index":47390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aniline (delta mass: 41.0132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.078,"smiles":null,"spectrum_id":"CCMSLIB00017313616","spectrum_index":47391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 39.047 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017313617","spectrum_index":47392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 99.0744 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.166,"smiles":null,"spectrum_id":"CCMSLIB00017313619","spectrum_index":47393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PM018176 Spermidine-di-p-coumaroyl (delta mass: 162.0528 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.292,"smiles":null,"spectrum_id":"CCMSLIB00017313621","spectrum_index":47394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 118.042 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.186,"smiles":null,"spectrum_id":"CCMSLIB00017313623","spectrum_index":47395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HAPLAMINE CollisionEnergy:102040 (delta mass: 43.0064 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.119,"smiles":null,"spectrum_id":"CCMSLIB00017313625","spectrum_index":47396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 137.05 Da; putative annotation: N/A; putative formula: C6H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.2,"smiles":null,"spectrum_id":"CCMSLIB00017313627","spectrum_index":47397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 82.0421 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017313629","spectrum_index":47398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 51.0274 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.077,"smiles":null,"spectrum_id":"CCMSLIB00017313630","spectrum_index":47399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 411.36 Da; putative annotation: N/A; putative formula: C27H45N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.451,"smiles":null,"spectrum_id":"CCMSLIB00017313632","spectrum_index":47400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 46.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017313634","spectrum_index":47401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 254.1311 Da; putative annotation: 2,6-Dihydroxy-1,1,7-trimethyl-2,9,10,10a-tetrahydrophenanthren-3-one; putative formula: C17H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.202,"smiles":null,"spectrum_id":"CCMSLIB00017313636","spectrum_index":47402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 151.0624 Da; putative annotation: 5-Hydroxydopamine; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.149,"smiles":null,"spectrum_id":"CCMSLIB00017313637","spectrum_index":47403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 128.0585 Da; putative annotation: GLUTAMINE; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.145,"smiles":null,"spectrum_id":"CCMSLIB00017313639","spectrum_index":47404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 50.0 eV (delta mass: 138.0315 Da; putative annotation: 2-(Hydroxymethyl)-5-methoxy-4H-pyran-4-one; putative formula: C7H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.107,"smiles":null,"spectrum_id":"CCMSLIB00017313641","spectrum_index":47405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ser (delta mass: 113.0849 Da; putative annotation: 1747371 - 40.0 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.203,"smiles":null,"spectrum_id":"CCMSLIB00017313643","spectrum_index":47406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of Naphthoresorcinol (delta mass: 180.0775 Da; putative annotation: \"\"3-(4'Hydrooxy-3'-methoxyphenyl)-1,3-diol\"\"; putative formula: C10H12O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.137,"smiles":null,"spectrum_id":"CCMSLIB00017313645","spectrum_index":47407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 134.0574 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.206,"smiles":null,"spectrum_id":"CCMSLIB00017313647","spectrum_index":47408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 330.2045 Da; putative annotation: N/A; putative formula: C17H30O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.29,"smiles":null,"spectrum_id":"CCMSLIB00017313649","spectrum_index":47409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Pro (delta mass: 172.0853 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.251,"smiles":null,"spectrum_id":"CCMSLIB00017313651","spectrum_index":47410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 577.2219 Da; putative annotation: N/A; putative formula: C27H31N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.282,"smiles":null,"spectrum_id":"CCMSLIB00017313653","spectrum_index":47411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 41.1054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.232,"smiles":null,"spectrum_id":"CCMSLIB00017313655","spectrum_index":47412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 74.037 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.139,"smiles":null,"spectrum_id":"CCMSLIB00017313656","spectrum_index":47413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxybutorphanol (delta mass: 18.968 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.19,"smiles":null,"spectrum_id":"CCMSLIB00017313658","spectrum_index":47414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 50.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017313660","spectrum_index":47415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 167.0584 Da; putative annotation: N/A; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.113,"smiles":null,"spectrum_id":"CCMSLIB00017313662","spectrum_index":47416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 66.0119 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.125,"smiles":null,"spectrum_id":"CCMSLIB00017313664","spectrum_index":47417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Methyl-1-piperazinyl)butanoic acid (delta mass: 117.0433 Da; putative annotation: N/A; putative formula: C5H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.187,"smiles":null,"spectrum_id":"CCMSLIB00017313666","spectrum_index":47418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 33.9905 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.056,"smiles":null,"spectrum_id":"CCMSLIB00017313668","spectrum_index":47419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 375.179 Da; putative annotation: N/A; putative formula: C19H25N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.245,"smiles":null,"spectrum_id":"CCMSLIB00017313670","spectrum_index":47420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 408.2009 Da; putative annotation: N/A; putative formula: C19H28N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.266,"smiles":null,"spectrum_id":"CCMSLIB00017313672","spectrum_index":47421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 127.0947 Da; putative annotation: N/A; putative formula: C3H9N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.142,"smiles":null,"spectrum_id":"CCMSLIB00017313674","spectrum_index":47422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 176.0467 Da; putative annotation: N/A; putative formula: C4H9N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.159,"smiles":null,"spectrum_id":"CCMSLIB00017313676","spectrum_index":47423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 136.0736 Da; putative annotation: N/A; putative formula: C6H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.165,"smiles":null,"spectrum_id":"CCMSLIB00017313677","spectrum_index":47424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 58.0531 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.113,"smiles":null,"spectrum_id":"CCMSLIB00017313679","spectrum_index":47425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 738.5215 Da; putative annotation: N/A; putative formula: C46H62N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1069.68,"smiles":null,"spectrum_id":"CCMSLIB00017313681","spectrum_index":47426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 82.8369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.939,"smiles":null,"spectrum_id":"CCMSLIB00017313683","spectrum_index":47427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 655.2809 Da; putative annotation: N/A; putative formula: C27H49N3O11S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":970.44,"smiles":null,"spectrum_id":"CCMSLIB00017313685","spectrum_index":47428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 180.1268 Da; putative annotation: N/A; putative formula: C10H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.213,"smiles":null,"spectrum_id":"CCMSLIB00017313687","spectrum_index":47429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-(3S)-3-Hydroxyquinine (delta mass: 239.0822 Da; putative annotation: N/A; putative formula: C10H14N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.268,"smiles":null,"spectrum_id":"CCMSLIB00017313688","spectrum_index":47430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00160238-01!RIBALININE (delta mass: 162.0565 Da; putative annotation: N/A; putative formula: C5H11N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.185,"smiles":null,"spectrum_id":"CCMSLIB00017313690","spectrum_index":47431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 459.3143 Da; putative annotation: N/A; putative formula: C24H41N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.405,"smiles":null,"spectrum_id":"CCMSLIB00017313692","spectrum_index":47432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 50.027 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.176,"smiles":null,"spectrum_id":"CCMSLIB00017313694","spectrum_index":47433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 331.2712 Da; putative annotation: N/A; putative formula: C18H37NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.283,"smiles":null,"spectrum_id":"CCMSLIB00017313696","spectrum_index":47434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 97.0344 Da; putative annotation: N/A; putative formula: C5H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.184,"smiles":null,"spectrum_id":"CCMSLIB00017313698","spectrum_index":47435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 326.149 Da; putative annotation: N/A; putative formula: C16H18N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.22,"smiles":null,"spectrum_id":"CCMSLIB00017313700","spectrum_index":47436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 545.346 Da; putative annotation: N/A; putative formula: C32H52NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.515,"smiles":null,"spectrum_id":"CCMSLIB00017313702","spectrum_index":47437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1H-Benzimidazol-2-ylsulfanyl)furan--2-carbaldehyde (delta mass: 236.0962 Da; putative annotation: N/A; putative formula: C13H17O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.134,"smiles":null,"spectrum_id":"CCMSLIB00017313704","spectrum_index":47438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 160.0997 Da; putative annotation: N/A; putative formula: C10H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.16,"smiles":null,"spectrum_id":"CCMSLIB00017313706","spectrum_index":47439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 90.0465 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.144,"smiles":null,"spectrum_id":"CCMSLIB00017313708","spectrum_index":47440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 146.077 Da; putative annotation: N/A; putative formula: C7H14OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.137,"smiles":null,"spectrum_id":"CCMSLIB00017313709","spectrum_index":47441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 144.1153 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.274,"smiles":null,"spectrum_id":"CCMSLIB00017313711","spectrum_index":47442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 52.9897 Da; putative annotation: N/A; putative formula: C2H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.065,"smiles":null,"spectrum_id":"CCMSLIB00017313713","spectrum_index":47443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 223.0943 Da; putative annotation: N/A; putative formula: C12H18NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.175,"smiles":null,"spectrum_id":"CCMSLIB00017313715","spectrum_index":47444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Piperazinyl)-1H-indole (delta mass: 44.061 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.195,"smiles":null,"spectrum_id":"CCMSLIB00017313717","spectrum_index":47445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phenol, 4-(2-aminoethyl)- from NIST14 (delta mass: 156.1953 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.287,"smiles":null,"spectrum_id":"CCMSLIB00017313719","spectrum_index":47446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT106523 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole|2-(4-methyl-1,3-thiazol-5-yl)ethanol (delta mass: 4.9281 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.976,"smiles":null,"spectrum_id":"CCMSLIB00017313721","spectrum_index":47447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 35.035 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.095,"smiles":null,"spectrum_id":"CCMSLIB00017313722","spectrum_index":47448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 118.0595 Da; putative annotation: N/A; putative formula: CH6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.118,"smiles":null,"spectrum_id":"CCMSLIB00017313724","spectrum_index":47449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pergolide sulfoxide (delta mass: 311.196 Da; putative annotation: N/A; putative formula: C14H25N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.38,"smiles":null,"spectrum_id":"CCMSLIB00017313726","spectrum_index":47450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 157.0373 Da; putative annotation: N/A; putative formula: C6H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.139,"smiles":null,"spectrum_id":"CCMSLIB00017313728","spectrum_index":47451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 97.0616 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.102,"smiles":null,"spectrum_id":"CCMSLIB00017313730","spectrum_index":47452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(8-Chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethanone (delta mass: 77.0229 Da; putative annotation: N/A; putative formula: H3N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.102,"smiles":null,"spectrum_id":"CCMSLIB00017313732","spectrum_index":47453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rupicolin (sordidone) (delta mass: 18.0161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.042,"smiles":null,"spectrum_id":"CCMSLIB00017313734","spectrum_index":47454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 213.0637 Da; putative annotation: N/A; putative formula: C9H11NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.098,"smiles":null,"spectrum_id":"CCMSLIB00017313736","spectrum_index":47455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 16.0342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.131,"smiles":null,"spectrum_id":"CCMSLIB00017313738","spectrum_index":47456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(4-Fluorophenoxy)phenyl]-N-methylmethanamine (delta mass: 29.0488 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.162,"smiles":null,"spectrum_id":"CCMSLIB00017313739","spectrum_index":47457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 30.996 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.067,"smiles":null,"spectrum_id":"CCMSLIB00017313741","spectrum_index":47458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 16.3765 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.5,"smiles":null,"spectrum_id":"CCMSLIB00017313743","spectrum_index":47459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 196.1185 Da; putative annotation: N/A; putative formula: C6H12N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.252,"smiles":null,"spectrum_id":"CCMSLIB00017313745","spectrum_index":47460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 82.0265 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.186,"smiles":null,"spectrum_id":"CCMSLIB00017313747","spectrum_index":47461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Fluoro-2,3-dihydro-1H-indole (delta mass: 8.009 Da; putative annotation: N/A; putative formula: C2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.08,"smiles":null,"spectrum_id":"CCMSLIB00017313749","spectrum_index":47462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 76.031 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.133,"smiles":null,"spectrum_id":"CCMSLIB00017313750","spectrum_index":47463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]cyclopropanecarboxamide (delta mass: 46.0086 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.153,"smiles":null,"spectrum_id":"CCMSLIB00017313752","spectrum_index":47464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 657.5953 Da; putative annotation: N/A; putative formula: C37H79N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.667,"smiles":null,"spectrum_id":"CCMSLIB00017313754","spectrum_index":47465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 404.1505 Da; putative annotation: N/A; putative formula: C18H28O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":748.336,"smiles":null,"spectrum_id":"CCMSLIB00017313756","spectrum_index":47466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 88.0528 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.113,"smiles":null,"spectrum_id":"CCMSLIB00017313758","spectrum_index":47467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(9H-Carbazol-9-yl)propanoic acid (delta mass: 102.143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.245,"smiles":null,"spectrum_id":"CCMSLIB00017313760","spectrum_index":47468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 203.1154 Da; putative annotation: N/A; putative formula: C9H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.181,"smiles":null,"spectrum_id":"CCMSLIB00017313762","spectrum_index":47469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 79.0419 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.155,"smiles":null,"spectrum_id":"CCMSLIB00017313764","spectrum_index":47470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylphenethylamine (delta mass: 16.0337 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.183,"smiles":null,"spectrum_id":"CCMSLIB00017313765","spectrum_index":47471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 638.2228 Da; putative annotation: N/A; putative formula: C34H35N6O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.32,"smiles":null,"spectrum_id":"CCMSLIB00017313767","spectrum_index":47472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ureidopropionic acid (delta mass: 28.9992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.06,"smiles":null,"spectrum_id":"CCMSLIB00017313769","spectrum_index":47473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 440.1155 Da; putative annotation: N/A; putative formula: C21H20N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.233,"smiles":null,"spectrum_id":"CCMSLIB00017313771","spectrum_index":47474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-hydroxy-1,7-diphenylhept-1-en-3-one (delta mass: 217.2097 Da; putative annotation: N/A; putative formula: C7H23N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.363,"smiles":null,"spectrum_id":"CCMSLIB00017313773","spectrum_index":47475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Glycolylneuraminic acid (delta mass: 194.1202 Da; putative annotation: N/A; putative formula: C14H14N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.228,"smiles":null,"spectrum_id":"CCMSLIB00017313775","spectrum_index":47476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 36.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.108,"smiles":null,"spectrum_id":"CCMSLIB00017313777","spectrum_index":47477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 64.0625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.144,"smiles":null,"spectrum_id":"CCMSLIB00017313779","spectrum_index":47478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 221.153 Da; putative annotation: N/A; putative formula: C12H19N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.266,"smiles":null,"spectrum_id":"CCMSLIB00017313781","spectrum_index":47479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 2.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.202,"smiles":null,"spectrum_id":"CCMSLIB00017313782","spectrum_index":47480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chloromonilinic acid B (delta mass: 14.0162 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.059,"smiles":null,"spectrum_id":"CCMSLIB00017313784","spectrum_index":47481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.065,"smiles":null,"spectrum_id":"CCMSLIB00017313786","spectrum_index":47482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 160.0525 Da; putative annotation: N/A; putative formula: C10H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.201,"smiles":null,"spectrum_id":"CCMSLIB00017313788","spectrum_index":47483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380224-01!1,7-bis(3,4-dihydroxyphenyl)-6-methoxyheptan-3-one (delta mass: 274.0627 Da; putative annotation: N/A; putative formula: C18H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.227,"smiles":null,"spectrum_id":"CCMSLIB00017313790","spectrum_index":47484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxy-3,5-dimethoxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 194.0913 Da; putative annotation: N/A; putative formula: C7H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.199,"smiles":null,"spectrum_id":"CCMSLIB00017313792","spectrum_index":47485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 321.0713 Da; putative annotation: N/A; putative formula: C13H23NS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.158,"smiles":null,"spectrum_id":"CCMSLIB00017313794","spectrum_index":47486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 642.1942 Da; putative annotation: N/A; putative formula: C45H26N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":805.254,"smiles":null,"spectrum_id":"CCMSLIB00017313796","spectrum_index":47487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 32.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.144,"smiles":null,"spectrum_id":"CCMSLIB00017313798","spectrum_index":47488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 55.0182 Da; putative annotation: N/A; putative formula: CHN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.105,"smiles":null,"spectrum_id":"CCMSLIB00017313800","spectrum_index":47489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 102.0831 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.258,"smiles":null,"spectrum_id":"CCMSLIB00017313802","spectrum_index":47490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 91.9939 Da; putative annotation: N/A; putative formula: C2H6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.065,"smiles":null,"spectrum_id":"CCMSLIB00017313804","spectrum_index":47491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 329.1271 Da; putative annotation: N/A; putative formula: C11H19N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.239,"smiles":null,"spectrum_id":"CCMSLIB00017313806","spectrum_index":47492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,7,8-trimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 116.193 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.3,"smiles":null,"spectrum_id":"CCMSLIB00017313808","spectrum_index":47493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 74.0253 Da; putative annotation: N/A; putative formula: C5H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017313810","spectrum_index":47494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yohimbic acid (delta mass: 380.1727 Da; putative annotation: N/A; putative formula: C22H24N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.359,"smiles":null,"spectrum_id":"CCMSLIB00017313812","spectrum_index":47495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paxilline (delta mass: 25.8976 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.146,"smiles":null,"spectrum_id":"CCMSLIB00017313814","spectrum_index":47496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 145.0373 Da; putative annotation: N/A; putative formula: C5H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.124,"smiles":null,"spectrum_id":"CCMSLIB00017313815","spectrum_index":47497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melatonin - 30.0 eV (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.197,"smiles":null,"spectrum_id":"CCMSLIB00017313817","spectrum_index":47498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 71.0372 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.134,"smiles":null,"spectrum_id":"CCMSLIB00017313819","spectrum_index":47499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Met (delta mass: 55.0378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.144,"smiles":null,"spectrum_id":"CCMSLIB00017313821","spectrum_index":47500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 276.1234 Da; putative annotation: N/A; putative formula: C14H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.215,"smiles":null,"spectrum_id":"CCMSLIB00017313823","spectrum_index":47501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 162.0523 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.139,"smiles":null,"spectrum_id":"CCMSLIB00017313825","spectrum_index":47502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of eserine (delta mass: 28.09 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.261,"smiles":null,"spectrum_id":"CCMSLIB00017313827","spectrum_index":47503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 220.2189 Da; putative annotation: N/A; putative formula: C16H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.342,"smiles":null,"spectrum_id":"CCMSLIB00017313829","spectrum_index":47504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 272.9788 Da; putative annotation: N/A; putative formula: C2H9N7OP2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.02,"smiles":null,"spectrum_id":"CCMSLIB00017313830","spectrum_index":47505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Pro (delta mass: 168.0534 Da; putative annotation: N/A; putative formula: C7H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.156,"smiles":null,"spectrum_id":"CCMSLIB00017313832","spectrum_index":47506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 40.0 eV (delta mass: 62.881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.972,"smiles":null,"spectrum_id":"CCMSLIB00017313834","spectrum_index":47507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 45.01 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017313836","spectrum_index":47508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 340.309 Da; putative annotation: N/A; putative formula: C20H40N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.369,"smiles":null,"spectrum_id":"CCMSLIB00017313838","spectrum_index":47509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1-octanamine (delta mass: 256.2384 Da; putative annotation: N/A; putative formula: C12H28N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.46,"smiles":null,"spectrum_id":"CCMSLIB00017313840","spectrum_index":47510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 180.0421 Da; putative annotation: N/A; putative formula: C9H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.128,"smiles":null,"spectrum_id":"CCMSLIB00017313842","spectrum_index":47511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.113,"smiles":null,"spectrum_id":"CCMSLIB00017313844","spectrum_index":47512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLIC ACID - 60.00 eV (delta mass: 17.445 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017313845","spectrum_index":47513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 158.0732 Da; putative annotation: N/A; putative formula: C11H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.118,"smiles":null,"spectrum_id":"CCMSLIB00017313847","spectrum_index":47514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol CollisionEnergy:102040\"\" (delta mass: 40.9971 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.193,"smiles":null,"spectrum_id":"CCMSLIB00017313849","spectrum_index":47515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 65.063 Da; putative annotation: N/A; putative formula: C5H7NO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017313851","spectrum_index":47516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Glu (delta mass: 224.116 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.198,"smiles":null,"spectrum_id":"CCMSLIB00017313853","spectrum_index":47517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 64.0064 Da; putative annotation: N/A; putative formula: C3N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.118,"smiles":null,"spectrum_id":"CCMSLIB00017313855","spectrum_index":47518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 64.0156 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.195,"smiles":null,"spectrum_id":"CCMSLIB00017313857","spectrum_index":47519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hydroquinidine (delta mass: 73.0092 Da; putative annotation: N/A; putative formula: CH3N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.216,"smiles":null,"spectrum_id":"CCMSLIB00017313859","spectrum_index":47520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Longicaulenone (delta mass: 189.1002 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.228,"smiles":null,"spectrum_id":"CCMSLIB00017313861","spectrum_index":47521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ARABITOL (delta mass: 156.862 Da; putative annotation: N/A; putative formula: H-1NO-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.938,"smiles":null,"spectrum_id":"CCMSLIB00017313862","spectrum_index":47522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 183.8552 Da; putative annotation: N/A; putative formula: CHO-1P5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.931,"smiles":null,"spectrum_id":"CCMSLIB00017313864","spectrum_index":47523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 533.2133 Da; putative annotation: N/A; putative formula: C25H27N9O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.3,"smiles":null,"spectrum_id":"CCMSLIB00017313866","spectrum_index":47524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Heptyl-4-hydroxyquinoline N-oxide (delta mass: 16.0669 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.231,"smiles":null,"spectrum_id":"CCMSLIB00017313868","spectrum_index":47525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 131.0781 Da; putative annotation: N/A; putative formula: C6H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.145,"smiles":null,"spectrum_id":"CCMSLIB00017313870","spectrum_index":47526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 79.0738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.139,"smiles":null,"spectrum_id":"CCMSLIB00017313872","spectrum_index":47527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 18.0316 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.207,"smiles":null,"spectrum_id":"CCMSLIB00017313874","spectrum_index":47528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1107.6683 Da; putative annotation: N/A; putative formula: C55H93N7O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1270.73,"smiles":null,"spectrum_id":"CCMSLIB00017313876","spectrum_index":47529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Ser (delta mass: 55.0461 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.18,"smiles":null,"spectrum_id":"CCMSLIB00017313878","spectrum_index":47530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 125.0823 Da; putative annotation: N/A; putative formula: C3H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.232,"smiles":null,"spectrum_id":"CCMSLIB00017313880","spectrum_index":47531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 125.0728 Da; putative annotation: N/A; putative formula: C4H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017313882","spectrum_index":47532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 55.006 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.103,"smiles":null,"spectrum_id":"CCMSLIB00017313884","spectrum_index":47533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 208.0847 Da; putative annotation: N/A; putative formula: C10H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.181,"smiles":null,"spectrum_id":"CCMSLIB00017313886","spectrum_index":47534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 256.1155 Da; putative annotation: N/A; putative formula: C14H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.238,"smiles":null,"spectrum_id":"CCMSLIB00017313888","spectrum_index":47535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 239.062 Da; putative annotation: N/A; putative formula: C11H13NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.13,"smiles":null,"spectrum_id":"CCMSLIB00017313889","spectrum_index":47536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 341.2936 Da; putative annotation: N/A; putative formula: C20H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.479,"smiles":null,"spectrum_id":"CCMSLIB00017313891","spectrum_index":47537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 212.0685 Da; putative annotation: N/A; putative formula: C10H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.139,"smiles":null,"spectrum_id":"CCMSLIB00017313893","spectrum_index":47538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 9.094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.253,"smiles":null,"spectrum_id":"CCMSLIB00017313895","spectrum_index":47539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 238.2331 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.272,"smiles":null,"spectrum_id":"CCMSLIB00017313897","spectrum_index":47540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 102.0681 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.217,"smiles":null,"spectrum_id":"CCMSLIB00017313899","spectrum_index":47541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dichloro-1H-indole-2-carboxylic acid (delta mass: 51.021 Da; putative annotation: N/A; putative formula: C2HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.998,"smiles":null,"spectrum_id":"CCMSLIB00017313901","spectrum_index":47542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 89.0709 Da; putative annotation: N/A; putative formula: CH7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.131,"smiles":null,"spectrum_id":"CCMSLIB00017313903","spectrum_index":47543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 104.0991 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.238,"smiles":null,"spectrum_id":"CCMSLIB00017313905","spectrum_index":47544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 111.0321 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017313907","spectrum_index":47545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 308.2867 Da; putative annotation: N/A; putative formula: C24H36O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.347,"smiles":null,"spectrum_id":"CCMSLIB00017313908","spectrum_index":47546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 380.0901 Da; putative annotation: N/A; putative formula: C6H12N12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.15,"smiles":null,"spectrum_id":"CCMSLIB00017313910","spectrum_index":47547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 366.3022 Da; putative annotation: N/A; putative formula: C25H38N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.393,"smiles":null,"spectrum_id":"CCMSLIB00017313912","spectrum_index":47548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 148.0525 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.108,"smiles":null,"spectrum_id":"CCMSLIB00017313914","spectrum_index":47549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 56.9966 Da; putative annotation: N/A; putative formula: H-1N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.077,"smiles":null,"spectrum_id":"CCMSLIB00017313916","spectrum_index":47550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 53.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.165,"smiles":null,"spectrum_id":"CCMSLIB00017313918","spectrum_index":47551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 338.2923 Da; putative annotation: N/A; putative formula: C20H38N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.405,"smiles":null,"spectrum_id":"CCMSLIB00017313920","spectrum_index":47552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 162.0212 Da; putative annotation: 6-Fluoro-1H-indazole-3-carboxylic acid; putative formula: C8H3FN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.092,"smiles":null,"spectrum_id":"CCMSLIB00017313922","spectrum_index":47553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 119.0372 Da; putative annotation: Massbank:RP011501 Anthranilic acid|2-azaniumylbenzoate; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.113,"smiles":null,"spectrum_id":"CCMSLIB00017313924","spectrum_index":47554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 268.0368 Da; putative annotation: 6-Chloropurine riboside CollisionEnergy:102040; putative formula: C10H9ClN4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.097,"smiles":null,"spectrum_id":"CCMSLIB00017313926","spectrum_index":47555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 94.0057 Da; putative annotation: 3-Furancarboxylic acid; putative formula: C5H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.045,"smiles":null,"spectrum_id":"CCMSLIB00017313927","spectrum_index":47556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 133.0533 Da; putative annotation: Massbank:AU276703 Acetaminophen|N-(4-hydroxyphenyl)acetamide; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.118,"smiles":null,"spectrum_id":"CCMSLIB00017313929","spectrum_index":47557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 125.0844 Da; putative annotation: 1-Methylpiperidine-3-carboxylic acid; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.145,"smiles":null,"spectrum_id":"CCMSLIB00017313931","spectrum_index":47558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 184.0193 Da; putative annotation: Xanthotoxol; putative formula: C11H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.09,"smiles":null,"spectrum_id":"CCMSLIB00017313933","spectrum_index":47559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2.alpha.-Mannobiose from NIST14 (delta mass: 309.1228 Da; putative annotation: Massbank:PR310826 N-Fructosyl phenylalanine; putative formula: C15H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.246,"smiles":null,"spectrum_id":"CCMSLIB00017313935","spectrum_index":47560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 117.0419 Da; putative annotation: ADENINE - 70.0 eV; putative formula: C5H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.113,"smiles":null,"spectrum_id":"CCMSLIB00017313937","spectrum_index":47561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 113.0836 Da; putative annotation: L-ISOLEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.154,"smiles":null,"spectrum_id":"CCMSLIB00017313939","spectrum_index":47562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 116.0837 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017313941","spectrum_index":47563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentamethylene bisacetamide (delta mass: 27.9742 Da; putative annotation: N/A; putative formula: CO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.118,"smiles":null,"spectrum_id":"CCMSLIB00017313942","spectrum_index":47564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 53.0605 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.179,"smiles":null,"spectrum_id":"CCMSLIB00017313944","spectrum_index":47565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 265.1156 Da; putative annotation: N/A; putative formula: C10H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.212,"smiles":null,"spectrum_id":"CCMSLIB00017313946","spectrum_index":47566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 39.0553 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017313948","spectrum_index":47567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 27.0001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.123,"smiles":null,"spectrum_id":"CCMSLIB00017313950","spectrum_index":47568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 161.048 Da; putative annotation: N/A; putative formula: C9H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.234,"smiles":null,"spectrum_id":"CCMSLIB00017313952","spectrum_index":47569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 96.0216 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.186,"smiles":null,"spectrum_id":"CCMSLIB00017313954","spectrum_index":47570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(1H-Indol-5-yl)ethanone (delta mass: 15.9943 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.07,"smiles":null,"spectrum_id":"CCMSLIB00017313956","spectrum_index":47571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 458.3741 Da; putative annotation: N/A; putative formula: C30H50O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1431.7,"smiles":null,"spectrum_id":"CCMSLIB00017313958","spectrum_index":47572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 211.1212 Da; putative annotation: N/A; putative formula: C11H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.197,"smiles":null,"spectrum_id":"CCMSLIB00017313959","spectrum_index":47573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-2-[(dimethylamino)methyl]phenol (delta mass: 63.0766 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.145,"smiles":null,"spectrum_id":"CCMSLIB00017313961","spectrum_index":47574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 226.0903 Da; putative annotation: N/A; putative formula: C17H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.145,"smiles":null,"spectrum_id":"CCMSLIB00017313963","spectrum_index":47575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 70.0591 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.239,"smiles":null,"spectrum_id":"CCMSLIB00017313965","spectrum_index":47576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 291.1471 Da; putative annotation: N/A; putative formula: C16H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.223,"smiles":null,"spectrum_id":"CCMSLIB00017313967","spectrum_index":47577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 99.0655 Da; putative annotation: N/A; putative formula: CH5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.21,"smiles":null,"spectrum_id":"CCMSLIB00017313969","spectrum_index":47578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 59.0827 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.158,"smiles":null,"spectrum_id":"CCMSLIB00017313971","spectrum_index":47579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ARABITOL (delta mass: 178.0629 Da; putative annotation: N/A; putative formula: C10H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.139,"smiles":null,"spectrum_id":"CCMSLIB00017313973","spectrum_index":47580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 527.2361 Da; putative annotation: N/A; putative formula: C38H29N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.339,"smiles":null,"spectrum_id":"CCMSLIB00017313975","spectrum_index":47581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Fluoro-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 162.1092 Da; putative annotation: N/A; putative formula: CH10N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.207,"smiles":null,"spectrum_id":"CCMSLIB00017313976","spectrum_index":47582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 7.9297 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.047,"smiles":null,"spectrum_id":"CCMSLIB00017313978","spectrum_index":47583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 12.0735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.144,"smiles":null,"spectrum_id":"CCMSLIB00017313980","spectrum_index":47584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 86.0838 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.149,"smiles":null,"spectrum_id":"CCMSLIB00017313982","spectrum_index":47585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 149.0122 Da; putative annotation: N/A; putative formula: H3N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.055,"smiles":null,"spectrum_id":"CCMSLIB00017313984","spectrum_index":47586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 17.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.145,"smiles":null,"spectrum_id":"CCMSLIB00017313986","spectrum_index":47587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 282.1781 Da; putative annotation: N/A; putative formula: C15H28N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.254,"smiles":null,"spectrum_id":"CCMSLIB00017313988","spectrum_index":47588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 190.0954 Da; putative annotation: N/A; putative formula: C7H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.244,"smiles":null,"spectrum_id":"CCMSLIB00017313990","spectrum_index":47589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 107.0537 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.213,"smiles":null,"spectrum_id":"CCMSLIB00017313991","spectrum_index":47590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 194.0856 Da; putative annotation: N/A; putative formula: C11H15OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.224,"smiles":null,"spectrum_id":"CCMSLIB00017313993","spectrum_index":47591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 125.085 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.19,"smiles":null,"spectrum_id":"CCMSLIB00017313995","spectrum_index":47592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 415.2472 Da; putative annotation: N/A; putative formula: C23H33N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.355,"smiles":null,"spectrum_id":"CCMSLIB00017313997","spectrum_index":47593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 129.0422 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.113,"smiles":null,"spectrum_id":"CCMSLIB00017313999","spectrum_index":47594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 143.0706 Da; putative annotation: N/A; putative formula: C5H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.172,"smiles":null,"spectrum_id":"CCMSLIB00017314001","spectrum_index":47595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dimethyl-1H-benzimidazole-2-thiol (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.074,"smiles":null,"spectrum_id":"CCMSLIB00017314002","spectrum_index":47596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 232.1658 Da; putative annotation: N/A; putative formula: C16H24O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.225,"smiles":null,"spectrum_id":"CCMSLIB00017314004","spectrum_index":47597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 38.0517 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.117,"smiles":null,"spectrum_id":"CCMSLIB00017314006","spectrum_index":47598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-3-pyridazinol (delta mass: 179.0665 Da; putative annotation: N/A; putative formula: C4H5N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.122,"smiles":null,"spectrum_id":"CCMSLIB00017314008","spectrum_index":47599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 204.063 Da; putative annotation: N/A; putative formula: C8H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.16,"smiles":null,"spectrum_id":"CCMSLIB00017314010","spectrum_index":47600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 174.0155 Da; putative annotation: N/A; putative formula: C10H8O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.118,"smiles":null,"spectrum_id":"CCMSLIB00017314012","spectrum_index":47601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cephalotaxine (delta mass: 64.0887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.243,"smiles":null,"spectrum_id":"CCMSLIB00017314014","spectrum_index":47602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 26.0167 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.103,"smiles":null,"spectrum_id":"CCMSLIB00017314016","spectrum_index":47603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 86.0476 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.171,"smiles":null,"spectrum_id":"CCMSLIB00017314018","spectrum_index":47604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 393.1912 Da; putative annotation: N/A; putative formula: C20H23N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.245,"smiles":null,"spectrum_id":"CCMSLIB00017314020","spectrum_index":47605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (delta mass: 308.1091 Da; putative annotation: N/A; putative formula: C17H24O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.253,"smiles":null,"spectrum_id":"CCMSLIB00017314021","spectrum_index":47606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 338.2225 Da; putative annotation: N/A; putative formula: C19H26N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.335,"smiles":null,"spectrum_id":"CCMSLIB00017314023","spectrum_index":47607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 55.0416 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.138,"smiles":null,"spectrum_id":"CCMSLIB00017314025","spectrum_index":47608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 301.9569 Da; putative annotation: N/A; putative formula: C11H10O2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.091,"smiles":null,"spectrum_id":"CCMSLIB00017314027","spectrum_index":47609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 369.1766 Da; putative annotation: N/A; putative formula: C22H27NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.331,"smiles":null,"spectrum_id":"CCMSLIB00017314029","spectrum_index":47610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 62.0464 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.143,"smiles":null,"spectrum_id":"CCMSLIB00017314031","spectrum_index":47611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-4-(2-thienyl)-3-butyn-2-ol (delta mass: 259.3052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.358,"smiles":null,"spectrum_id":"CCMSLIB00017314033","spectrum_index":47612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 169.123 Da; putative annotation: N/A; putative formula: C8H15N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.23,"smiles":null,"spectrum_id":"CCMSLIB00017314035","spectrum_index":47613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 102.0467 Da; putative annotation: N/A; putative formula: C8H6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017314037","spectrum_index":47614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[(3,4-dimethoxyphenyl)methyl](4-oxo(3-hydrophthalazinyl))carboxamide CollisionEnergy:205060\"\" (delta mass: 32.0246 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.154,"smiles":null,"spectrum_id":"CCMSLIB00017314039","spectrum_index":47615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharman-3-carboxylic acid (delta mass: 337.1303 Da; putative annotation: N/A; putative formula: C14H20N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.243,"smiles":null,"spectrum_id":"CCMSLIB00017314040","spectrum_index":47616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 523.4766 Da; putative annotation: N/A; putative formula: C36H61NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.548,"smiles":null,"spectrum_id":"CCMSLIB00017314042","spectrum_index":47617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 292.1294 Da; putative annotation: N/A; putative formula: C13H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.19,"smiles":null,"spectrum_id":"CCMSLIB00017314044","spectrum_index":47618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 78.054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.141,"smiles":null,"spectrum_id":"CCMSLIB00017314046","spectrum_index":47619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 431.266 Da; putative annotation: N/A; putative formula: C22H29N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.362,"smiles":null,"spectrum_id":"CCMSLIB00017314048","spectrum_index":47620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 73.9437 Da; putative annotation: N/A; putative formula: CH-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.014,"smiles":null,"spectrum_id":"CCMSLIB00017314050","spectrum_index":47621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE-3-ACETIC ACID (delta mass: 160.1104 Da; putative annotation: N/A; putative formula: C8H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.176,"smiles":null,"spectrum_id":"CCMSLIB00017314052","spectrum_index":47622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HYDROQUINIDINE (delta mass: 45.0213 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.228,"smiles":null,"spectrum_id":"CCMSLIB00017314054","spectrum_index":47623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 58.0419 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.102,"smiles":null,"spectrum_id":"CCMSLIB00017314056","spectrum_index":47624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 84.0693 Da; putative annotation: N/A; putative formula: C4H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.123,"smiles":null,"spectrum_id":"CCMSLIB00017314058","spectrum_index":47625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipivefrine (delta mass: 66.0473 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.259,"smiles":null,"spectrum_id":"CCMSLIB00017314060","spectrum_index":47626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 224.1141 Da; putative annotation: N/A; putative formula: C7H12N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.241,"smiles":null,"spectrum_id":"CCMSLIB00017314061","spectrum_index":47627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300441 Emetine (delta mass: 32.0338 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.34,"smiles":null,"spectrum_id":"CCMSLIB00017314063","spectrum_index":47628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 123.0783 Da; putative annotation: N/A; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.149,"smiles":null,"spectrum_id":"CCMSLIB00017314065","spectrum_index":47629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Diaminotoluene (delta mass: 12.0101 Da; putative annotation: N/A; putative formula: N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.102,"smiles":null,"spectrum_id":"CCMSLIB00017314067","spectrum_index":47630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 9.9848 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.108,"smiles":null,"spectrum_id":"CCMSLIB00017314069","spectrum_index":47631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 38.0262 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.133,"smiles":null,"spectrum_id":"CCMSLIB00017314071","spectrum_index":47632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 53.0592 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.14,"smiles":null,"spectrum_id":"CCMSLIB00017314073","spectrum_index":47633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Ser (delta mass: 129.0534 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.198,"smiles":null,"spectrum_id":"CCMSLIB00017314075","spectrum_index":47634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 74.0367 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.123,"smiles":null,"spectrum_id":"CCMSLIB00017314077","spectrum_index":47635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 91.0459 Da; putative annotation: N/A; putative formula: H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.164,"smiles":null,"spectrum_id":"CCMSLIB00017314079","spectrum_index":47636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 428.23 Da; putative annotation: N/A; putative formula: C26H37OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.311,"smiles":null,"spectrum_id":"CCMSLIB00017314081","spectrum_index":47637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1151.3967 Da; putative annotation: N/A; putative formula: C22H49N37O20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1314.46,"smiles":null,"spectrum_id":"CCMSLIB00017314083","spectrum_index":47638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 145.0738 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017314084","spectrum_index":47639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 181.1102 Da; putative annotation: N/A; putative formula: C10H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.213,"smiles":null,"spectrum_id":"CCMSLIB00017314086","spectrum_index":47640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 172.2542 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.351,"smiles":null,"spectrum_id":"CCMSLIB00017314088","spectrum_index":47641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 135.0324 Da; putative annotation: N/A; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.108,"smiles":null,"spectrum_id":"CCMSLIB00017314090","spectrum_index":47642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 125.0492 Da; putative annotation: N/A; putative formula: C5H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.177,"smiles":null,"spectrum_id":"CCMSLIB00017314092","spectrum_index":47643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT200730 D(+)-Galacturonic acid monohydrate|D-galacturonate|(2S,3R,4S,5R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid (delta mass: 36.0363 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.086,"smiles":null,"spectrum_id":"CCMSLIB00017314094","spectrum_index":47644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 84.0576 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.112,"smiles":null,"spectrum_id":"CCMSLIB00017314095","spectrum_index":47645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 43.0196 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.09,"smiles":null,"spectrum_id":"CCMSLIB00017314097","spectrum_index":47646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 448.7456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.869,"smiles":null,"spectrum_id":"CCMSLIB00017314099","spectrum_index":47647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 24.0078 Da; putative annotation: N/A; putative formula: CN2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.05,"smiles":null,"spectrum_id":"CCMSLIB00017314101","spectrum_index":47648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 198.0205 Da; putative annotation: N/A; putative formula: C5H12O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.128,"smiles":null,"spectrum_id":"CCMSLIB00017314103","spectrum_index":47649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 831.3929 Da; putative annotation: N/A; putative formula: C42H49N13O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1162.55,"smiles":null,"spectrum_id":"CCMSLIB00017314104","spectrum_index":47650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 112.0309 Da; putative annotation: N/A; putative formula: C9H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.195,"smiles":null,"spectrum_id":"CCMSLIB00017314106","spectrum_index":47651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 220.0029 Da; putative annotation: N/A; putative formula: C3H6N6O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.084,"smiles":null,"spectrum_id":"CCMSLIB00017314108","spectrum_index":47652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin F (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.274,"smiles":null,"spectrum_id":"CCMSLIB00017314110","spectrum_index":47653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 162.0306 Da; putative annotation: N/A; putative formula: C3H7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.159,"smiles":null,"spectrum_id":"CCMSLIB00017314112","spectrum_index":47654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-hydroxycarbamazepine (delta mass: 117.1252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.238,"smiles":null,"spectrum_id":"CCMSLIB00017314113","spectrum_index":47655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 142.1465 Da; putative annotation: N/A; putative formula: C8H18N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.233,"smiles":null,"spectrum_id":"CCMSLIB00017314115","spectrum_index":47656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 11.0286 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.151,"smiles":null,"spectrum_id":"CCMSLIB00017314117","spectrum_index":47657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 292.2391 Da; putative annotation: N/A; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.325,"smiles":null,"spectrum_id":"CCMSLIB00017314119","spectrum_index":47658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 28.0315 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":130.123,"smiles":null,"spectrum_id":"CCMSLIB00017314121","spectrum_index":47659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 216.0777 Da; putative annotation: N/A; putative formula: C13H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.143,"smiles":null,"spectrum_id":"CCMSLIB00017314123","spectrum_index":47660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 120.0205 Da; putative annotation: N/A; putative formula: CH5N4OP)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.086,"smiles":null,"spectrum_id":"CCMSLIB00017314125","spectrum_index":47661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine propyl ester (delta mass: 71.0422 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.15,"smiles":null,"spectrum_id":"CCMSLIB00017314128","spectrum_index":47662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 293.2379 Da; putative annotation: N/A; putative formula: C17H32N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.324,"smiles":null,"spectrum_id":"CCMSLIB00017314129","spectrum_index":47663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 143.033 Da; putative annotation: N/A; putative formula: C4H5N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.119,"smiles":null,"spectrum_id":"CCMSLIB00017314131","spectrum_index":47664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 30.9978 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.079,"smiles":null,"spectrum_id":"CCMSLIB00017314133","spectrum_index":47665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (1S,2S,16E)-16-ethylidene-2-(hydroxymethyl)-4,14-diazatetracyclo[12.2.2.0,.0?,?]octadeca-3(11),5,7,9-tetraene-2-carboxylate (delta mass: 348.1477 Da; putative annotation: N/A; putative formula: C21H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.349,"smiles":null,"spectrum_id":"CCMSLIB00017314135","spectrum_index":47666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 76.0677 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.243,"smiles":null,"spectrum_id":"CCMSLIB00017314137","spectrum_index":47667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 312.2091 Da; putative annotation: N/A; putative formula: C21H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.28,"smiles":null,"spectrum_id":"CCMSLIB00017314139","spectrum_index":47668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 145.8971 Da; putative annotation: N/A; putative formula: C3H-2OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.983,"smiles":null,"spectrum_id":"CCMSLIB00017314141","spectrum_index":47669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 270.0526 Da; putative annotation: N/A; putative formula: C15H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.128,"smiles":null,"spectrum_id":"CCMSLIB00017314143","spectrum_index":47670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE10; MS2Dec (delta mass: 69.0222 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.083,"smiles":null,"spectrum_id":"CCMSLIB00017314145","spectrum_index":47671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 168.0723 Da; putative annotation: N/A; putative formula: C8H12N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.137,"smiles":null,"spectrum_id":"CCMSLIB00017314147","spectrum_index":47672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 173.0511 Da; putative annotation: N/A; putative formula: C7H11NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.153,"smiles":null,"spectrum_id":"CCMSLIB00017314149","spectrum_index":47673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 176.0274 Da; putative annotation: N/A; putative formula: C6H4N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.129,"smiles":null,"spectrum_id":"CCMSLIB00017314151","spectrum_index":47674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004503 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 128.0196 Da; putative annotation: N/A; putative formula: N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.116,"smiles":null,"spectrum_id":"CCMSLIB00017314153","spectrum_index":47675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 33.0357 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.143,"smiles":null,"spectrum_id":"CCMSLIB00017314154","spectrum_index":47676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-(methylsulfanyl)-1H-indole-2-carboxylate (delta mass: 149.0893 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.148,"smiles":null,"spectrum_id":"CCMSLIB00017314156","spectrum_index":47677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 137.0842 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.171,"smiles":null,"spectrum_id":"CCMSLIB00017314158","spectrum_index":47678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(2-nitrobenzyl)ethanamine (delta mass: 152.0788 Da; putative annotation: N/A; putative formula: C8H12N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.198,"smiles":null,"spectrum_id":"CCMSLIB00017314160","spectrum_index":47679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 256.225 Da; putative annotation: N/A; putative formula: C9H24N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.348,"smiles":null,"spectrum_id":"CCMSLIB00017314162","spectrum_index":47680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 232.1821 Da; putative annotation: N/A; putative formula: C10H25N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.336,"smiles":null,"spectrum_id":"CCMSLIB00017314164","spectrum_index":47681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 29.9941 Da; putative annotation: N/A; putative formula: CH2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.148,"smiles":null,"spectrum_id":"CCMSLIB00017314166","spectrum_index":47682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 17.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.169,"smiles":null,"spectrum_id":"CCMSLIB00017314167","spectrum_index":47683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 643.0586 Da; putative annotation: N/A; putative formula: C20H23N9O8P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":865.156,"smiles":null,"spectrum_id":"CCMSLIB00017314169","spectrum_index":47684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 765.6507 Da; putative annotation: N/A; putative formula: C48H79N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.748,"smiles":null,"spectrum_id":"CCMSLIB00017314172","spectrum_index":47685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,16-dimethoxy-10-azatetracyclo[7.7.1.0,?.0,?]heptadeca-1(16),2(7),3,5,13(17),14-hexaene-5,15-diol (delta mass: 60.042 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.181,"smiles":null,"spectrum_id":"CCMSLIB00017314173","spectrum_index":47686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mitraphylline (delta mass: 380.2111 Da; putative annotation: N/A; putative formula: C24H24N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.392,"smiles":null,"spectrum_id":"CCMSLIB00017314175","spectrum_index":47687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 414.3131 Da; putative annotation: N/A; putative formula: C27H42O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":741.442,"smiles":null,"spectrum_id":"CCMSLIB00017314177","spectrum_index":47688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N'-Hexane-1,6-diylbis(N'-cyanoguanidine) (delta mass: 18.0021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017314179","spectrum_index":47689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 56.0622 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.248,"smiles":null,"spectrum_id":"CCMSLIB00017314181","spectrum_index":47690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 59.0807 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.207,"smiles":null,"spectrum_id":"CCMSLIB00017314183","spectrum_index":47691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 62.0257 Da; putative annotation: N/A; putative formula: C4H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017314185","spectrum_index":47692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 52.0427 Da; putative annotation: N/A; putative formula: C3H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.114,"smiles":null,"spectrum_id":"CCMSLIB00017314187","spectrum_index":47693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 74.0001 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.076,"smiles":null,"spectrum_id":"CCMSLIB00017314189","spectrum_index":47694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 228.1721 Da; putative annotation: N/A; putative formula: C13H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.237,"smiles":null,"spectrum_id":"CCMSLIB00017314190","spectrum_index":47695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 252.0335 Da; putative annotation: N/A; putative formula: C7H13N2O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.114,"smiles":null,"spectrum_id":"CCMSLIB00017314192","spectrum_index":47696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 199.0482 Da; putative annotation: N/A; putative formula: C8H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.135,"smiles":null,"spectrum_id":"CCMSLIB00017314194","spectrum_index":47697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 18.0817 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.141,"smiles":null,"spectrum_id":"CCMSLIB00017314196","spectrum_index":47698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 61.0646 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.239,"smiles":null,"spectrum_id":"CCMSLIB00017314198","spectrum_index":47699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dulcitol (delta mass: 82.0678 Da; putative annotation: N/A; putative formula: C3H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.154,"smiles":null,"spectrum_id":"CCMSLIB00017314199","spectrum_index":47700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 88.0315 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.191,"smiles":null,"spectrum_id":"CCMSLIB00017314201","spectrum_index":47701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 242.1673 Da; putative annotation: N/A; putative formula: C17H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.243,"smiles":null,"spectrum_id":"CCMSLIB00017314203","spectrum_index":47702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 157.193 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.275,"smiles":null,"spectrum_id":"CCMSLIB00017314205","spectrum_index":47703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-quinolin-4-yl(5-vinylquinuclidin-2-yl)methanol (delta mass: 14.0245 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.205,"smiles":null,"spectrum_id":"CCMSLIB00017314207","spectrum_index":47704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 165.0768 Da; putative annotation: N/A; putative formula: C5H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.174,"smiles":null,"spectrum_id":"CCMSLIB00017314209","spectrum_index":47705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 52.0061 Da; putative annotation: N/A; putative formula: C2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.092,"smiles":null,"spectrum_id":"CCMSLIB00017314210","spectrum_index":47706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Asp (delta mass: 69.0577 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.186,"smiles":null,"spectrum_id":"CCMSLIB00017314212","spectrum_index":47707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C9:0 (delta mass: 157.1464 Da; putative annotation: N/A; putative formula: C9H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.353,"smiles":null,"spectrum_id":"CCMSLIB00017314214","spectrum_index":47708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 389.1531 Da; putative annotation: N/A; putative formula: C11H15N15O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":720.307,"smiles":null,"spectrum_id":"CCMSLIB00017314216","spectrum_index":47709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 119.0374 Da; putative annotation: 5-Methylpyridine-2-carboxylic acid; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.108,"smiles":null,"spectrum_id":"CCMSLIB00017314218","spectrum_index":47710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 210.0679 Da; putative annotation: Massbank:EA023009 Benzophenone-3|2-Hydroxy-4-methoxybenzophenone|(2-hydroxy-4-methoxy-phenyl)-phenyl-methanone; putative formula: C14H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.128,"smiles":null,"spectrum_id":"CCMSLIB00017314220","spectrum_index":47711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 67.0789 Da; putative annotation: 2-Methylpyrrolidine; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.134,"smiles":null,"spectrum_id":"CCMSLIB00017314222","spectrum_index":47712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 276.2083 Da; putative annotation: 9-Oxo-10E,12Z-octadecadienoic acid; putative formula: C18H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.295,"smiles":null,"spectrum_id":"CCMSLIB00017314224","spectrum_index":47713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 233.1053 Da; putative annotation: N-Acetyl-L-tyrosine ethyl ester; putative formula: C13H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.197,"smiles":null,"spectrum_id":"CCMSLIB00017314226","spectrum_index":47714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 284.0689 Da; putative annotation: Hematoxylin; putative formula: C16H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.129,"smiles":null,"spectrum_id":"CCMSLIB00017314228","spectrum_index":47715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 99.0688 Da; putative annotation: L-(+)-Valine - 40.0 eV; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.239,"smiles":null,"spectrum_id":"CCMSLIB00017314230","spectrum_index":47716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 101.0474 Da; putative annotation: L-homoserine CollisionEnergy:102040; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017314232","spectrum_index":47717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 233.0886 Da; putative annotation: Massbank:KO009069 Muramate|2-Amino-3-O-D-1-carboxyethyl-2-deoxy-D-glucose|3-O-alpha-Carboxyethyl-D-glucosamine|Muramic acid; putative formula: C9H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.212,"smiles":null,"spectrum_id":"CCMSLIB00017314233","spectrum_index":47718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 778.4483 Da; putative annotation: Hederoside F; putative formula: C42H66O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":985.535,"smiles":null,"spectrum_id":"CCMSLIB00017314235","spectrum_index":47719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 326.0787 Da; putative annotation: Usnic acid; putative formula: C18H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.139,"smiles":null,"spectrum_id":"CCMSLIB00017314237","spectrum_index":47720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 320.0693 Da; putative annotation: NCGC00347521-02!3,6,8-trihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione [IIN-based: Match]; putative formula: C19H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.198,"smiles":null,"spectrum_id":"CCMSLIB00017314239","spectrum_index":47721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 129.0429 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.135,"smiles":null,"spectrum_id":"CCMSLIB00017314241","spectrum_index":47722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 255.1462 Da; putative annotation: N/A; putative formula: C13H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.316,"smiles":null,"spectrum_id":"CCMSLIB00017314243","spectrum_index":47723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 405.2521 Da; putative annotation: N/A; putative formula: C24H39NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.422,"smiles":null,"spectrum_id":"CCMSLIB00017314245","spectrum_index":47724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]cyclopropanecarboxamide (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.154,"smiles":null,"spectrum_id":"CCMSLIB00017314247","spectrum_index":47725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 176.1399 Da; putative annotation: N/A; putative formula: C5H16N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.22,"smiles":null,"spectrum_id":"CCMSLIB00017314248","spectrum_index":47726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 148.0731 Da; putative annotation: N/A; putative formula: C6H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.222,"smiles":null,"spectrum_id":"CCMSLIB00017314250","spectrum_index":47727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 215.0944 Da; putative annotation: N/A; putative formula: C13H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.218,"smiles":null,"spectrum_id":"CCMSLIB00017314252","spectrum_index":47728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 44.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.117,"smiles":null,"spectrum_id":"CCMSLIB00017314254","spectrum_index":47729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 88.0675 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017314256","spectrum_index":47730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 224.1058 Da; putative annotation: N/A; putative formula: C13H20O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.228,"smiles":null,"spectrum_id":"CCMSLIB00017314258","spectrum_index":47731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Desmethylquinidine (delta mass: 63.078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.253,"smiles":null,"spectrum_id":"CCMSLIB00017314260","spectrum_index":47732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 17.0347 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.076,"smiles":null,"spectrum_id":"CCMSLIB00017314262","spectrum_index":47733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 155.8383 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.966,"smiles":null,"spectrum_id":"CCMSLIB00017314264","spectrum_index":47734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Diphenyl-1H-indole-7-carboxylic acid (delta mass: 291.1412 Da; putative annotation: N/A; putative formula: C23H17NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":605.259,"smiles":null,"spectrum_id":"CCMSLIB00017314266","spectrum_index":47735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(6aR,9R,10aR)-9-(methylsulfanylmethyl)-7-propyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline\"\" (delta mass: 102.0742 Da; putative annotation: N/A; putative formula: H6N8O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.263,"smiles":null,"spectrum_id":"CCMSLIB00017314267","spectrum_index":47736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 503.5612 Da; putative annotation: N/A; putative formula: C34H69N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.642,"smiles":null,"spectrum_id":"CCMSLIB00017314269","spectrum_index":47737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 126.3667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.5,"smiles":null,"spectrum_id":"CCMSLIB00017314271","spectrum_index":47738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 12.0357 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.132,"smiles":null,"spectrum_id":"CCMSLIB00017314273","spectrum_index":47739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 118.0688 Da; putative annotation: N/A; putative formula: C3H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.222,"smiles":null,"spectrum_id":"CCMSLIB00017314275","spectrum_index":47740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 376.21 Da; putative annotation: N/A; putative formula: C18H32O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.276,"smiles":null,"spectrum_id":"CCMSLIB00017314277","spectrum_index":47741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mecillinam (delta mass: 125.0896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.243,"smiles":null,"spectrum_id":"CCMSLIB00017314279","spectrum_index":47742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 200.1049 Da; putative annotation: N/A; putative formula: C10H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.212,"smiles":null,"spectrum_id":"CCMSLIB00017314281","spectrum_index":47743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 87.0446 Da; putative annotation: N/A; putative formula: C2H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.147,"smiles":null,"spectrum_id":"CCMSLIB00017314283","spectrum_index":47744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 108.8789 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.944,"smiles":null,"spectrum_id":"CCMSLIB00017314284","spectrum_index":47745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 114.054 Da; putative annotation: N/A; putative formula: C3H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.07,"smiles":null,"spectrum_id":"CCMSLIB00017314286","spectrum_index":47746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 638.4489 Da; putative annotation: N/A; putative formula: C47H58O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.509,"smiles":null,"spectrum_id":"CCMSLIB00017314287","spectrum_index":47747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 115.0634 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.134,"smiles":null,"spectrum_id":"CCMSLIB00017314288","spectrum_index":47748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 35.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.122,"smiles":null,"spectrum_id":"CCMSLIB00017314289","spectrum_index":47749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 68.035 Da; putative annotation: N/A; putative formula: C3H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.09,"smiles":null,"spectrum_id":"CCMSLIB00017314290","spectrum_index":47750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 133.9985 Da; putative annotation: N/A; putative formula: C3H-2N6O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.064,"smiles":null,"spectrum_id":"CCMSLIB00017314291","spectrum_index":47751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 908.48 Da; putative annotation: N/A; putative formula: C47H72O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1235.61,"smiles":null,"spectrum_id":"CCMSLIB00017314292","spectrum_index":47752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 38.0517 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.096,"smiles":null,"spectrum_id":"CCMSLIB00017314293","spectrum_index":47753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 52.031 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017314294","spectrum_index":47754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cis,cis-9,12-Octadecadien-1-ol (delta mass: 79.972 Da; putative annotation: N/A; putative formula: C4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.24,"smiles":null,"spectrum_id":"CCMSLIB00017314295","spectrum_index":47755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cephalotaxine (delta mass: 43.9905 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.145,"smiles":null,"spectrum_id":"CCMSLIB00017314296","spectrum_index":47756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 431.1319 Da; putative annotation: N/A; putative formula: C22H26NO4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.203,"smiles":null,"spectrum_id":"CCMSLIB00017314297","spectrum_index":47757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 393.1547 Da; putative annotation: N/A; putative formula: C19H19N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.241,"smiles":null,"spectrum_id":"CCMSLIB00017314298","spectrum_index":47758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 32.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.048,"smiles":null,"spectrum_id":"CCMSLIB00017314299","spectrum_index":47759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 97.9871 Da; putative annotation: N/A; putative formula: CH-2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.089,"smiles":null,"spectrum_id":"CCMSLIB00017314300","spectrum_index":47760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 244.2033 Da; putative annotation: N/A; putative formula: C14H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.295,"smiles":null,"spectrum_id":"CCMSLIB00017314301","spectrum_index":47761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 23.0153 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.138,"smiles":null,"spectrum_id":"CCMSLIB00017314302","spectrum_index":47762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 349.0592 Da; putative annotation: N/A; putative formula: C11H17N3O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.146,"smiles":null,"spectrum_id":"CCMSLIB00017314303","spectrum_index":47763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 144.0424 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.176,"smiles":null,"spectrum_id":"CCMSLIB00017314304","spectrum_index":47764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 80.0033 Da; putative annotation: N/A; putative formula: C8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.13,"smiles":null,"spectrum_id":"CCMSLIB00017314305","spectrum_index":47765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 484.2111 Da; putative annotation: N/A; putative formula: C28H28N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.282,"smiles":null,"spectrum_id":"CCMSLIB00017314306","spectrum_index":47766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucrose (delta mass: 972.3225 Da; putative annotation: N/A; putative formula: C47H54N6O13P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1315.45,"smiles":null,"spectrum_id":"CCMSLIB00017314307","spectrum_index":47767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 602.1464 Da; putative annotation: N/A; putative formula: C30H34O7S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":945.27,"smiles":null,"spectrum_id":"CCMSLIB00017314308","spectrum_index":47768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 395.2214 Da; putative annotation: N/A; putative formula: C16H29N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.334,"smiles":null,"spectrum_id":"CCMSLIB00017314309","spectrum_index":47769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 50.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.207,"smiles":null,"spectrum_id":"CCMSLIB00017314310","spectrum_index":47770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 125.0719 Da; putative annotation: N/A; putative formula: C4H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.2,"smiles":null,"spectrum_id":"CCMSLIB00017314311","spectrum_index":47771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 75.0472 Da; putative annotation: N/A; putative formula: C6H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.102,"smiles":null,"spectrum_id":"CCMSLIB00017314312","spectrum_index":47772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 64.0164 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017314313","spectrum_index":47773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdesmethoxycurcumin (delta mass: 76.0159 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.128,"smiles":null,"spectrum_id":"CCMSLIB00017314314","spectrum_index":47774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 102.0568 Da; putative annotation: N/A; putative formula: C7H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017314315","spectrum_index":47775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylnicotinic acid (delta mass: 30.0105 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.066,"smiles":null,"spectrum_id":"CCMSLIB00017314316","spectrum_index":47776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 304.1429 Da; putative annotation: N/A; putative formula: C17H24N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.229,"smiles":null,"spectrum_id":"CCMSLIB00017314317","spectrum_index":47777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 358.0933 Da; putative annotation: N/A; putative formula: C12H22O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.18,"smiles":null,"spectrum_id":"CCMSLIB00017314318","spectrum_index":47778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 72.9944 Da; putative annotation: N/A; putative formula: C5H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.08,"smiles":null,"spectrum_id":"CCMSLIB00017314319","spectrum_index":47779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 50.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.133,"smiles":null,"spectrum_id":"CCMSLIB00017314320","spectrum_index":47780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olodaterol (delta mass: 211.0923 Da; putative annotation: N/A; putative formula: C4H13N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.284,"smiles":null,"spectrum_id":"CCMSLIB00017314321","spectrum_index":47781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 42.0599 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.14,"smiles":null,"spectrum_id":"CCMSLIB00017314322","spectrum_index":47782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385672-01!(E)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)hept-4-en-3-one (delta mass: 193.0745 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.218,"smiles":null,"spectrum_id":"CCMSLIB00017314323","spectrum_index":47783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-His (delta mass: 97.0517 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.166,"smiles":null,"spectrum_id":"CCMSLIB00017314324","spectrum_index":47784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 197.1054 Da; putative annotation: N/A; putative formula: C10H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.223,"smiles":null,"spectrum_id":"CCMSLIB00017314325","spectrum_index":47785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 42.0125 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.192,"smiles":null,"spectrum_id":"CCMSLIB00017314326","spectrum_index":47786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 440.0934 Da; putative annotation: N/A; putative formula: C15H26N2O7P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.217,"smiles":null,"spectrum_id":"CCMSLIB00017314327","spectrum_index":47787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 79.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.175,"smiles":null,"spectrum_id":"CCMSLIB00017314328","spectrum_index":47788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 641.3341 Da; putative annotation: N/A; putative formula: C33H48N5O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.473,"smiles":null,"spectrum_id":"CCMSLIB00017314329","spectrum_index":47789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 23.9993 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.07,"smiles":null,"spectrum_id":"CCMSLIB00017314330","spectrum_index":47790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthioamphetamine (delta mass: 96.0394 Da; putative annotation: N/A; putative formula: C6H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.176,"smiles":null,"spectrum_id":"CCMSLIB00017314331","spectrum_index":47791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 73.0949 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.222,"smiles":null,"spectrum_id":"CCMSLIB00017314332","spectrum_index":47792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 55.0429 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.114,"smiles":null,"spectrum_id":"CCMSLIB00017314333","spectrum_index":47793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 368.7213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.845,"smiles":null,"spectrum_id":"CCMSLIB00017314334","spectrum_index":47794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 368.7208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.844,"smiles":null,"spectrum_id":"CCMSLIB00017314335","spectrum_index":47795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 57.0576 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.118,"smiles":null,"spectrum_id":"CCMSLIB00017314336","spectrum_index":47796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 122.0009 Da; putative annotation: N/A; putative formula: C6H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.113,"smiles":null,"spectrum_id":"CCMSLIB00017314337","spectrum_index":47797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 86.0509 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.21,"smiles":null,"spectrum_id":"CCMSLIB00017314338","spectrum_index":47798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 343.183 Da; putative annotation: N/A; putative formula: C18H25N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.279,"smiles":null,"spectrum_id":"CCMSLIB00017314339","spectrum_index":47799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 408.3175 Da; putative annotation: N/A; putative formula: C24H44N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.409,"smiles":null,"spectrum_id":"CCMSLIB00017314340","spectrum_index":47800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 58.0378 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.165,"smiles":null,"spectrum_id":"CCMSLIB00017314341","spectrum_index":47801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 180.0383 Da; putative annotation: N/A; putative formula: C4H8N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.129,"smiles":null,"spectrum_id":"CCMSLIB00017314342","spectrum_index":47802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 410.0978 Da; putative annotation: N/A; putative formula: C15H23O11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.184,"smiles":null,"spectrum_id":"CCMSLIB00017314343","spectrum_index":47803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 131.0443 Da; putative annotation: N/A; putative formula: C2H5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.188,"smiles":null,"spectrum_id":"CCMSLIB00017314344","spectrum_index":47804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 14.1821 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.306,"smiles":null,"spectrum_id":"CCMSLIB00017314345","spectrum_index":47805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 273.1432 Da; putative annotation: N/A; putative formula: C12H24N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.24,"smiles":null,"spectrum_id":"CCMSLIB00017314346","spectrum_index":47806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 112.0523 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.112,"smiles":null,"spectrum_id":"CCMSLIB00017314347","spectrum_index":47807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 265.2978 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.379,"smiles":null,"spectrum_id":"CCMSLIB00017314348","spectrum_index":47808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to His-Leu from NIST14 (delta mass: 214.0945 Da; putative annotation: N/A; putative formula: C11H19PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.255,"smiles":null,"spectrum_id":"CCMSLIB00017314349","spectrum_index":47809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 187.1086 Da; putative annotation: N/A; putative formula: C6H13N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.211,"smiles":null,"spectrum_id":"CCMSLIB00017314350","spectrum_index":47810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzylpenicillin_20eV (delta mass: 142.0772 Da; putative annotation: N/A; putative formula: C5H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.183,"smiles":null,"spectrum_id":"CCMSLIB00017314351","spectrum_index":47811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 157.146 Da; putative annotation: N/A; putative formula: C9H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.222,"smiles":null,"spectrum_id":"CCMSLIB00017314352","spectrum_index":47812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 174.1258 Da; putative annotation: N/A; putative formula: C9H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017314353","spectrum_index":47813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 783.9087 Da; putative annotation: N/A; putative formula: C21H36O7S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.0,"smiles":null,"spectrum_id":"CCMSLIB00017314354","spectrum_index":47814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 86.0006 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.086,"smiles":null,"spectrum_id":"CCMSLIB00017314355","spectrum_index":47815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1H-benzimidazole (delta mass: 108.0232 Da; putative annotation: N/A; putative formula: C5H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.099,"smiles":null,"spectrum_id":"CCMSLIB00017314356","spectrum_index":47816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 97.0514 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.153,"smiles":null,"spectrum_id":"CCMSLIB00017314357","spectrum_index":47817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 410.6954 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.834,"smiles":null,"spectrum_id":"CCMSLIB00017314358","spectrum_index":47818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 186.0698 Da; putative annotation: N/A; putative formula: C5H10N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.156,"smiles":null,"spectrum_id":"CCMSLIB00017314359","spectrum_index":47819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 269.1246 Da; putative annotation: N/A; putative formula: C10H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.211,"smiles":null,"spectrum_id":"CCMSLIB00017314360","spectrum_index":47820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 415.282 Da; putative annotation: N/A; putative formula: C26H42NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.436,"smiles":null,"spectrum_id":"CCMSLIB00017314361","spectrum_index":47821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 46.0721 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.226,"smiles":null,"spectrum_id":"CCMSLIB00017314362","spectrum_index":47822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 36.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.17,"smiles":null,"spectrum_id":"CCMSLIB00017314363","spectrum_index":47823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 285.0201 Da; putative annotation: N/A; putative formula: C12H12ClNO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.07,"smiles":null,"spectrum_id":"CCMSLIB00017314364","spectrum_index":47824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1216.5765 Da; putative annotation: N/A; putative formula: C87H72N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1409.65,"smiles":null,"spectrum_id":"CCMSLIB00017314365","spectrum_index":47825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 83.0373 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.129,"smiles":null,"spectrum_id":"CCMSLIB00017314366","spectrum_index":47826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 90.0844 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.16,"smiles":null,"spectrum_id":"CCMSLIB00017314367","spectrum_index":47827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 127.0641 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.156,"smiles":null,"spectrum_id":"CCMSLIB00017314368","spectrum_index":47828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (delta mass: 61.9957 Da; putative annotation: N/A; putative formula: H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.129,"smiles":null,"spectrum_id":"CCMSLIB00017314369","spectrum_index":47829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 147.0519 Da; putative annotation: N/A; putative formula: C9H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.144,"smiles":null,"spectrum_id":"CCMSLIB00017314370","spectrum_index":47830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 45.0201 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.127,"smiles":null,"spectrum_id":"CCMSLIB00017314371","spectrum_index":47831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 74.0369 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.092,"smiles":null,"spectrum_id":"CCMSLIB00017314372","spectrum_index":47832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Qunoline-8-methanol (delta mass: 97.0236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.099,"smiles":null,"spectrum_id":"CCMSLIB00017314373","spectrum_index":47833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(3-Aminopropyl)-N1-methylpropane-1,3-diamine (delta mass: 266.2609 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.426,"smiles":null,"spectrum_id":"CCMSLIB00017314374","spectrum_index":47834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 708.4187 Da; putative annotation: N/A; putative formula: C50H60O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1051.54,"smiles":null,"spectrum_id":"CCMSLIB00017314375","spectrum_index":47835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 573.7005 Da; putative annotation: N/A; putative formula: CH20O-1P18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.814,"smiles":null,"spectrum_id":"CCMSLIB00017314376","spectrum_index":47836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ307605 Piracetam|1-Pyrrolidineacetamide, 2-oxo-|2-(2-ketopyrrolidino)acetamide (delta mass: 85.052 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.133,"smiles":null,"spectrum_id":"CCMSLIB00017314377","spectrum_index":47837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 224.1474 Da; putative annotation: N/A; putative formula: C11H20N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.224,"smiles":null,"spectrum_id":"CCMSLIB00017314378","spectrum_index":47838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 29.0267 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.129,"smiles":null,"spectrum_id":"CCMSLIB00017314379","spectrum_index":47839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 624.4279 Da; putative annotation: N/A; putative formula: C35H57N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":762.519,"smiles":null,"spectrum_id":"CCMSLIB00017314380","spectrum_index":47840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 85.1507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.237,"smiles":null,"spectrum_id":"CCMSLIB00017314381","spectrum_index":47841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 552.137 Da; putative annotation: N/A; putative formula: C21H25N6O10P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.228,"smiles":null,"spectrum_id":"CCMSLIB00017314382","spectrum_index":47842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carmoxirole (delta mass: 300.2141 Da; putative annotation: N/A; putative formula: C17H34P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.421,"smiles":null,"spectrum_id":"CCMSLIB00017314383","spectrum_index":47843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 306.2555 Da; putative annotation: N/A; putative formula: C20H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.331,"smiles":null,"spectrum_id":"CCMSLIB00017314384","spectrum_index":47844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 615.2404 Da; putative annotation: N/A; putative formula: C34H37N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.311,"smiles":null,"spectrum_id":"CCMSLIB00017314385","spectrum_index":47845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 531.2097 Da; putative annotation: N/A; putative formula: C40H25N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.296,"smiles":null,"spectrum_id":"CCMSLIB00017314386","spectrum_index":47846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-crinamine (delta mass: 78.0315 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.17,"smiles":null,"spectrum_id":"CCMSLIB00017314387","spectrum_index":47847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 46.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.144,"smiles":null,"spectrum_id":"CCMSLIB00017314388","spectrum_index":47848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 90.0681 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017314389","spectrum_index":47849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 197.0896 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.259,"smiles":null,"spectrum_id":"CCMSLIB00017314390","spectrum_index":47850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HYDROQUINIDINE (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.217,"smiles":null,"spectrum_id":"CCMSLIB00017314391","spectrum_index":47851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3R)-2-(((S)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(5-chloropyridin-2-yl)-3-methylpentanamide (delta mass: 16.0274 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.275,"smiles":null,"spectrum_id":"CCMSLIB00017314392","spectrum_index":47852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 215.1874 Da; putative annotation: N/A; putative formula: C12H25NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.29,"smiles":null,"spectrum_id":"CCMSLIB00017314393","spectrum_index":47853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 343.1117 Da; putative annotation: N/A; putative formula: C11H21NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.171,"smiles":null,"spectrum_id":"CCMSLIB00017314394","spectrum_index":47854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 194.1096 Da; putative annotation: N/A; putative formula: C15H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.18,"smiles":null,"spectrum_id":"CCMSLIB00017314395","spectrum_index":47855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 76.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017314396","spectrum_index":47856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 39.0472 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017314397","spectrum_index":47857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 74.0038 Da; putative annotation: N/A; putative formula: CH3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.085,"smiles":null,"spectrum_id":"CCMSLIB00017314398","spectrum_index":47858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 35.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.202,"smiles":null,"spectrum_id":"CCMSLIB00017314399","spectrum_index":47859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 63.9288 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.027,"smiles":null,"spectrum_id":"CCMSLIB00017314400","spectrum_index":47860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 248.1501 Da; putative annotation: N/A; putative formula: C10H16N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.247,"smiles":null,"spectrum_id":"CCMSLIB00017314401","spectrum_index":47861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 113.0601 Da; putative annotation: N/A; putative formula: C4H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.095,"smiles":null,"spectrum_id":"CCMSLIB00017314402","spectrum_index":47862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 214.1207 Da; putative annotation: N/A; putative formula: C11H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.247,"smiles":null,"spectrum_id":"CCMSLIB00017314403","spectrum_index":47863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 308.271 Da; putative annotation: N/A; putative formula: C20H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.357,"smiles":null,"spectrum_id":"CCMSLIB00017314404","spectrum_index":47864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 32.0569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.18,"smiles":null,"spectrum_id":"CCMSLIB00017314405","spectrum_index":47865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 78.0793 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.155,"smiles":null,"spectrum_id":"CCMSLIB00017314406","spectrum_index":47866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Leu (delta mass: 113.0844 Da; putative annotation: L-Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.213,"smiles":null,"spectrum_id":"CCMSLIB00017314407","spectrum_index":47867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 275.1301 Da; putative annotation: 3-[(4-Fluoroanilino)carbonyl]-1,2,2-trimethylcyclopentanecarboxylic acid; putative formula: C16H18FNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":780.306,"smiles":null,"spectrum_id":"CCMSLIB00017314408","spectrum_index":47868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 106.0422 Da; putative annotation: 2-Methylresorcinol; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.129,"smiles":null,"spectrum_id":"CCMSLIB00017314409","spectrum_index":47869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 240.0744 Da; putative annotation: Massbank:FIO00297 3-Hydroxy-beta-lapachone; putative formula: C15H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.177,"smiles":null,"spectrum_id":"CCMSLIB00017314410","spectrum_index":47870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 285.0201 Da; putative annotation: 1-[(4-Chlorophenyl)sulfonyl]-3-piperidinecarboxylic acid; putative formula: C12H12ClNO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.07,"smiles":null,"spectrum_id":"CCMSLIB00017314411","spectrum_index":47871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 105.0575 Da; putative annotation: 2-Amino-4-methylphenol; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.118,"smiles":null,"spectrum_id":"CCMSLIB00017314412","spectrum_index":47872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Pro (delta mass: 99.0683 Da; putative annotation: Spectral Match to valine from NIST14-note this is the rearranged loss of ammonia to form a proline see parent mass; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.207,"smiles":null,"spectrum_id":"CCMSLIB00017314413","spectrum_index":47873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 147.0678 Da; putative annotation: L-phenylalanine CollisionEnergy:102040; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.165,"smiles":null,"spectrum_id":"CCMSLIB00017314414","spectrum_index":47874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Ala (delta mass: 143.072 Da; putative annotation: Tryptophol; putative formula: C10H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.206,"smiles":null,"spectrum_id":"CCMSLIB00017314415","spectrum_index":47875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 115.0626 Da; putative annotation: N-Methyl-L-threonine; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.123,"smiles":null,"spectrum_id":"CCMSLIB00017314416","spectrum_index":47876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 83.0374 Da; putative annotation: L-Homoserine lactone; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.124,"smiles":null,"spectrum_id":"CCMSLIB00017314417","spectrum_index":47877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 208.0845 Da; putative annotation: Spectral Match to PyroGlu-Pro from NIST14; putative formula: C10H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.181,"smiles":null,"spectrum_id":"CCMSLIB00017314418","spectrum_index":47878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 163.0703 Da; putative annotation: N/A; putative formula: C3H9N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.13,"smiles":null,"spectrum_id":"CCMSLIB00017314419","spectrum_index":47879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 158.0979 Da; putative annotation: N/A; putative formula: C7H15N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.236,"smiles":null,"spectrum_id":"CCMSLIB00017314420","spectrum_index":47880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 184.143 Da; putative annotation: N/A; putative formula: C7H16N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.223,"smiles":null,"spectrum_id":"CCMSLIB00017314421","spectrum_index":47881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 188.1569 Da; putative annotation: N/A; putative formula: C14H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.28,"smiles":null,"spectrum_id":"CCMSLIB00017314422","spectrum_index":47882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 107.0368 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.129,"smiles":null,"spectrum_id":"CCMSLIB00017314423","spectrum_index":47883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML01010 Demecolcine (delta mass: 18.0095 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.19,"smiles":null,"spectrum_id":"CCMSLIB00017314424","spectrum_index":47884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 755.3 Da; putative annotation: N/A; putative formula: C41H41N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.36,"smiles":null,"spectrum_id":"CCMSLIB00017314425","spectrum_index":47885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 1146.4917 Da; putative annotation: N/A; putative formula: C54H82O24S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1353.58,"smiles":null,"spectrum_id":"CCMSLIB00017314426","spectrum_index":47886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 233.0712 Da; putative annotation: N/A; putative formula: C11H12N3OP)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.158,"smiles":null,"spectrum_id":"CCMSLIB00017314427","spectrum_index":47887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 235.0843 Da; putative annotation: N/A; putative formula: C12H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.165,"smiles":null,"spectrum_id":"CCMSLIB00017314428","spectrum_index":47888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 202.1666 Da; putative annotation: N/A; putative formula: C10H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.288,"smiles":null,"spectrum_id":"CCMSLIB00017314429","spectrum_index":47889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 27.9953 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.066,"smiles":null,"spectrum_id":"CCMSLIB00017314430","spectrum_index":47890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 204.059 Da; putative annotation: N/A; putative formula: C8H8N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.081,"smiles":null,"spectrum_id":"CCMSLIB00017314431","spectrum_index":47891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 256.0333 Da; putative annotation: N/A; putative formula: C9H8N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.125,"smiles":null,"spectrum_id":"CCMSLIB00017314432","spectrum_index":47892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 384.1759 Da; putative annotation: N/A; putative formula: C23H28O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.278,"smiles":null,"spectrum_id":"CCMSLIB00017314433","spectrum_index":47893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ358309 Eseroline|1,3a,8-Trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-ol|3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol (delta mass: 66.0567 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.206,"smiles":null,"spectrum_id":"CCMSLIB00017314434","spectrum_index":47894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(4-methoxyphenyl)methanamine (delta mass: 77.0336 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.172,"smiles":null,"spectrum_id":"CCMSLIB00017314435","spectrum_index":47895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 240.2074 Da; putative annotation: N/A; putative formula: C11H24N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.294,"smiles":null,"spectrum_id":"CCMSLIB00017314436","spectrum_index":47896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 19.067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.143,"smiles":null,"spectrum_id":"CCMSLIB00017314437","spectrum_index":47897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cefotaxime (delta mass: 120.0344 Da; putative annotation: N/A; putative formula: C4H9O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.099,"smiles":null,"spectrum_id":"CCMSLIB00017314438","spectrum_index":47898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 68.0623 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.174,"smiles":null,"spectrum_id":"CCMSLIB00017314439","spectrum_index":47899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-hydroxypyrene (delta mass: 157.0492 Da; putative annotation: N/A; putative formula: C5H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.13,"smiles":null,"spectrum_id":"CCMSLIB00017314440","spectrum_index":47900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-GALACTOSAMINE (delta mass: 33.9156 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.002,"smiles":null,"spectrum_id":"CCMSLIB00017314441","spectrum_index":47901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Bisdemethoxycurcumin from NIST14 (delta mass: 327.0902 Da; putative annotation: N/A; putative formula: C14H13N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.202,"smiles":null,"spectrum_id":"CCMSLIB00017314442","spectrum_index":47902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 96.046 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.153,"smiles":null,"spectrum_id":"CCMSLIB00017314443","spectrum_index":47903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 224.1052 Da; putative annotation: N/A; putative formula: C7H13N8O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.186,"smiles":null,"spectrum_id":"CCMSLIB00017314444","spectrum_index":47904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 231.0732 Da; putative annotation: N/A; putative formula: C13H15NO-1P2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.138,"smiles":null,"spectrum_id":"CCMSLIB00017314445","spectrum_index":47905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10,11-dihydroxycarbamazepine (delta mass: 130.0287 Da; putative annotation: N/A; putative formula: C6H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.136,"smiles":null,"spectrum_id":"CCMSLIB00017314446","spectrum_index":47906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 142.1063 Da; putative annotation: N/A; putative formula: C3H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.26,"smiles":null,"spectrum_id":"CCMSLIB00017314447","spectrum_index":47907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 124.0143 Da; putative annotation: N/A; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.09,"smiles":null,"spectrum_id":"CCMSLIB00017314448","spectrum_index":47908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alsterpaullone (delta mass: 64.0172 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.104,"smiles":null,"spectrum_id":"CCMSLIB00017314449","spectrum_index":47909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 304.1795 Da; putative annotation: N/A; putative formula: C10H24N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.271,"smiles":null,"spectrum_id":"CCMSLIB00017314450","spectrum_index":47910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 124.0525 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.186,"smiles":null,"spectrum_id":"CCMSLIB00017314451","spectrum_index":47911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-3,4-(methylenedioxy)benzylamine (delta mass: 66.0204 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.107,"smiles":null,"spectrum_id":"CCMSLIB00017314452","spectrum_index":47912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 125.0473 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.082,"smiles":null,"spectrum_id":"CCMSLIB00017314453","spectrum_index":47913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 123.0259 Da; putative annotation: N/A; putative formula: C5H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.102,"smiles":null,"spectrum_id":"CCMSLIB00017314454","spectrum_index":47914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 205.0381 Da; putative annotation: N/A; putative formula: C3H7N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.129,"smiles":null,"spectrum_id":"CCMSLIB00017314455","spectrum_index":47915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 110.0569 Da; putative annotation: N/A; putative formula: C7H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.143,"smiles":null,"spectrum_id":"CCMSLIB00017314456","spectrum_index":47916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 190.094 Da; putative annotation: N/A; putative formula: C9H19PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.253,"smiles":null,"spectrum_id":"CCMSLIB00017314457","spectrum_index":47917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 392.0016 Da; putative annotation: N/A; putative formula: C16H8O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":707.161,"smiles":null,"spectrum_id":"CCMSLIB00017314458","spectrum_index":47918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 423.3062 Da; putative annotation: N/A; putative formula: C18H41N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.476,"smiles":null,"spectrum_id":"CCMSLIB00017314459","spectrum_index":47919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 99.0469 Da; putative annotation: N/A; putative formula: C8H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.149,"smiles":null,"spectrum_id":"CCMSLIB00017314460","spectrum_index":47920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 49.0316 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.112,"smiles":null,"spectrum_id":"CCMSLIB00017314461","spectrum_index":47921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 241.2918 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.419,"smiles":null,"spectrum_id":"CCMSLIB00017314462","spectrum_index":47922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU210201 Fluvastatin|(E,3R,5S)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5-dihydroxyhept-6-enoic acid (delta mass: 217.1156 Da; putative annotation: N/A; putative formula: C10H21NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.307,"smiles":null,"spectrum_id":"CCMSLIB00017314463","spectrum_index":47923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 391.2195 Da; putative annotation: N/A; putative formula: C23H29N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.322,"smiles":null,"spectrum_id":"CCMSLIB00017314464","spectrum_index":47924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 242.2241 Da; putative annotation: N/A; putative formula: C15H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.316,"smiles":null,"spectrum_id":"CCMSLIB00017314465","spectrum_index":47925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 80.0882 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.195,"smiles":null,"spectrum_id":"CCMSLIB00017314466","spectrum_index":47926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Ethoxy-3-methyl-indole-2-carboxylic acid, ethyl ester (delta mass: 18.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.139,"smiles":null,"spectrum_id":"CCMSLIB00017314467","spectrum_index":47927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 529.2251 Da; putative annotation: N/A; putative formula: C27H35N3O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.306,"smiles":null,"spectrum_id":"CCMSLIB00017314468","spectrum_index":47928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 21.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.123,"smiles":null,"spectrum_id":"CCMSLIB00017314469","spectrum_index":47929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 99.0194 Da; putative annotation: N/A; putative formula: CHN5O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.101,"smiles":null,"spectrum_id":"CCMSLIB00017314470","spectrum_index":47930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 136.1247 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.195,"smiles":null,"spectrum_id":"CCMSLIB00017314471","spectrum_index":47931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 244.0192 Da; putative annotation: N/A; putative formula: C5H4N6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.06,"smiles":null,"spectrum_id":"CCMSLIB00017314472","spectrum_index":47932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 168.0941 Da; putative annotation: N/A; putative formula: C13H12)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.149,"smiles":null,"spectrum_id":"CCMSLIB00017314473","spectrum_index":47933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 129.0577 Da; putative annotation: N/A; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.155,"smiles":null,"spectrum_id":"CCMSLIB00017314474","spectrum_index":47934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 15.9715 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.095,"smiles":null,"spectrum_id":"CCMSLIB00017314475","spectrum_index":47935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 307.2458 Da; putative annotation: N/A; putative formula: C18H33N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.348,"smiles":null,"spectrum_id":"CCMSLIB00017314476","spectrum_index":47936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 29.0515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.097,"smiles":null,"spectrum_id":"CCMSLIB00017314477","spectrum_index":47937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Pro from NIST14 (delta mass: 111.0679 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.171,"smiles":null,"spectrum_id":"CCMSLIB00017314478","spectrum_index":47938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 108.0936 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.331,"smiles":null,"spectrum_id":"CCMSLIB00017314479","spectrum_index":47939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 306.0981 Da; putative annotation: N/A; putative formula: C11H19N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.211,"smiles":null,"spectrum_id":"CCMSLIB00017314480","spectrum_index":47940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 405.1744 Da; putative annotation: N/A; putative formula: C16H27N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.272,"smiles":null,"spectrum_id":"CCMSLIB00017314481","spectrum_index":47941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 148.0872 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.324,"smiles":null,"spectrum_id":"CCMSLIB00017314482","spectrum_index":47942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 31.0787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.154,"smiles":null,"spectrum_id":"CCMSLIB00017314483","spectrum_index":47943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 40.0213 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.118,"smiles":null,"spectrum_id":"CCMSLIB00017314484","spectrum_index":47944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2,3-dione (delta mass: 51.0094 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.039,"smiles":null,"spectrum_id":"CCMSLIB00017314485","spectrum_index":47945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 160.0464 Da; putative annotation: N/A; putative formula: C9H8N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.17,"smiles":null,"spectrum_id":"CCMSLIB00017314486","spectrum_index":47946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 365.1329 Da; putative annotation: N/A; putative formula: C15H27NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.193,"smiles":null,"spectrum_id":"CCMSLIB00017314487","spectrum_index":47947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 35.0403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017314488","spectrum_index":47948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Pro-Glu (delta mass: 273.0961 Da; putative annotation: N/A; putative formula: C10H15N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.231,"smiles":null,"spectrum_id":"CCMSLIB00017314489","spectrum_index":47949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 196.0734 Da; putative annotation: N/A; putative formula: C10H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.207,"smiles":null,"spectrum_id":"CCMSLIB00017314490","spectrum_index":47950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 572.1946 Da; putative annotation: N/A; putative formula: C35H28N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":867.297,"smiles":null,"spectrum_id":"CCMSLIB00017314491","spectrum_index":47951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydropertusaric (delta mass: 92.0604 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.324,"smiles":null,"spectrum_id":"CCMSLIB00017314492","spectrum_index":47952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 204.089 Da; putative annotation: N/A; putative formula: C11H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.243,"smiles":null,"spectrum_id":"CCMSLIB00017314493","spectrum_index":47953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 203.0477 Da; putative annotation: N/A; putative formula: C5H9N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.139,"smiles":null,"spectrum_id":"CCMSLIB00017314494","spectrum_index":47954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 665.2898 Da; putative annotation: N/A; putative formula: C35H39N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":872.376,"smiles":null,"spectrum_id":"CCMSLIB00017314495","spectrum_index":47955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 130.0773 Da; putative annotation: N/A; putative formula: C4H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.351,"smiles":null,"spectrum_id":"CCMSLIB00017314496","spectrum_index":47956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU211802 Nordeprenyl|Desmethylselegiline|1-phenyl-N-prop-2-ynylpropan-2-amine (delta mass: 95.0731 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.201,"smiles":null,"spectrum_id":"CCMSLIB00017314497","spectrum_index":47957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 86.0373 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.15,"smiles":null,"spectrum_id":"CCMSLIB00017314498","spectrum_index":47958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 365.0718 Da; putative annotation: N/A; putative formula: C22H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.168,"smiles":null,"spectrum_id":"CCMSLIB00017314499","spectrum_index":47959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 240.1449 Da; putative annotation: N/A; putative formula: C8H16N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.21,"smiles":null,"spectrum_id":"CCMSLIB00017314500","spectrum_index":47960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 134.0707 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.23,"smiles":null,"spectrum_id":"CCMSLIB00017314501","spectrum_index":47961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(hydroxymethyl)-2-methyl-2-(5-oxooxolan-2-yl)-3H-chromen-4-one (delta mass: 148.1464 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.248,"smiles":null,"spectrum_id":"CCMSLIB00017314502","spectrum_index":47962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 105.1102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.233,"smiles":null,"spectrum_id":"CCMSLIB00017314503","spectrum_index":47963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 162.0533 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.129,"smiles":null,"spectrum_id":"CCMSLIB00017314504","spectrum_index":47964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 144.078 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.175,"smiles":null,"spectrum_id":"CCMSLIB00017314505","spectrum_index":47965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 70.0053 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.065,"smiles":null,"spectrum_id":"CCMSLIB00017314506","spectrum_index":47966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 44.0256 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.111,"smiles":null,"spectrum_id":"CCMSLIB00017314507","spectrum_index":47967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one (delta mass: 217.0689 Da; putative annotation: N/A; putative formula: C9H16NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.162,"smiles":null,"spectrum_id":"CCMSLIB00017314508","spectrum_index":47968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline [M+H-H2O]+; AIF; CE10; MS2Dec (delta mass: 148.0371 Da; putative annotation: N/A; putative formula: C5H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.134,"smiles":null,"spectrum_id":"CCMSLIB00017314509","spectrum_index":47969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 63.0399 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.126,"smiles":null,"spectrum_id":"CCMSLIB00017314510","spectrum_index":47970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin D (delta mass: 54.0564 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.32,"smiles":null,"spectrum_id":"CCMSLIB00017314511","spectrum_index":47971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 746.1894 Da; putative annotation: N/A; putative formula: C42H26N12O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1089.31,"smiles":null,"spectrum_id":"CCMSLIB00017314512","spectrum_index":47972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 77.0456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.137,"smiles":null,"spectrum_id":"CCMSLIB00017314513","spectrum_index":47973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 225.0626 Da; putative annotation: N/A; putative formula: C4H12N5O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.144,"smiles":null,"spectrum_id":"CCMSLIB00017314514","spectrum_index":47974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arcaine (delta mass: 112.1027 Da; putative annotation: N/A; putative formula: C6H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.254,"smiles":null,"spectrum_id":"CCMSLIB00017314515","spectrum_index":47975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butylthiourea (delta mass: 272.1452 Da; putative annotation: N/A; putative formula: C14H24O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.225,"smiles":null,"spectrum_id":"CCMSLIB00017314516","spectrum_index":47976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Buten-1-ol (delta mass: 10.0204 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":83.0852,"smiles":null,"spectrum_id":"CCMSLIB00017314517","spectrum_index":47977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 257.1269 Da; putative annotation: N/A; putative formula: C13H23NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.198,"smiles":null,"spectrum_id":"CCMSLIB00017314518","spectrum_index":47978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 19.0776 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.158,"smiles":null,"spectrum_id":"CCMSLIB00017314519","spectrum_index":47979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aminobutyl benzamide (delta mass: 59.0484 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.182,"smiles":null,"spectrum_id":"CCMSLIB00017314520","spectrum_index":47980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00426 Colchicine (delta mass: 2.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.191,"smiles":null,"spectrum_id":"CCMSLIB00017314521","spectrum_index":47981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Peniprequinolone (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.207,"smiles":null,"spectrum_id":"CCMSLIB00017314522","spectrum_index":47982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 139.0589 Da; putative annotation: N/A; putative formula: C3H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.139,"smiles":null,"spectrum_id":"CCMSLIB00017314523","spectrum_index":47983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 956.3719 Da; putative annotation: N/A; putative formula: C58H58N2O7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.47,"smiles":null,"spectrum_id":"CCMSLIB00017314524","spectrum_index":47984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 9.9905 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.012,"smiles":null,"spectrum_id":"CCMSLIB00017314525","spectrum_index":47985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 205.241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.369,"smiles":null,"spectrum_id":"CCMSLIB00017314526","spectrum_index":47986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 280.2398 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.389,"smiles":null,"spectrum_id":"CCMSLIB00017314527","spectrum_index":47987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 699.6911 Da; putative annotation: N/A; putative formula: C47H89NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":921.788,"smiles":null,"spectrum_id":"CCMSLIB00017314528","spectrum_index":47988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 106.027 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017314529","spectrum_index":47989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 220.0725 Da; putative annotation: N/A; putative formula: C6H13N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.158,"smiles":null,"spectrum_id":"CCMSLIB00017314530","spectrum_index":47990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 403.2353 Da; putative annotation: N/A; putative formula: C23H33NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.364,"smiles":null,"spectrum_id":"CCMSLIB00017314531","spectrum_index":47991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 387.2407 Da; putative annotation: N/A; putative formula: C23H33NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.369,"smiles":null,"spectrum_id":"CCMSLIB00017314532","spectrum_index":47992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 78.0319 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.075,"smiles":null,"spectrum_id":"CCMSLIB00017314533","spectrum_index":47993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 81.0643 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.218,"smiles":null,"spectrum_id":"CCMSLIB00017314534","spectrum_index":47994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 161.0531 Da; putative annotation: N/A; putative formula: C6H13NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.15,"smiles":null,"spectrum_id":"CCMSLIB00017314535","spectrum_index":47995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 148.0865 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.262,"smiles":null,"spectrum_id":"CCMSLIB00017314536","spectrum_index":47996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindole (delta mass: 19.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.081,"smiles":null,"spectrum_id":"CCMSLIB00017314537","spectrum_index":47997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 56.0632 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.16,"smiles":null,"spectrum_id":"CCMSLIB00017314538","spectrum_index":47998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 201.2098 Da; putative annotation: N/A; putative formula: C8H23N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.285,"smiles":null,"spectrum_id":"CCMSLIB00017314539","spectrum_index":47999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 49.0054 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.076,"smiles":null,"spectrum_id":"CCMSLIB00017314540","spectrum_index":48000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxyamphetamine (delta mass: 61.0276 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.171,"smiles":null,"spectrum_id":"CCMSLIB00017314541","spectrum_index":48001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 78.0581 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.129,"smiles":null,"spectrum_id":"CCMSLIB00017314542","spectrum_index":48002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 104.05 Da; putative annotation: N/A; putative formula: C3H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.153,"smiles":null,"spectrum_id":"CCMSLIB00017314543","spectrum_index":48003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 210.1703 Da; putative annotation: N/A; putative formula: C8H18N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.257,"smiles":null,"spectrum_id":"CCMSLIB00017314544","spectrum_index":48004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 92.0472 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.097,"smiles":null,"spectrum_id":"CCMSLIB00017314545","spectrum_index":48005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 23.9967 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.079,"smiles":null,"spectrum_id":"CCMSLIB00017314546","spectrum_index":48006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 263.2562 Da; putative annotation: N/A; putative formula: C18H33N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.332,"smiles":null,"spectrum_id":"CCMSLIB00017314547","spectrum_index":48007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 33.9673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.007,"smiles":null,"spectrum_id":"CCMSLIB00017314548","spectrum_index":48008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4,5-Trimethoxyamphetamine (delta mass: 100.0315 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.175,"smiles":null,"spectrum_id":"CCMSLIB00017314549","spectrum_index":48009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 44.0474 Da; putative annotation: N/A; putative formula: H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017314550","spectrum_index":48010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 135.0322 Da; putative annotation: N/A; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.103,"smiles":null,"spectrum_id":"CCMSLIB00017314551","spectrum_index":48011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 113.9812 Da; putative annotation: N/A; putative formula: CH-2N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.083,"smiles":null,"spectrum_id":"CCMSLIB00017314552","spectrum_index":48012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 178.1723 Da; putative annotation: N/A; putative formula: C13H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.274,"smiles":null,"spectrum_id":"CCMSLIB00017314553","spectrum_index":48013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 189.1002 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.181,"smiles":null,"spectrum_id":"CCMSLIB00017314554","spectrum_index":48014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-(2-oxo-2-phenylethyl)-1,3-dihydro-2H-indol-2-one (delta mass: 57.0224 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.119,"smiles":null,"spectrum_id":"CCMSLIB00017314555","spectrum_index":48015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 179.0785 Da; putative annotation: N/A; putative formula: C3H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.134,"smiles":null,"spectrum_id":"CCMSLIB00017314556","spectrum_index":48016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 76.0676 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.18,"smiles":null,"spectrum_id":"CCMSLIB00017314557","spectrum_index":48017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 416.1266 Da; putative annotation: N/A; putative formula: C17H26N2O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.255,"smiles":null,"spectrum_id":"CCMSLIB00017314558","spectrum_index":48018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 169.9595 Da; putative annotation: N/A; putative formula: H6N4O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.061,"smiles":null,"spectrum_id":"CCMSLIB00017314559","spectrum_index":48019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 342.1165 Da; putative annotation: N/A; putative formula: C15H23N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.203,"smiles":null,"spectrum_id":"CCMSLIB00017314560","spectrum_index":48020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-7-carboxaldehyde (delta mass: 2.015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.075,"smiles":null,"spectrum_id":"CCMSLIB00017314561","spectrum_index":48021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 99.0319 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.113,"smiles":null,"spectrum_id":"CCMSLIB00017314562","spectrum_index":48022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 305.185 Da; putative annotation: N/A; putative formula: C15H23N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.25,"smiles":null,"spectrum_id":"CCMSLIB00017314563","spectrum_index":48023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Acetoacetamido-2-benzimidazolone (delta mass: 41.0032 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.091,"smiles":null,"spectrum_id":"CCMSLIB00017314564","spectrum_index":48024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300526 Hordenine (delta mass: 165.0992 Da; putative annotation: N/A; putative formula: C10H15NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.222,"smiles":null,"spectrum_id":"CCMSLIB00017314565","spectrum_index":48025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 70.0617 Da; putative annotation: N/A; putative formula: C2H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.231,"smiles":null,"spectrum_id":"CCMSLIB00017314566","spectrum_index":48026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline [M+H-H2O]+; AIF; CE10; MS2Dec (delta mass: 203.0784 Da; putative annotation: N/A; putative formula: C5H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.175,"smiles":null,"spectrum_id":"CCMSLIB00017314567","spectrum_index":48027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 162.032 Da; putative annotation: Caffeic acid; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.092,"smiles":null,"spectrum_id":"CCMSLIB00017314568","spectrum_index":48028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 150.0315 Da; putative annotation: 2-Hydroxy-3-methoxybenzoic acid; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.092,"smiles":null,"spectrum_id":"CCMSLIB00017314569","spectrum_index":48029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 284.069 Da; putative annotation: 3,4',5-Trihydroxy-7-methoxyflavanone; putative formula: C16H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.193,"smiles":null,"spectrum_id":"CCMSLIB00017314570","spectrum_index":48030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 113.0841 Da; putative annotation: Norleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.234,"smiles":null,"spectrum_id":"CCMSLIB00017314571","spectrum_index":48031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 158.0353 Da; putative annotation: Massbank:BML01379 6-Hydroxy-4-methylcoumarin, 6-Hydroxy-4-methyl-2-benzopyrone; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.106,"smiles":null,"spectrum_id":"CCMSLIB00017314572","spectrum_index":48032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid - 30.0 eV (delta mass: 336.2247 Da; putative annotation: 13,14-Dihydro-15-ketoprostaglandin D1; putative formula: C20H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.338,"smiles":null,"spectrum_id":"CCMSLIB00017314573","spectrum_index":48033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 141.1153 Da; putative annotation: Pregabalin; putative formula: C8H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.175,"smiles":null,"spectrum_id":"CCMSLIB00017314574","spectrum_index":48034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 158.0367 Da; putative annotation: 7-Hydroxy-4-methylcoumarin; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.107,"smiles":null,"spectrum_id":"CCMSLIB00017314575","spectrum_index":48035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 166.1108 Da; putative annotation: Cyclo(alanylisoleucyl); putative formula: C9H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.223,"smiles":null,"spectrum_id":"CCMSLIB00017314576","spectrum_index":48036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 182.0684 Da; putative annotation: PyroGlu-Ala; putative formula: C8H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.171,"smiles":null,"spectrum_id":"CCMSLIB00017314577","spectrum_index":48037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 179.0744 Da; putative annotation: 4-Amino-3-(4-fluorophenyl)butanoic acid; putative formula: C10H10FNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.14,"smiles":null,"spectrum_id":"CCMSLIB00017314578","spectrum_index":48038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-3-[4-(carboxymethyl)phenyl]propanoic acid (delta mass: 132.0422 Da; putative annotation: D-Lyxose; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.134,"smiles":null,"spectrum_id":"CCMSLIB00017314579","spectrum_index":48039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylguanosine; AIF; CE30; MS2Dec (delta mass: 132.0337 Da; putative annotation: N/A; putative formula: C5H9O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.148,"smiles":null,"spectrum_id":"CCMSLIB00017314580","spectrum_index":48040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indolmycin (delta mass: 428.2852 Da; putative annotation: N/A; putative formula: C18H36N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.409,"smiles":null,"spectrum_id":"CCMSLIB00017314581","spectrum_index":48041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 335.2828 Da; putative annotation: N/A; putative formula: C21H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.369,"smiles":null,"spectrum_id":"CCMSLIB00017314582","spectrum_index":48042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 389.1489 Da; putative annotation: N/A; putative formula: C21H19N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.209,"smiles":null,"spectrum_id":"CCMSLIB00017314583","spectrum_index":48043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 106.0771 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.122,"smiles":null,"spectrum_id":"CCMSLIB00017314584","spectrum_index":48044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 18.0057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.117,"smiles":null,"spectrum_id":"CCMSLIB00017314585","spectrum_index":48045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(6-Aminohexyl)-1,6-hexanediamine (delta mass: 72.046 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.289,"smiles":null,"spectrum_id":"CCMSLIB00017314586","spectrum_index":48046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381001-01_C32H41NO11_ (delta mass: 615.2501 Da; putative annotation: N/A; putative formula: C24H37N7O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1231.53,"smiles":null,"spectrum_id":"CCMSLIB00017314587","spectrum_index":48047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-hydroxyquinoline (delta mass: 35.0403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.1,"smiles":null,"spectrum_id":"CCMSLIB00017314588","spectrum_index":48048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 68.0259 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017314589","spectrum_index":48049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 191.0404 Da; putative annotation: N/A; putative formula: C10H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.127,"smiles":null,"spectrum_id":"CCMSLIB00017314590","spectrum_index":48050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 275.2614 Da; putative annotation: N/A; putative formula: C19H33N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.374,"smiles":null,"spectrum_id":"CCMSLIB00017314591","spectrum_index":48051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 351.2155 Da; putative annotation: N/A; putative formula: C18H29N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.281,"smiles":null,"spectrum_id":"CCMSLIB00017314592","spectrum_index":48052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 114.0385 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.135,"smiles":null,"spectrum_id":"CCMSLIB00017314593","spectrum_index":48053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 142.0703 Da; putative annotation: N/A; putative formula: C2H6N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.136,"smiles":null,"spectrum_id":"CCMSLIB00017314594","spectrum_index":48054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 85.9885 Da; putative annotation: N/A; putative formula: H-2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.117,"smiles":null,"spectrum_id":"CCMSLIB00017314595","spectrum_index":48055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 531.9043 Da; putative annotation: N/A; putative formula: C23H16O-1S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":694.964,"smiles":null,"spectrum_id":"CCMSLIB00017314596","spectrum_index":48056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380136-01!1-(2,3-dihydropyrrol-1-yl)-8,9-dihydroxy-2-methyldecane-1,3-dione (delta mass: 17.0285 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.214,"smiles":null,"spectrum_id":"CCMSLIB00017314597","spectrum_index":48057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 74.0519 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.117,"smiles":null,"spectrum_id":"CCMSLIB00017314598","spectrum_index":48058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 30.0767 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.122,"smiles":null,"spectrum_id":"CCMSLIB00017314599","spectrum_index":48059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 475.3136 Da; putative annotation: N/A; putative formula: C29H41N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.374,"smiles":null,"spectrum_id":"CCMSLIB00017314600","spectrum_index":48060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 411.1688 Da; putative annotation: N/A; putative formula: C16H25N7O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.266,"smiles":null,"spectrum_id":"CCMSLIB00017314601","spectrum_index":48061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 309.0987 Da; putative annotation: N/A; putative formula: C12H24NO2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.248,"smiles":null,"spectrum_id":"CCMSLIB00017314602","spectrum_index":48062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 426.238 Da; putative annotation: N/A; putative formula: C22H30N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.335,"smiles":null,"spectrum_id":"CCMSLIB00017314603","spectrum_index":48063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 154.1143 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.195,"smiles":null,"spectrum_id":"CCMSLIB00017314604","spectrum_index":48064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 309.1365 Da; putative annotation: N/A; putative formula: C19H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.207,"smiles":null,"spectrum_id":"CCMSLIB00017314605","spectrum_index":48065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolidine (delta mass: 147.0532 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.186,"smiles":null,"spectrum_id":"CCMSLIB00017314606","spectrum_index":48066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]-2-furamide (delta mass: 16.0142 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.138,"smiles":null,"spectrum_id":"CCMSLIB00017314607","spectrum_index":48067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 284.1976 Da; putative annotation: N/A; putative formula: C16H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.279,"smiles":null,"spectrum_id":"CCMSLIB00017314608","spectrum_index":48068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homostachydrine (delta mass: 61.0035 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.121,"smiles":null,"spectrum_id":"CCMSLIB00017314609","spectrum_index":48069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 217.2169 Da; putative annotation: N/A; putative formula: C16H27NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.308,"smiles":null,"spectrum_id":"CCMSLIB00017314610","spectrum_index":48070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 32.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.176,"smiles":null,"spectrum_id":"CCMSLIB00017314611","spectrum_index":48071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 244.0965 Da; putative annotation: N/A; putative formula: C5H12N10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.22,"smiles":null,"spectrum_id":"CCMSLIB00017314612","spectrum_index":48072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 134.074 Da; putative annotation: N/A; putative formula: C2H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.254,"smiles":null,"spectrum_id":"CCMSLIB00017314613","spectrum_index":48073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 376.1041 Da; putative annotation: N/A; putative formula: C15H25N2O3PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.175,"smiles":null,"spectrum_id":"CCMSLIB00017314614","spectrum_index":48074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatol (delta mass: 113.0474 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.129,"smiles":null,"spectrum_id":"CCMSLIB00017314615","spectrum_index":48075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 142.0751 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.177,"smiles":null,"spectrum_id":"CCMSLIB00017314616","spectrum_index":48076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 362.1472 Da; putative annotation: N/A; putative formula: C20H27O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.234,"smiles":null,"spectrum_id":"CCMSLIB00017314617","spectrum_index":48077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 33.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.097,"smiles":null,"spectrum_id":"CCMSLIB00017314618","spectrum_index":48078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 28.0232 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.13,"smiles":null,"spectrum_id":"CCMSLIB00017314619","spectrum_index":48079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 34.0317 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.118,"smiles":null,"spectrum_id":"CCMSLIB00017314620","spectrum_index":48080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methylpyridine-2-carboxylic acid (delta mass: 57.0214 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.076,"smiles":null,"spectrum_id":"CCMSLIB00017314621","spectrum_index":48081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 103.0272 Da; putative annotation: N/A; putative formula: C3H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.103,"smiles":null,"spectrum_id":"CCMSLIB00017314622","spectrum_index":48082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 92.0344 Da; putative annotation: N/A; putative formula: H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.096,"smiles":null,"spectrum_id":"CCMSLIB00017314623","spectrum_index":48083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lys-Pro (delta mass: 486.195 Da; putative annotation: N/A; putative formula: C25H26N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.361,"smiles":null,"spectrum_id":"CCMSLIB00017314624","spectrum_index":48084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 98.0712 Da; putative annotation: N/A; putative formula: C2H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.246,"smiles":null,"spectrum_id":"CCMSLIB00017314625","spectrum_index":48085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.145,"smiles":null,"spectrum_id":"CCMSLIB00017314626","spectrum_index":48086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 465.237 Da; putative annotation: N/A; putative formula: C25H39NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.313,"smiles":null,"spectrum_id":"CCMSLIB00017314627","spectrum_index":48087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 490.0875 Da; putative annotation: N/A; putative formula: C30H18O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.148,"smiles":null,"spectrum_id":"CCMSLIB00017314628","spectrum_index":48088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 367.7183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.842,"smiles":null,"spectrum_id":"CCMSLIB00017314629","spectrum_index":48089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 84.0571 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.227,"smiles":null,"spectrum_id":"CCMSLIB00017314630","spectrum_index":48090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 404.2769 Da; putative annotation: N/A; putative formula: C21H40O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.368,"smiles":null,"spectrum_id":"CCMSLIB00017314631","spectrum_index":48091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 71.0752 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.225,"smiles":null,"spectrum_id":"CCMSLIB00017314632","spectrum_index":48092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Propanediol (delta mass: 42.0106 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":119.07,"smiles":null,"spectrum_id":"CCMSLIB00017314633","spectrum_index":48093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 192.2969 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.383,"smiles":null,"spectrum_id":"CCMSLIB00017314634","spectrum_index":48094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 164.0512 Da; putative annotation: N/A; putative formula: C6H12O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.137,"smiles":null,"spectrum_id":"CCMSLIB00017314635","spectrum_index":48095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 54.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.102,"smiles":null,"spectrum_id":"CCMSLIB00017314636","spectrum_index":48096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.039,"smiles":null,"spectrum_id":"CCMSLIB00017314637","spectrum_index":48097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 73.0561 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017314638","spectrum_index":48098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 73.0166 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.14,"smiles":null,"spectrum_id":"CCMSLIB00017314639","spectrum_index":48099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methylphenyl)-1H-indole (delta mass: 227.0921 Da; putative annotation: N/A; putative formula: C10H9N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.204,"smiles":null,"spectrum_id":"CCMSLIB00017314640","spectrum_index":48100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 90.0532 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.233,"smiles":null,"spectrum_id":"CCMSLIB00017314641","spectrum_index":48101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385848-01_C19H24N2O_(3alpha,14alpha,16alpha)-14,15-Dihydroeburnamenin-14-ol (delta mass: 38.0445 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.241,"smiles":null,"spectrum_id":"CCMSLIB00017314642","spectrum_index":48102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 422.0434 Da; putative annotation: N/A; putative formula: C26H14O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.177,"smiles":null,"spectrum_id":"CCMSLIB00017314643","spectrum_index":48103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ332502 Epinephrine|4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol (delta mass: 84.9977 Da; putative annotation: N/A; putative formula: C3H3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.095,"smiles":null,"spectrum_id":"CCMSLIB00017314644","spectrum_index":48104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 793.4626 Da; putative annotation: N/A; putative formula: C43H63N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":986.533,"smiles":null,"spectrum_id":"CCMSLIB00017314645","spectrum_index":48105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 392.2154 Da; putative annotation: N/A; putative formula: C19H37O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.255,"smiles":null,"spectrum_id":"CCMSLIB00017314646","spectrum_index":48106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 202.0592 Da; putative annotation: N/A; putative formula: C7H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.136,"smiles":null,"spectrum_id":"CCMSLIB00017314647","spectrum_index":48107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 185.1424 Da; putative annotation: N/A; putative formula: C10H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.234,"smiles":null,"spectrum_id":"CCMSLIB00017314648","spectrum_index":48108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 87.0315 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.118,"smiles":null,"spectrum_id":"CCMSLIB00017314649","spectrum_index":48109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 108.0422 Da; putative annotation: N/A; putative formula: C4H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.102,"smiles":null,"spectrum_id":"CCMSLIB00017314650","spectrum_index":48110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 492.0852 Da; putative annotation: N/A; putative formula: C22H16N6O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.145,"smiles":null,"spectrum_id":"CCMSLIB00017314651","spectrum_index":48111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 16.0192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.1,"smiles":null,"spectrum_id":"CCMSLIB00017314652","spectrum_index":48112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 130.0609 Da; putative annotation: N/A; putative formula: C2H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.21,"smiles":null,"spectrum_id":"CCMSLIB00017314653","spectrum_index":48113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.beta.-D-galactopyranosyl)-D-glucopyranose (delta mass: 494.1755 Da; putative annotation: N/A; putative formula: C22H31N4O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":878.326,"smiles":null,"spectrum_id":"CCMSLIB00017314654","spectrum_index":48114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 845.3058 Da; putative annotation: N/A; putative formula: C49H51NO8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1350.48,"smiles":null,"spectrum_id":"CCMSLIB00017314655","spectrum_index":48115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Ala (delta mass: 71.037 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.176,"smiles":null,"spectrum_id":"CCMSLIB00017314656","spectrum_index":48116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 166.0633 Da; putative annotation: N/A; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.149,"smiles":null,"spectrum_id":"CCMSLIB00017314657","spectrum_index":48117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 76.0337 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.21,"smiles":null,"spectrum_id":"CCMSLIB00017314658","spectrum_index":48118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 74.0449 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.22,"smiles":null,"spectrum_id":"CCMSLIB00017314659","spectrum_index":48119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 627.5746 Da; putative annotation: N/A; putative formula: C45H73N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":811.671,"smiles":null,"spectrum_id":"CCMSLIB00017314660","spectrum_index":48120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 9.984 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.055,"smiles":null,"spectrum_id":"CCMSLIB00017314661","spectrum_index":48121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.117,"smiles":null,"spectrum_id":"CCMSLIB00017314662","spectrum_index":48122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 28.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.128,"smiles":null,"spectrum_id":"CCMSLIB00017314663","spectrum_index":48123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leucrose (delta mass: 596.209 Da; putative annotation: N/A; putative formula: C33H40O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":939.333,"smiles":null,"spectrum_id":"CCMSLIB00017314664","spectrum_index":48124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dl-3-Indolelactic acid - 30.0 eV (delta mass: 173.032 Da; putative annotation: N/A; putative formula: C6H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.113,"smiles":null,"spectrum_id":"CCMSLIB00017314665","spectrum_index":48125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 132.0542 Da; putative annotation: N/A; putative formula: C4H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.156,"smiles":null,"spectrum_id":"CCMSLIB00017314666","spectrum_index":48126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cloethocarb (delta mass: 82.1745 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.243,"smiles":null,"spectrum_id":"CCMSLIB00017314667","spectrum_index":48127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 182.9212 Da; putative annotation: N/A; putative formula: CHN3O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.018,"smiles":null,"spectrum_id":"CCMSLIB00017314668","spectrum_index":48128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 77.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.155,"smiles":null,"spectrum_id":"CCMSLIB00017314669","spectrum_index":48129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 175.0722 Da; putative annotation: N/A; putative formula: C5H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.174,"smiles":null,"spectrum_id":"CCMSLIB00017314670","spectrum_index":48130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 474.1322 Da; putative annotation: N/A; putative formula: C20H22N6O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":817.256,"smiles":null,"spectrum_id":"CCMSLIB00017314671","spectrum_index":48131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 437.3815 Da; putative annotation: N/A; putative formula: C26H51N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.458,"smiles":null,"spectrum_id":"CCMSLIB00017314672","spectrum_index":48132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1251.4439 Da; putative annotation: N/A; putative formula: C97H57NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1473.54,"smiles":null,"spectrum_id":"CCMSLIB00017314673","spectrum_index":48133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 927.5197 Da; putative annotation: N/A; putative formula: C53H69N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.6,"smiles":null,"spectrum_id":"CCMSLIB00017314674","spectrum_index":48134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 360.1551 Da; putative annotation: N/A; putative formula: C17H24N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.241,"smiles":null,"spectrum_id":"CCMSLIB00017314675","spectrum_index":48135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 165.0312 Da; putative annotation: N/A; putative formula: C2H7N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.18,"smiles":null,"spectrum_id":"CCMSLIB00017314676","spectrum_index":48136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of E-N-Deoxyfructosyllysine (delta mass: 308.0648 Da; putative annotation: N/A; putative formula: C16H13N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":617.23,"smiles":null,"spectrum_id":"CCMSLIB00017314677","spectrum_index":48137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 255.1764 Da; putative annotation: N/A; putative formula: C13H25N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.299,"smiles":null,"spectrum_id":"CCMSLIB00017314678","spectrum_index":48138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 186.1042 Da; putative annotation: N/A; putative formula: C13H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.169,"smiles":null,"spectrum_id":"CCMSLIB00017314679","spectrum_index":48139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 411.2452 Da; putative annotation: N/A; putative formula: C23H41NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.337,"smiles":null,"spectrum_id":"CCMSLIB00017314680","spectrum_index":48140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 209.0893 Da; putative annotation: N/A; putative formula: C11H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.201,"smiles":null,"spectrum_id":"CCMSLIB00017314681","spectrum_index":48141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 440.2658 Da; putative annotation: N/A; putative formula: C20H37N6O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.363,"smiles":null,"spectrum_id":"CCMSLIB00017314682","spectrum_index":48142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 14.9182 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.961,"smiles":null,"spectrum_id":"CCMSLIB00017314683","spectrum_index":48143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 127.0839 Da; putative annotation: N/A; putative formula: C7H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.196,"smiles":null,"spectrum_id":"CCMSLIB00017314684","spectrum_index":48144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 118.0745 Da; putative annotation: N/A; putative formula: C4H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017314685","spectrum_index":48145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-His (delta mass: 113.0839 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.198,"smiles":null,"spectrum_id":"CCMSLIB00017314686","spectrum_index":48146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 59.0737 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.181,"smiles":null,"spectrum_id":"CCMSLIB00017314687","spectrum_index":48147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 26.9633 Da; putative annotation: N/A; putative formula: C9H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.07,"smiles":null,"spectrum_id":"CCMSLIB00017314688","spectrum_index":48148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 633.6389 Da; putative annotation: N/A; putative formula: C38H79N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":819.71,"smiles":null,"spectrum_id":"CCMSLIB00017314689","spectrum_index":48149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 719.2144 Da; putative annotation: N/A; putative formula: C34H33N13S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":941.312,"smiles":null,"spectrum_id":"CCMSLIB00017314690","spectrum_index":48150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 175.4188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.5,"smiles":null,"spectrum_id":"CCMSLIB00017314691","spectrum_index":48151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLIC ACID (delta mass: 282.1708 Da; putative annotation: N/A; putative formula: C14H18N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.226,"smiles":null,"spectrum_id":"CCMSLIB00017314692","spectrum_index":48152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indolepropionic acid (delta mass: 129.042 Da; putative annotation: D-(-)-Glutamic acid - 30.0 eV; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.128,"smiles":null,"spectrum_id":"CCMSLIB00017314693","spectrum_index":48153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 113.0845 Da; putative annotation: LEUCINE; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.255,"smiles":null,"spectrum_id":"CCMSLIB00017314694","spectrum_index":48154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 107.0373 Da; putative annotation: 5-Hydroxy-2-(hydroxymethyl)pyridine; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.113,"smiles":null,"spectrum_id":"CCMSLIB00017314695","spectrum_index":48155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Ile (delta mass: 99.0687 Da; putative annotation: L-(+)-Valine - 30.0 eV; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017314696","spectrum_index":48156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PAR_146.0966_8.3 (delta mass: 169.0986 Da; putative annotation: (1-Benzyl-1H-pyrazol-3-yl)methanamine; putative formula: C11H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.195,"smiles":null,"spectrum_id":"CCMSLIB00017314697","spectrum_index":48157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-methoxyphenyl)propylamine CollisionEnergy:205060 (delta mass: 120.0575 Da; putative annotation: 5-Norbornene-2-carboxylic acid; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.18,"smiles":null,"spectrum_id":"CCMSLIB00017314698","spectrum_index":48158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 157.0542 Da; putative annotation: 3-Indoleacetic acid; putative formula: C10H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.13,"smiles":null,"spectrum_id":"CCMSLIB00017314699","spectrum_index":48159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 374.2444 Da; putative annotation: 9-Oxo-11.alpha.,16R-dihydroxy-17-cyclobutyl-5Z,13E-dien-1-oic acid; putative formula: C23H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.325,"smiles":null,"spectrum_id":"CCMSLIB00017314700","spectrum_index":48160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 42.0212 Da; putative annotation: Urea; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.092,"smiles":null,"spectrum_id":"CCMSLIB00017314701","spectrum_index":48161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 115.0556 Da; putative annotation: N/A; putative formula: C5H10NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.131,"smiles":null,"spectrum_id":"CCMSLIB00017314702","spectrum_index":48162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 98.0766 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.236,"smiles":null,"spectrum_id":"CCMSLIB00017314703","spectrum_index":48163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 227.0901 Da; putative annotation: N/A; putative formula: C11H18NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.155,"smiles":null,"spectrum_id":"CCMSLIB00017314704","spectrum_index":48164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310692 Disaccharide(Hex-Hex) (delta mass: 97.9672 Da; putative annotation: N/A; putative formula: C2H-1N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.091,"smiles":null,"spectrum_id":"CCMSLIB00017314705","spectrum_index":48165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-2-propyl-1H-benzimidazole-6-carboxylic acid (delta mass: 199.0912 Da; putative annotation: N/A; putative formula: C13H14NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.204,"smiles":null,"spectrum_id":"CCMSLIB00017314706","spectrum_index":48166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 109.0376 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.197,"smiles":null,"spectrum_id":"CCMSLIB00017314707","spectrum_index":48167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 157.0741 Da; putative annotation: N/A; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.161,"smiles":null,"spectrum_id":"CCMSLIB00017314708","spectrum_index":48168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oleyl alcohol (delta mass: 56.0624 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.346,"smiles":null,"spectrum_id":"CCMSLIB00017314709","spectrum_index":48169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 35.0584 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.191,"smiles":null,"spectrum_id":"CCMSLIB00017314710","spectrum_index":48170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 272.1609 Da; putative annotation: N/A; putative formula: C11H16N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.326,"smiles":null,"spectrum_id":"CCMSLIB00017314711","spectrum_index":48171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 215.1116 Da; putative annotation: N/A; putative formula: C9H19N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.154,"smiles":null,"spectrum_id":"CCMSLIB00017314712","spectrum_index":48172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 885.4361 Da; putative annotation: N/A; putative formula: C49H59N9O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1092.52,"smiles":null,"spectrum_id":"CCMSLIB00017314713","spectrum_index":48173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylnicotinic acid (delta mass: 49.0013 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.056,"smiles":null,"spectrum_id":"CCMSLIB00017314714","spectrum_index":48174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2.alpha.-Mannobiose from NIST14 (delta mass: 89.046 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.169,"smiles":null,"spectrum_id":"CCMSLIB00017314715","spectrum_index":48175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 303.256 Da; putative annotation: N/A; putative formula: C20H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.352,"smiles":null,"spectrum_id":"CCMSLIB00017314716","spectrum_index":48176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coumaroyl putrescin (delta mass: 217.1105 Da; putative annotation: N/A; putative formula: C13H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.255,"smiles":null,"spectrum_id":"CCMSLIB00017314717","spectrum_index":48177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 282.0525 Da; putative annotation: N/A; putative formula: C16H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.139,"smiles":null,"spectrum_id":"CCMSLIB00017314718","spectrum_index":48178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 72.0412 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.216,"smiles":null,"spectrum_id":"CCMSLIB00017314719","spectrum_index":48179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 108.0314 Da; putative annotation: N/A; putative formula: C5H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.185,"smiles":null,"spectrum_id":"CCMSLIB00017314720","spectrum_index":48180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 84.0199 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.196,"smiles":null,"spectrum_id":"CCMSLIB00017314721","spectrum_index":48181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 265.241 Da; putative annotation: N/A; putative formula: C17H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.463,"smiles":null,"spectrum_id":"CCMSLIB00017314722","spectrum_index":48182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Volinanserin (delta mass: 251.1721 Da; putative annotation: N/A; putative formula: C15H25NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.385,"smiles":null,"spectrum_id":"CCMSLIB00017314723","spectrum_index":48183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 115.0669 Da; putative annotation: N/A; putative formula: C4H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.148,"smiles":null,"spectrum_id":"CCMSLIB00017314724","spectrum_index":48184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 108.13 Da; putative annotation: N/A; putative formula: C9H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.31,"smiles":null,"spectrum_id":"CCMSLIB00017314725","spectrum_index":48185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 46.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.165,"smiles":null,"spectrum_id":"CCMSLIB00017314726","spectrum_index":48186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 173.1003 Da; putative annotation: N/A; putative formula: C7H15N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.16,"smiles":null,"spectrum_id":"CCMSLIB00017314727","spectrum_index":48187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 14.0667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.137,"smiles":null,"spectrum_id":"CCMSLIB00017314728","spectrum_index":48188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 84.0389 Da; putative annotation: N/A; putative formula: C5H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.15,"smiles":null,"spectrum_id":"CCMSLIB00017314729","spectrum_index":48189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 236.2137 Da; putative annotation: N/A; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.267,"smiles":null,"spectrum_id":"CCMSLIB00017314730","spectrum_index":48190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 151.0932 Da; putative annotation: N/A; putative formula: C9H14NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.169,"smiles":null,"spectrum_id":"CCMSLIB00017314731","spectrum_index":48191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 226.078 Da; putative annotation: N/A; putative formula: C18H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.201,"smiles":null,"spectrum_id":"CCMSLIB00017314732","spectrum_index":48192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 46.9134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.995,"smiles":null,"spectrum_id":"CCMSLIB00017314733","spectrum_index":48193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 396.2273 Da; putative annotation: N/A; putative formula: C21H28N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.303,"smiles":null,"spectrum_id":"CCMSLIB00017314734","spectrum_index":48194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 175.1172 Da; putative annotation: N/A; putative formula: H9N13O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.254,"smiles":null,"spectrum_id":"CCMSLIB00017314735","spectrum_index":48195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 68.0473 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.191,"smiles":null,"spectrum_id":"CCMSLIB00017314736","spectrum_index":48196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 41.9061 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.982,"smiles":null,"spectrum_id":"CCMSLIB00017314737","spectrum_index":48197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 66.0556 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.154,"smiles":null,"spectrum_id":"CCMSLIB00017314738","spectrum_index":48198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethylselegiline (delta mass: 59.0255 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.153,"smiles":null,"spectrum_id":"CCMSLIB00017314739","spectrum_index":48199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 108.0424 Da; putative annotation: N/A; putative formula: C4H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.129,"smiles":null,"spectrum_id":"CCMSLIB00017314740","spectrum_index":48200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 342.1686 Da; putative annotation: N/A; putative formula: C18H30O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.302,"smiles":null,"spectrum_id":"CCMSLIB00017314741","spectrum_index":48201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 298.149 Da; putative annotation: N/A; putative formula: C9H22N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.303,"smiles":null,"spectrum_id":"CCMSLIB00017314742","spectrum_index":48202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 244.2203 Da; putative annotation: N/A; putative formula: C18H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.344,"smiles":null,"spectrum_id":"CCMSLIB00017314743","spectrum_index":48203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1,N11-Diethylnorspermine (delta mass: 208.0628 Da; putative annotation: N/A; putative formula: C5H12N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.333,"smiles":null,"spectrum_id":"CCMSLIB00017314744","spectrum_index":48204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 392.2912 Da; putative annotation: N/A; putative formula: C18H41N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.409,"smiles":null,"spectrum_id":"CCMSLIB00017314745","spectrum_index":48205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 132.0942 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.218,"smiles":null,"spectrum_id":"CCMSLIB00017314746","spectrum_index":48206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 163.0728 Da; putative annotation: N/A; putative formula: C4H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017314747","spectrum_index":48207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 515.1832 Da; putative annotation: N/A; putative formula: C24H37NO5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":819.338,"smiles":null,"spectrum_id":"CCMSLIB00017314748","spectrum_index":48208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 144.097 Da; putative annotation: N/A; putative formula: C8H16S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.199,"smiles":null,"spectrum_id":"CCMSLIB00017314749","spectrum_index":48209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 39.1264 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.208,"smiles":null,"spectrum_id":"CCMSLIB00017314750","spectrum_index":48210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 80.0089 Da; putative annotation: N/A; putative formula: C5H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.095,"smiles":null,"spectrum_id":"CCMSLIB00017314751","spectrum_index":48211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 61.0242 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.3,"smiles":null,"spectrum_id":"CCMSLIB00017314752","spectrum_index":48212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 75.029 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.089,"smiles":null,"spectrum_id":"CCMSLIB00017314753","spectrum_index":48213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 113.0683 Da; putative annotation: N/A; putative formula: C3H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.135,"smiles":null,"spectrum_id":"CCMSLIB00017314754","spectrum_index":48214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 272.0357 Da; putative annotation: N/A; putative formula: C11H12O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.106,"smiles":null,"spectrum_id":"CCMSLIB00017314755","spectrum_index":48215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 247.1974 Da; putative annotation: N/A; putative formula: C10H25N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.326,"smiles":null,"spectrum_id":"CCMSLIB00017314756","spectrum_index":48216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 200.1049 Da; putative annotation: N/A; putative formula: C10H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.165,"smiles":null,"spectrum_id":"CCMSLIB00017314757","spectrum_index":48217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 241.0904 Da; putative annotation: N/A; putative formula: C6H15N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.169,"smiles":null,"spectrum_id":"CCMSLIB00017314758","spectrum_index":48218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 81.0654 Da; putative annotation: N/A; putative formula: C4H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.251,"smiles":null,"spectrum_id":"CCMSLIB00017314759","spectrum_index":48219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 124.0888 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.164,"smiles":null,"spectrum_id":"CCMSLIB00017314760","spectrum_index":48220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 109.0314 Da; putative annotation: N/A; putative formula: C9H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.144,"smiles":null,"spectrum_id":"CCMSLIB00017314761","spectrum_index":48221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYLTRYPTAMINE (delta mass: 100.0115 Da; putative annotation: N/A; putative formula: N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.134,"smiles":null,"spectrum_id":"CCMSLIB00017314762","spectrum_index":48222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 344.7097 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.812,"smiles":null,"spectrum_id":"CCMSLIB00017314763","spectrum_index":48223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 17.9377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.086,"smiles":null,"spectrum_id":"CCMSLIB00017314764","spectrum_index":48224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Benzyl-1H-indol-5-ylamine (delta mass: 137.0576 Da; putative annotation: N/A; putative formula: C6H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.181,"smiles":null,"spectrum_id":"CCMSLIB00017314765","spectrum_index":48225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 391.1945 Da; putative annotation: N/A; putative formula: C18H34NO4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.281,"smiles":null,"spectrum_id":"CCMSLIB00017314766","spectrum_index":48226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005923 Tetrahydropapaveroline|1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 146.0584 Da; putative annotation: N/A; putative formula: C7H14O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.181,"smiles":null,"spectrum_id":"CCMSLIB00017314767","spectrum_index":48227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 176.0687 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.155,"smiles":null,"spectrum_id":"CCMSLIB00017314768","spectrum_index":48228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 131.059 Da; putative annotation: N/A; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.124,"smiles":null,"spectrum_id":"CCMSLIB00017314769","spectrum_index":48229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 100.0674 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017314770","spectrum_index":48230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 150.0679 Da; putative annotation: N/A; putative formula: C9H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.154,"smiles":null,"spectrum_id":"CCMSLIB00017314771","spectrum_index":48231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 37.9998 Da; putative annotation: N/A; putative formula: H-2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.049,"smiles":null,"spectrum_id":"CCMSLIB00017314772","spectrum_index":48232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 78.0311 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.091,"smiles":null,"spectrum_id":"CCMSLIB00017314773","spectrum_index":48233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 15.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.117,"smiles":null,"spectrum_id":"CCMSLIB00017314774","spectrum_index":48234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 127.0837 Da; putative annotation: N/A; putative formula: C7H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.175,"smiles":null,"spectrum_id":"CCMSLIB00017314775","spectrum_index":48235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 273.1937 Da; putative annotation: N/A; putative formula: C14H27NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.275,"smiles":null,"spectrum_id":"CCMSLIB00017314776","spectrum_index":48236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 315.2405 Da; putative annotation: N/A; putative formula: C17H33NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.322,"smiles":null,"spectrum_id":"CCMSLIB00017314777","spectrum_index":48237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolidine (delta mass: 48.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.175,"smiles":null,"spectrum_id":"CCMSLIB00017314778","spectrum_index":48238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 146.0371 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.161,"smiles":null,"spectrum_id":"CCMSLIB00017314779","spectrum_index":48239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 252.0865 Da; putative annotation: N/A; putative formula: C10H22OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.225,"smiles":null,"spectrum_id":"CCMSLIB00017314780","spectrum_index":48240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM836003 Indoline|Indoline|2,3-dihydro-1H-indole (delta mass: 256.22 Da; putative annotation: N/A; putative formula: C19H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.301,"smiles":null,"spectrum_id":"CCMSLIB00017314781","spectrum_index":48241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 99.0686 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.239,"smiles":null,"spectrum_id":"CCMSLIB00017314782","spectrum_index":48242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 120.0578 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.222,"smiles":null,"spectrum_id":"CCMSLIB00017314783","spectrum_index":48243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 382.7253 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.849,"smiles":null,"spectrum_id":"CCMSLIB00017314784","spectrum_index":48244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 174.0523 Da; putative annotation: N/A; putative formula: C7H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.164,"smiles":null,"spectrum_id":"CCMSLIB00017314785","spectrum_index":48245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 167.0934 Da; putative annotation: N/A; putative formula: C9H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.18,"smiles":null,"spectrum_id":"CCMSLIB00017314786","spectrum_index":48246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180232-02!7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one [IIN-based: Match] (delta mass: 106.0511 Da; putative annotation: N/A; putative formula: H7N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.205,"smiles":null,"spectrum_id":"CCMSLIB00017314787","spectrum_index":48247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 120.0007 Da; putative annotation: N/A; putative formula: C2H6N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.087,"smiles":null,"spectrum_id":"CCMSLIB00017314788","spectrum_index":48248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 686.414 Da; putative annotation: N/A; putative formula: C36H46N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1017.57,"smiles":null,"spectrum_id":"CCMSLIB00017314789","spectrum_index":48249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 255.0955 Da; putative annotation: N/A; putative formula: C8H17NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.155,"smiles":null,"spectrum_id":"CCMSLIB00017314790","spectrum_index":48250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 198.1046 Da; putative annotation: N/A; putative formula: C14H14O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.16,"smiles":null,"spectrum_id":"CCMSLIB00017314791","spectrum_index":48251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 88.4903 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.634,"smiles":null,"spectrum_id":"CCMSLIB00017314792","spectrum_index":48252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 160.1079 Da; putative annotation: N/A; putative formula: C4H12N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.283,"smiles":null,"spectrum_id":"CCMSLIB00017314793","spectrum_index":48253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 61.0055 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.113,"smiles":null,"spectrum_id":"CCMSLIB00017314794","spectrum_index":48254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 134.0735 Da; putative annotation: N/A; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.15,"smiles":null,"spectrum_id":"CCMSLIB00017314795","spectrum_index":48255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 41.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.112,"smiles":null,"spectrum_id":"CCMSLIB00017314796","spectrum_index":48256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 310.0493 Da; putative annotation: N/A; putative formula: C11H14N6O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.183,"smiles":null,"spectrum_id":"CCMSLIB00017314797","spectrum_index":48257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 79.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.075,"smiles":null,"spectrum_id":"CCMSLIB00017314798","spectrum_index":48258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 471.8105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.871,"smiles":null,"spectrum_id":"CCMSLIB00017314799","spectrum_index":48259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-Isopropoxy-5-(trifluoromethyl)phenyl]amine (delta mass: 60.0599 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.154,"smiles":null,"spectrum_id":"CCMSLIB00017314800","spectrum_index":48260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 174.0227 Da; putative annotation: N/A; putative formula: C10H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.13,"smiles":null,"spectrum_id":"CCMSLIB00017314801","spectrum_index":48261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 480.091 Da; putative annotation: N/A; putative formula: C24H21N2O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.203,"smiles":null,"spectrum_id":"CCMSLIB00017314802","spectrum_index":48262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 50.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.165,"smiles":null,"spectrum_id":"CCMSLIB00017314803","spectrum_index":48263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rhetsinine (delta mass: 141.075 Da; putative annotation: N/A; putative formula: C3H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.214,"smiles":null,"spectrum_id":"CCMSLIB00017314804","spectrum_index":48264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 537.3461 Da; putative annotation: N/A; putative formula: C26H47N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.438,"smiles":null,"spectrum_id":"CCMSLIB00017314805","spectrum_index":48265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Arg from NIST14 (delta mass: 343.1397 Da; putative annotation: N/A; putative formula: C12H26NO8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.343,"smiles":null,"spectrum_id":"CCMSLIB00017314806","spectrum_index":48266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 63.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.202,"smiles":null,"spectrum_id":"CCMSLIB00017314807","spectrum_index":48267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 278.2603 Da; putative annotation: N/A; putative formula: C19H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.357,"smiles":null,"spectrum_id":"CCMSLIB00017314808","spectrum_index":48268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 69.0574 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.18,"smiles":null,"spectrum_id":"CCMSLIB00017314809","spectrum_index":48269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 624.5276 Da; putative annotation: N/A; putative formula: C45H68O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.599,"smiles":null,"spectrum_id":"CCMSLIB00017314810","spectrum_index":48270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 32.0084 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.126,"smiles":null,"spectrum_id":"CCMSLIB00017314811","spectrum_index":48271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 78.0116 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.093,"smiles":null,"spectrum_id":"CCMSLIB00017314812","spectrum_index":48272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 306.095 Da; putative annotation: N/A; putative formula: C12H18O9)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.16,"smiles":null,"spectrum_id":"CCMSLIB00017314813","spectrum_index":48273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 37.9768 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.089,"smiles":null,"spectrum_id":"CCMSLIB00017314814","spectrum_index":48274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxy-2,2-dimethyl-4-chromanol (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017314815","spectrum_index":48275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 40.0462 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017314816","spectrum_index":48276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 36.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.159,"smiles":null,"spectrum_id":"CCMSLIB00017314817","spectrum_index":48277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-6-carboxamide, N-hydroxy-1-[(4-methoxyphenyl)methyl]- (delta mass: 55.9899 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.113,"smiles":null,"spectrum_id":"CCMSLIB00017314818","spectrum_index":48278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine ethyl ester (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.128,"smiles":null,"spectrum_id":"CCMSLIB00017314819","spectrum_index":48279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 128.095 Da; putative annotation: N/A; putative formula: C6H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.187,"smiles":null,"spectrum_id":"CCMSLIB00017314820","spectrum_index":48280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 186.0677 Da; putative annotation: N/A; putative formula: C7H10N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.138,"smiles":null,"spectrum_id":"CCMSLIB00017314821","spectrum_index":48281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 216.1502 Da; putative annotation: N/A; putative formula: C15H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.205,"smiles":null,"spectrum_id":"CCMSLIB00017314822","spectrum_index":48282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Armepavine (delta mass: 106.048 Da; putative annotation: N/A; putative formula: CH6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.223,"smiles":null,"spectrum_id":"CCMSLIB00017314823","spectrum_index":48283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 202.0787 Da; putative annotation: N/A; putative formula: C8H16N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.165,"smiles":null,"spectrum_id":"CCMSLIB00017314824","spectrum_index":48284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 192.9914 Da; putative annotation: N/A; putative formula: C3H7N5O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.062,"smiles":null,"spectrum_id":"CCMSLIB00017314825","spectrum_index":48285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 262.0952 Da; putative annotation: N/A; putative formula: C13H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.249,"smiles":null,"spectrum_id":"CCMSLIB00017314826","spectrum_index":48286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 283.1051 Da; putative annotation: N/A; putative formula: C13H17NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.181,"smiles":null,"spectrum_id":"CCMSLIB00017314827","spectrum_index":48287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 817.726 Da; putative annotation: N/A; putative formula: C50H95N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1039.82,"smiles":null,"spectrum_id":"CCMSLIB00017314828","spectrum_index":48288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00480 Hydrocinchonine (delta mass: 17.9242 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.12,"smiles":null,"spectrum_id":"CCMSLIB00017314829","spectrum_index":48289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-.alpha.-methyltryptamine (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.144,"smiles":null,"spectrum_id":"CCMSLIB00017314830","spectrum_index":48290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 213.1117 Da; putative annotation: N/A; putative formula: C9H15N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.266,"smiles":null,"spectrum_id":"CCMSLIB00017314831","spectrum_index":48291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 109.0651 Da; putative annotation: N/A; putative formula: C5H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.146,"smiles":null,"spectrum_id":"CCMSLIB00017314832","spectrum_index":48292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 27.9862 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.051,"smiles":null,"spectrum_id":"CCMSLIB00017314833","spectrum_index":48293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 114.9982 Da; putative annotation: N/A; putative formula: C4H6NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.08,"smiles":null,"spectrum_id":"CCMSLIB00017314834","spectrum_index":48294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 54.1268 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.168,"smiles":null,"spectrum_id":"CCMSLIB00017314835","spectrum_index":48295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01040 Hexahydrocurcumin (delta mass: 119.058 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.238,"smiles":null,"spectrum_id":"CCMSLIB00017314836","spectrum_index":48296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 102.0759 Da; putative annotation: N/A; putative formula: H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.124,"smiles":null,"spectrum_id":"CCMSLIB00017314837","spectrum_index":48297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 288.6328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.73,"smiles":null,"spectrum_id":"CCMSLIB00017314838","spectrum_index":48298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Amino-2-quinolinecarboxylic acid (delta mass: 83.0734 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.139,"smiles":null,"spectrum_id":"CCMSLIB00017314839","spectrum_index":48299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 56.0267 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.103,"smiles":null,"spectrum_id":"CCMSLIB00017314840","spectrum_index":48300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 58.0054 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.154,"smiles":null,"spectrum_id":"CCMSLIB00017314841","spectrum_index":48301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trifluperidol (delta mass: 146.0286 Da; putative annotation: N/A; putative formula: C9H7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.202,"smiles":null,"spectrum_id":"CCMSLIB00017314842","spectrum_index":48302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 326.1369 Da; putative annotation: N/A; putative formula: C19H23N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.197,"smiles":null,"spectrum_id":"CCMSLIB00017314843","spectrum_index":48303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (delta mass: 131.0384 Da; putative annotation: N/A; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.142,"smiles":null,"spectrum_id":"CCMSLIB00017314844","spectrum_index":48304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 282.219 Da; putative annotation: N/A; putative formula: C17H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.295,"smiles":null,"spectrum_id":"CCMSLIB00017314845","spectrum_index":48305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Nitro-1-propenyl)indole (delta mass: 57.0097 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.091,"smiles":null,"spectrum_id":"CCMSLIB00017314846","spectrum_index":48306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 41.9168 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.039,"smiles":null,"spectrum_id":"CCMSLIB00017314847","spectrum_index":48307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 312.2124 Da; putative annotation: N/A; putative formula: C18H32O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.283,"smiles":null,"spectrum_id":"CCMSLIB00017314848","spectrum_index":48308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 208.1096 Da; putative annotation: N/A; putative formula: C12H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.196,"smiles":null,"spectrum_id":"CCMSLIB00017314849","spectrum_index":48309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Tyr (delta mass: 163.0627 Da; putative annotation: DL-o-Tyrosine; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.176,"smiles":null,"spectrum_id":"CCMSLIB00017314850","spectrum_index":48310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 129.0424 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.124,"smiles":null,"spectrum_id":"CCMSLIB00017314851","spectrum_index":48311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 178.0366 Da; putative annotation: 3-(4-Fluorobenzoyl)propionic acid; putative formula: C10H7FO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.082,"smiles":null,"spectrum_id":"CCMSLIB00017314852","spectrum_index":48312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 159.0698 Da; putative annotation: 1-(2-Hydroxyphenyl)-2-pyrrolidinone; putative formula: C10H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.141,"smiles":null,"spectrum_id":"CCMSLIB00017314853","spectrum_index":48313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 143.0583 Da; putative annotation: 2-Aminoadipic acid; AIF; CE0; MS2Dec; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.129,"smiles":null,"spectrum_id":"CCMSLIB00017314854","spectrum_index":48314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 126.0675 Da; putative annotation: 3-Tetrahydro-2-furanylpropanoic acid; putative formula: C7H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.159,"smiles":null,"spectrum_id":"CCMSLIB00017314855","spectrum_index":48315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 130.0436 Da; putative annotation: Atropic acid; putative formula: C9H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.093,"smiles":null,"spectrum_id":"CCMSLIB00017314856","spectrum_index":48316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 262.2248 Da; putative annotation: linoleic acid; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.29,"smiles":null,"spectrum_id":"CCMSLIB00017314857","spectrum_index":48317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 254.0215 Da; putative annotation: 1,2,5,8-Tetrahydroxyanthracene-9,10-dione; putative formula: C14H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.082,"smiles":null,"spectrum_id":"CCMSLIB00017314858","spectrum_index":48318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 113.0838 Da; putative annotation: 6-Aminocaproic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.155,"smiles":null,"spectrum_id":"CCMSLIB00017314859","spectrum_index":48319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 111.0681 Da; putative annotation: Cyclopentanecarboxylic acid, 3-amino-, (1S,3R)-; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017314860","spectrum_index":48320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 286.1929 Da; putative annotation: h_266_oxandrolone_m3; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.316,"smiles":null,"spectrum_id":"CCMSLIB00017314861","spectrum_index":48321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 338.2457 Da; putative annotation: 13,14-Dihydroprostaglandin F2.alpha.; putative formula: C20H34O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.342,"smiles":null,"spectrum_id":"CCMSLIB00017314862","spectrum_index":48322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 382.172 Da; putative annotation: NCGC00380157-01_C23H28O6_6-(Hydroxymethyl)-4-methoxy-6,9a-dimethyl-3-oxo-1,3,4,5,5a,6,7,8,9,9a-decahydronaphtho[1,2-c]furan-5-yl benzoate; putative formula: C23H26O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.284,"smiles":null,"spectrum_id":"CCMSLIB00017314863","spectrum_index":48323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 214.0993 Da; putative annotation: Asp-Val; putative formula: C9H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017314864","spectrum_index":48324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 28.9979 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.11,"smiles":null,"spectrum_id":"CCMSLIB00017314865","spectrum_index":48325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 112.0162 Da; putative annotation: N/A; putative formula: C5H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.108,"smiles":null,"spectrum_id":"CCMSLIB00017314866","spectrum_index":48326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 376.1543 Da; putative annotation: N/A; putative formula: C14H20N10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.235,"smiles":null,"spectrum_id":"CCMSLIB00017314867","spectrum_index":48327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 408.3842 Da; putative annotation: N/A; putative formula: C24H48N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.499,"smiles":null,"spectrum_id":"CCMSLIB00017314868","spectrum_index":48328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 175.0547 Da; putative annotation: N/A; putative formula: C10H10NP)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.12,"smiles":null,"spectrum_id":"CCMSLIB00017314869","spectrum_index":48329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpyridin-4-ylamine (delta mass: 46.0533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.129,"smiles":null,"spectrum_id":"CCMSLIB00017314870","spectrum_index":48330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 124.067 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.341,"smiles":null,"spectrum_id":"CCMSLIB00017314871","spectrum_index":48331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 444.2476 Da; putative annotation: N/A; putative formula: C23H43O2P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.318,"smiles":null,"spectrum_id":"CCMSLIB00017314872","spectrum_index":48332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 76.0503 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.168,"smiles":null,"spectrum_id":"CCMSLIB00017314873","spectrum_index":48333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 119.0468 Da; putative annotation: N/A; putative formula: C6H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.108,"smiles":null,"spectrum_id":"CCMSLIB00017314874","spectrum_index":48334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 865.483 Da; putative annotation: N/A; putative formula: C45H71NO15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.55,"smiles":null,"spectrum_id":"CCMSLIB00017314875","spectrum_index":48335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 144.1141 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.257,"smiles":null,"spectrum_id":"CCMSLIB00017314876","spectrum_index":48336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 910.5268 Da; putative annotation: N/A; putative formula: C58H62N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1253.65,"smiles":null,"spectrum_id":"CCMSLIB00017314877","spectrum_index":48337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 297.1741 Da; putative annotation: N/A; putative formula: C12H23N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.349,"smiles":null,"spectrum_id":"CCMSLIB00017314878","spectrum_index":48338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-(Pyridin-3-yl)furan-2-yl]methanamine (delta mass: 257.2432 Da; putative annotation: N/A; putative formula: C10H27N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.33,"smiles":null,"spectrum_id":"CCMSLIB00017314879","spectrum_index":48339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 245.0951 Da; putative annotation: N/A; putative formula: C16H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.186,"smiles":null,"spectrum_id":"CCMSLIB00017314880","spectrum_index":48340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 41.0276 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.156,"smiles":null,"spectrum_id":"CCMSLIB00017314881","spectrum_index":48341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 360.2714 Da; putative annotation: N/A; putative formula: C21H36N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.42,"smiles":null,"spectrum_id":"CCMSLIB00017314882","spectrum_index":48342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 395.2199 Da; putative annotation: N/A; putative formula: C17H30N7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.317,"smiles":null,"spectrum_id":"CCMSLIB00017314883","spectrum_index":48343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 56.0515 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.185,"smiles":null,"spectrum_id":"CCMSLIB00017314884","spectrum_index":48344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 47.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.102,"smiles":null,"spectrum_id":"CCMSLIB00017314885","spectrum_index":48345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 158.1301 Da; putative annotation: N/A; putative formula: C9H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.227,"smiles":null,"spectrum_id":"CCMSLIB00017314886","spectrum_index":48346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 238.1726 Da; putative annotation: N/A; putative formula: C18H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.312,"smiles":null,"spectrum_id":"CCMSLIB00017314887","spectrum_index":48347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 439.4752 Da; putative annotation: N/A; putative formula: C25H57N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.551,"smiles":null,"spectrum_id":"CCMSLIB00017314888","spectrum_index":48348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 94.1113 Da; putative annotation: N/A; putative formula: C8H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.192,"smiles":null,"spectrum_id":"CCMSLIB00017314889","spectrum_index":48349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephromopsic acid (delta mass: 123.008 Da; putative annotation: N/A; putative formula: C2H6NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.261,"smiles":null,"spectrum_id":"CCMSLIB00017314890","spectrum_index":48350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 228.1111 Da; putative annotation: N/A; putative formula: C10H16N2O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.198,"smiles":null,"spectrum_id":"CCMSLIB00017314891","spectrum_index":48351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 338.082 Da; putative annotation: N/A; putative formula: C18H15N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.211,"smiles":null,"spectrum_id":"CCMSLIB00017314892","spectrum_index":48352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 11.9984 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.116,"smiles":null,"spectrum_id":"CCMSLIB00017314893","spectrum_index":48353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 72.0296 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.07,"smiles":null,"spectrum_id":"CCMSLIB00017314894","spectrum_index":48354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 182.093 Da; putative annotation: N/A; putative formula: C10H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.153,"smiles":null,"spectrum_id":"CCMSLIB00017314895","spectrum_index":48355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sterigmatocystin (delta mass: 26.0171 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.088,"smiles":null,"spectrum_id":"CCMSLIB00017314896","spectrum_index":48356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 86.0865 Da; putative annotation: N/A; putative formula: C4H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.141,"smiles":null,"spectrum_id":"CCMSLIB00017314897","spectrum_index":48357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 80.0557 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.163,"smiles":null,"spectrum_id":"CCMSLIB00017314898","spectrum_index":48358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 510.2474 Da; putative annotation: N/A; putative formula: C27H42O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":855.417,"smiles":null,"spectrum_id":"CCMSLIB00017314899","spectrum_index":48359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 44.0268 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.113,"smiles":null,"spectrum_id":"CCMSLIB00017314900","spectrum_index":48360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 95.0846 Da; putative annotation: N/A; putative formula: C5H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.249,"smiles":null,"spectrum_id":"CCMSLIB00017314901","spectrum_index":48361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CARBAZOLE CollisionEnergy:205060 (delta mass: 297.0948 Da; putative annotation: N/A; putative formula: C16H17N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.176,"smiles":null,"spectrum_id":"CCMSLIB00017314902","spectrum_index":48362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 116.0474 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.176,"smiles":null,"spectrum_id":"CCMSLIB00017314903","spectrum_index":48363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 136.232 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.323,"smiles":null,"spectrum_id":"CCMSLIB00017314904","spectrum_index":48364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 594.3396 Da; putative annotation: N/A; putative formula: C37H46N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.415,"smiles":null,"spectrum_id":"CCMSLIB00017314905","spectrum_index":48365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 44.0702 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.256,"smiles":null,"spectrum_id":"CCMSLIB00017314906","spectrum_index":48366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 122.0579 Da; putative annotation: N/A; putative formula: C5H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.176,"smiles":null,"spectrum_id":"CCMSLIB00017314907","spectrum_index":48367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 116.0374 Da; putative annotation: N/A; putative formula: C7H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.103,"smiles":null,"spectrum_id":"CCMSLIB00017314908","spectrum_index":48368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 215.1035 Da; putative annotation: N/A; putative formula: C8H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.206,"smiles":null,"spectrum_id":"CCMSLIB00017314909","spectrum_index":48369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 439.211 Da; putative annotation: N/A; putative formula: C24H29N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.323,"smiles":null,"spectrum_id":"CCMSLIB00017314910","spectrum_index":48370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 331.2196 Da; putative annotation: N/A; putative formula: C18H29N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.379,"smiles":null,"spectrum_id":"CCMSLIB00017314911","spectrum_index":48371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 359.1441 Da; putative annotation: N/A; putative formula: C13H21N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.298,"smiles":null,"spectrum_id":"CCMSLIB00017314912","spectrum_index":48372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 182.0225 Da; putative annotation: N/A; putative formula: C9H10S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.135,"smiles":null,"spectrum_id":"CCMSLIB00017314913","spectrum_index":48373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 44.0251 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.148,"smiles":null,"spectrum_id":"CCMSLIB00017314914","spectrum_index":48374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 106.0266 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.069,"smiles":null,"spectrum_id":"CCMSLIB00017314915","spectrum_index":48375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Pro-Arg (delta mass: 69.0606 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.28,"smiles":null,"spectrum_id":"CCMSLIB00017314916","spectrum_index":48376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 56.0999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.16,"smiles":null,"spectrum_id":"CCMSLIB00017314917","spectrum_index":48377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 38.0154 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.091,"smiles":null,"spectrum_id":"CCMSLIB00017314918","spectrum_index":48378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 188.058 Da; putative annotation: N/A; putative formula: C10H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.134,"smiles":null,"spectrum_id":"CCMSLIB00017314919","spectrum_index":48379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 74.0368 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.134,"smiles":null,"spectrum_id":"CCMSLIB00017314920","spectrum_index":48380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00160283-01!1-(8-Quinolinyl)-beta-carboline (delta mass: 45.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.171,"smiles":null,"spectrum_id":"CCMSLIB00017314921","spectrum_index":48381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 496.2292 Da; putative annotation: N/A; putative formula: C30H40S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.289,"smiles":null,"spectrum_id":"CCMSLIB00017314922","spectrum_index":48382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 28.0743 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.154,"smiles":null,"spectrum_id":"CCMSLIB00017314923","spectrum_index":48383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 32.9849 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.045,"smiles":null,"spectrum_id":"CCMSLIB00017314924","spectrum_index":48384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 45.0713 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.163,"smiles":null,"spectrum_id":"CCMSLIB00017314925","spectrum_index":48385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 40.0319 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.181,"smiles":null,"spectrum_id":"CCMSLIB00017314926","spectrum_index":48386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 173.0769 Da; putative annotation: N/A; putative formula: C2H7N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.213,"smiles":null,"spectrum_id":"CCMSLIB00017314927","spectrum_index":48387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 45.0103 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017314928","spectrum_index":48388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 476.1114 Da; putative annotation: N/A; putative formula: C19H20N6O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.172,"smiles":null,"spectrum_id":"CCMSLIB00017314929","spectrum_index":48389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 72.036 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.138,"smiles":null,"spectrum_id":"CCMSLIB00017314930","spectrum_index":48390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 121.0594 Da; putative annotation: N/A; putative formula: CH7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.188,"smiles":null,"spectrum_id":"CCMSLIB00017314931","spectrum_index":48391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 96.0432 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.14,"smiles":null,"spectrum_id":"CCMSLIB00017314932","spectrum_index":48392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 76.0688 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.15,"smiles":null,"spectrum_id":"CCMSLIB00017314933","spectrum_index":48393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 96.0213 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017314934","spectrum_index":48394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 605.2189 Da; putative annotation: N/A; putative formula: C24H39N5O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.279,"smiles":null,"spectrum_id":"CCMSLIB00017314935","spectrum_index":48395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 133.0957 Da; putative annotation: N/A; putative formula: C3H11N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.155,"smiles":null,"spectrum_id":"CCMSLIB00017314936","spectrum_index":48396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 120.0212 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.123,"smiles":null,"spectrum_id":"CCMSLIB00017314937","spectrum_index":48397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 206.0726 Da; putative annotation: N/A; putative formula: C7H14N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.201,"smiles":null,"spectrum_id":"CCMSLIB00017314938","spectrum_index":48398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 170.1053 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.244,"smiles":null,"spectrum_id":"CCMSLIB00017314939","spectrum_index":48399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 74.9223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.934,"smiles":null,"spectrum_id":"CCMSLIB00017314940","spectrum_index":48400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 207.6741 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.734,"smiles":null,"spectrum_id":"CCMSLIB00017314941","spectrum_index":48401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 243.1851 Da; putative annotation: N/A; putative formula: C14H21N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.298,"smiles":null,"spectrum_id":"CCMSLIB00017314942","spectrum_index":48402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetic acid - 40.0 eV (delta mass: 152.2133 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.284,"smiles":null,"spectrum_id":"CCMSLIB00017314943","spectrum_index":48403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250803 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 298.2509 Da; putative annotation: N/A; putative formula: C18H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.311,"smiles":null,"spectrum_id":"CCMSLIB00017314944","spectrum_index":48404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hypaphorine (delta mass: 185.9987 Da; putative annotation: N/A; putative formula: C7H6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.143,"smiles":null,"spectrum_id":"CCMSLIB00017314945","spectrum_index":48405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylbutanoic acid (delta mass: 41.0637 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.15,"smiles":null,"spectrum_id":"CCMSLIB00017314946","spectrum_index":48406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Indolinone (delta mass: 14.04 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.1,"smiles":null,"spectrum_id":"CCMSLIB00017314947","spectrum_index":48407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 50.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.099,"smiles":null,"spectrum_id":"CCMSLIB00017314948","spectrum_index":48408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.beta.-Homoglutamine (delta mass: 224.2143 Da; putative annotation: N/A; putative formula: C15H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.306,"smiles":null,"spectrum_id":"CCMSLIB00017314949","spectrum_index":48409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 27.9913 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.112,"smiles":null,"spectrum_id":"CCMSLIB00017314950","spectrum_index":48410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 228.1551 Da; putative annotation: N/A; putative formula: C13H24OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.257,"smiles":null,"spectrum_id":"CCMSLIB00017314951","spectrum_index":48411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 563.3599 Da; putative annotation: N/A; putative formula: C32H41N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.462,"smiles":null,"spectrum_id":"CCMSLIB00017314952","spectrum_index":48412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 45.0933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.153,"smiles":null,"spectrum_id":"CCMSLIB00017314953","spectrum_index":48413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 320.2717 Da; putative annotation: N/A; putative formula: C21H36O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.322,"smiles":null,"spectrum_id":"CCMSLIB00017314954","spectrum_index":48414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 163.0359 Da; putative annotation: N/A; putative formula: C3HN9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.081,"smiles":null,"spectrum_id":"CCMSLIB00017314955","spectrum_index":48415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 446.2099 Da; putative annotation: N/A; putative formula: C20H36N2O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.306,"smiles":null,"spectrum_id":"CCMSLIB00017314956","spectrum_index":48416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 238.1291 Da; putative annotation: N/A; putative formula: C8H14N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.256,"smiles":null,"spectrum_id":"CCMSLIB00017314957","spectrum_index":48417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 124.0414 Da; putative annotation: N/A; putative formula: C9H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.144,"smiles":null,"spectrum_id":"CCMSLIB00017314958","spectrum_index":48418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 124.0279 Da; putative annotation: N/A; putative formula: C5H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.14,"smiles":null,"spectrum_id":"CCMSLIB00017314959","spectrum_index":48419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 104.0262 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.071,"smiles":null,"spectrum_id":"CCMSLIB00017314960","spectrum_index":48420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 342.3678 Da; putative annotation: N/A; putative formula: C26H46O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.444,"smiles":null,"spectrum_id":"CCMSLIB00017314961","spectrum_index":48421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 432.2715 Da; putative annotation: N/A; putative formula: C27H36N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.337,"smiles":null,"spectrum_id":"CCMSLIB00017314962","spectrum_index":48422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C5:0 (delta mass: 164.9218 Da; putative annotation: N/A; putative formula: C3H3NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.145,"smiles":null,"spectrum_id":"CCMSLIB00017314963","spectrum_index":48423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 164.0409 Da; putative annotation: N/A; putative formula: C8H8N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.103,"smiles":null,"spectrum_id":"CCMSLIB00017314964","spectrum_index":48424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 17.8818 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.947,"smiles":null,"spectrum_id":"CCMSLIB00017314965","spectrum_index":48425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 24.0356 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.31,"smiles":null,"spectrum_id":"CCMSLIB00017314966","spectrum_index":48426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 118.0417 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.106,"smiles":null,"spectrum_id":"CCMSLIB00017314967","spectrum_index":48427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 105.3875 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.5,"smiles":null,"spectrum_id":"CCMSLIB00017314968","spectrum_index":48428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 162.061 Da; putative annotation: N/A; putative formula: C9H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.21,"smiles":null,"spectrum_id":"CCMSLIB00017314969","spectrum_index":48429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-pentyl- (delta mass: 51.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.175,"smiles":null,"spectrum_id":"CCMSLIB00017314970","spectrum_index":48430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 195.1687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.227,"smiles":null,"spectrum_id":"CCMSLIB00017314971","spectrum_index":48431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 174.1839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.281,"smiles":null,"spectrum_id":"CCMSLIB00017314972","spectrum_index":48432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 35.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017314973","spectrum_index":48433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140302 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 158.1646 Da; putative annotation: N/A; putative formula: C6H18N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.261,"smiles":null,"spectrum_id":"CCMSLIB00017314974","spectrum_index":48434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PM018176 Spermidine-di-p-coumaroyl (delta mass: 515.2902 Da; putative annotation: N/A; putative formula: C30H37N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":953.529,"smiles":null,"spectrum_id":"CCMSLIB00017314975","spectrum_index":48435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 715.9647 Da; putative annotation: N/A; putative formula: C16H15N8O19P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":938.062,"smiles":null,"spectrum_id":"CCMSLIB00017314976","spectrum_index":48436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosamine (delta mass: 625.3455 Da; putative annotation: N/A; putative formula: C45H43N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.443,"smiles":null,"spectrum_id":"CCMSLIB00017314977","spectrum_index":48437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 669.2994 Da; putative annotation: N/A; putative formula: C30H35N15O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.37,"smiles":null,"spectrum_id":"CCMSLIB00017314978","spectrum_index":48438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luciferin (delta mass: 46.0113 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.016,"smiles":null,"spectrum_id":"CCMSLIB00017314979","spectrum_index":48439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 222.2922 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.378,"smiles":null,"spectrum_id":"CCMSLIB00017314980","spectrum_index":48440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 207.0496 Da; putative annotation: N/A; putative formula: C6H13N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.115,"smiles":null,"spectrum_id":"CCMSLIB00017314981","spectrum_index":48441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 156.1146 Da; putative annotation: N/A; putative formula: C9H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.227,"smiles":null,"spectrum_id":"CCMSLIB00017314982","spectrum_index":48442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 114.0822 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.206,"smiles":null,"spectrum_id":"CCMSLIB00017314983","spectrum_index":48443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Propanediol (delta mass: 37.03 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":114.09,"smiles":null,"spectrum_id":"CCMSLIB00017314984","spectrum_index":48444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-Amino-2-methylpropyl)urea (delta mass: 156.1011 Da; putative annotation: N/A; putative formula: C6H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.214,"smiles":null,"spectrum_id":"CCMSLIB00017314985","spectrum_index":48445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 53.0379 Da; putative annotation: N/A; putative formula: C2H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.109,"smiles":null,"spectrum_id":"CCMSLIB00017314986","spectrum_index":48446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385769-01!4-[3,5-dihydroxy-7-(4-hydroxyphenyl)heptyl]benzene-1,2-diol (delta mass: 67.0841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.254,"smiles":null,"spectrum_id":"CCMSLIB00017314987","spectrum_index":48447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 322.1422 Da; putative annotation: N/A; putative formula: C10H22N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.229,"smiles":null,"spectrum_id":"CCMSLIB00017314988","spectrum_index":48448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 18.0107 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.053,"smiles":null,"spectrum_id":"CCMSLIB00017314989","spectrum_index":48449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 250.1999 Da; putative annotation: N/A; putative formula: C11H22N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.24,"smiles":null,"spectrum_id":"CCMSLIB00017314990","spectrum_index":48450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 321.3092 Da; putative annotation: N/A; putative formula: C20H39N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.58,"smiles":null,"spectrum_id":"CCMSLIB00017314991","spectrum_index":48451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 62.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.077,"smiles":null,"spectrum_id":"CCMSLIB00017314992","spectrum_index":48452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 366.0722 Da; putative annotation: N/A; putative formula: C17H14N6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.143,"smiles":null,"spectrum_id":"CCMSLIB00017314993","spectrum_index":48453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 239.137 Da; putative annotation: N/A; putative formula: C10H17N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.217,"smiles":null,"spectrum_id":"CCMSLIB00017314994","spectrum_index":48454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 67.0494 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.13,"smiles":null,"spectrum_id":"CCMSLIB00017314995","spectrum_index":48455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxycodone (delta mass: 97.0491 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.188,"smiles":null,"spectrum_id":"CCMSLIB00017314996","spectrum_index":48456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SODIUM D-GLUCONATE (delta mass: 126.0307 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.096,"smiles":null,"spectrum_id":"CCMSLIB00017314997","spectrum_index":48457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 106.042 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.128,"smiles":null,"spectrum_id":"CCMSLIB00017314998","spectrum_index":48458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 98.0728 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.159,"smiles":null,"spectrum_id":"CCMSLIB00017314999","spectrum_index":48459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy-2-pyridinecarboxylic acid (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017315000","spectrum_index":48460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 203.1523 Da; putative annotation: N/A; putative formula: C10H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.255,"smiles":null,"spectrum_id":"CCMSLIB00017315001","spectrum_index":48461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 119.0405 Da; putative annotation: N/A; putative formula: C4H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.116,"smiles":null,"spectrum_id":"CCMSLIB00017315002","spectrum_index":48462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 128.0512 Da; putative annotation: N/A; putative formula: C5H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.133,"smiles":null,"spectrum_id":"CCMSLIB00017315003","spectrum_index":48463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017315004","spectrum_index":48464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 113.0841 Da; putative annotation: Massbank:PR100388 D-Alloisoleucine|allo-Ile|(2R,3S)-2-Amino-3-methylpentanoic acid|(2R,3S)-2-Amino-3-methylvaleric acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.234,"smiles":null,"spectrum_id":"CCMSLIB00017315005","spectrum_index":48465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 184.121 Da; putative annotation: Ala-Leu; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.271,"smiles":null,"spectrum_id":"CCMSLIB00017315006","spectrum_index":48466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 216.1152 Da; putative annotation: Massbank:NA001030 Pterosin G|(S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-1H-inden-1-one|(2S)-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-2,3-dihydroinden-1-one; putative formula: C14H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.18,"smiles":null,"spectrum_id":"CCMSLIB00017315007","spectrum_index":48467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of METHIONINE (delta mass: 72.0198 Da; putative annotation: 3-HYDROXYPROPIONIC ACID; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.078,"smiles":null,"spectrum_id":"CCMSLIB00017315008","spectrum_index":48468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 122.0479 Da; putative annotation: 1-(2-Carboxyethyl)-1H-imidazole; putative formula: C6H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.197,"smiles":null,"spectrum_id":"CCMSLIB00017315009","spectrum_index":48469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 274.2291 Da; putative annotation: 5.beta.-Androstane-3.beta.,17.beta.-diol; putative formula: C19H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.498,"smiles":null,"spectrum_id":"CCMSLIB00017315010","spectrum_index":48470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 484.3581 Da; putative annotation: N/A; putative formula: C30H49N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.427,"smiles":null,"spectrum_id":"CCMSLIB00017315011","spectrum_index":48471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 154.078 Da; putative annotation: N/A; putative formula: C12H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.202,"smiles":null,"spectrum_id":"CCMSLIB00017315012","spectrum_index":48472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 72.0131 Da; putative annotation: N/A; putative formula: C3H5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.11,"smiles":null,"spectrum_id":"CCMSLIB00017315013","spectrum_index":48473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.123,"smiles":null,"spectrum_id":"CCMSLIB00017315014","spectrum_index":48474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 184.0889 Da; putative annotation: N/A; putative formula: C13H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.16,"smiles":null,"spectrum_id":"CCMSLIB00017315015","spectrum_index":48475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 126.1406 Da; putative annotation: N/A; putative formula: C9H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.237,"smiles":null,"spectrum_id":"CCMSLIB00017315016","spectrum_index":48476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 519.334 Da; putative annotation: N/A; putative formula: C27H46N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.41,"smiles":null,"spectrum_id":"CCMSLIB00017315017","spectrum_index":48477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 185.2204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.369,"smiles":null,"spectrum_id":"CCMSLIB00017315018","spectrum_index":48478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Leu-His from NIST14 (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.245,"smiles":null,"spectrum_id":"CCMSLIB00017315019","spectrum_index":48479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 363.2607 Da; putative annotation: N/A; putative formula: C22H39NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.357,"smiles":null,"spectrum_id":"CCMSLIB00017315020","spectrum_index":48480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 786.3811 Da; putative annotation: N/A; putative formula: C39H50N10O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":979.452,"smiles":null,"spectrum_id":"CCMSLIB00017315021","spectrum_index":48481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 821.4557 Da; putative annotation: N/A; putative formula: C56H59N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1002.53,"smiles":null,"spectrum_id":"CCMSLIB00017315022","spectrum_index":48482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 242.1596 Da; putative annotation: N/A; putative formula: C8H18N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.267,"smiles":null,"spectrum_id":"CCMSLIB00017315023","spectrum_index":48483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381053-01_C31H44O12_beta-D-Glucopyranoside, 5-(4-hydroxyphenyl)-1-[2-(4-hydroxyphenyl)ethyl]pentyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)- (delta mass: 78.007 Da; putative annotation: N/A; putative formula: H2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.298,"smiles":null,"spectrum_id":"CCMSLIB00017315024","spectrum_index":48484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 62.0521 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.211,"smiles":null,"spectrum_id":"CCMSLIB00017315025","spectrum_index":48485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 66.0469 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.149,"smiles":null,"spectrum_id":"CCMSLIB00017315026","spectrum_index":48486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 563.364 Da; putative annotation: N/A; putative formula: C34H50N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.44,"smiles":null,"spectrum_id":"CCMSLIB00017315027","spectrum_index":48487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 206.2379 Da; putative annotation: N/A; putative formula: C16H30O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.361,"smiles":null,"spectrum_id":"CCMSLIB00017315028","spectrum_index":48488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 63.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.107,"smiles":null,"spectrum_id":"CCMSLIB00017315029","spectrum_index":48489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9H-Xanthene-4-acetic acid, 5,6-dimethyl-9-oxo- (delta mass: 46.0153 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.112,"smiles":null,"spectrum_id":"CCMSLIB00017315030","spectrum_index":48490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 96.0931 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.315,"smiles":null,"spectrum_id":"CCMSLIB00017315031","spectrum_index":48491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 383.1919 Da; putative annotation: N/A; putative formula: C23H29NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.346,"smiles":null,"spectrum_id":"CCMSLIB00017315032","spectrum_index":48492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 308.1407 Da; putative annotation: N/A; putative formula: C12H24N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.31,"smiles":null,"spectrum_id":"CCMSLIB00017315033","spectrum_index":48493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 48.0345 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.074,"smiles":null,"spectrum_id":"CCMSLIB00017315034","spectrum_index":48494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 173.1065 Da; putative annotation: N/A; putative formula: C9H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.261,"smiles":null,"spectrum_id":"CCMSLIB00017315035","spectrum_index":48495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 92.0624 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.174,"smiles":null,"spectrum_id":"CCMSLIB00017315036","spectrum_index":48496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 203.1163 Da; putative annotation: N/A; putative formula: C10H21NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.223,"smiles":null,"spectrum_id":"CCMSLIB00017315037","spectrum_index":48497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 14.0229 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.224,"smiles":null,"spectrum_id":"CCMSLIB00017315038","spectrum_index":48498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 36.9273 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.998,"smiles":null,"spectrum_id":"CCMSLIB00017315039","spectrum_index":48499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-8-ol (delta mass: 12.0206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.081,"smiles":null,"spectrum_id":"CCMSLIB00017315040","spectrum_index":48500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 338.1193 Da; putative annotation: N/A; putative formula: C10H22N6O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.273,"smiles":null,"spectrum_id":"CCMSLIB00017315041","spectrum_index":48501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 500.1942 Da; putative annotation: N/A; putative formula: C21H32N4O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":712.286,"smiles":null,"spectrum_id":"CCMSLIB00017315042","spectrum_index":48502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 84.9887 Da; putative annotation: N/A; putative formula: CH-1N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.174,"smiles":null,"spectrum_id":"CCMSLIB00017315043","spectrum_index":48503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 304.0594 Da; putative annotation: N/A; putative formula: C16H16O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.12,"smiles":null,"spectrum_id":"CCMSLIB00017315044","spectrum_index":48504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 109.0385 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.219,"smiles":null,"spectrum_id":"CCMSLIB00017315045","spectrum_index":48505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylputrescine; AIF; CE0; MS2Dec (delta mass: 100.0524 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.17,"smiles":null,"spectrum_id":"CCMSLIB00017315046","spectrum_index":48506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 83.0801 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.206,"smiles":null,"spectrum_id":"CCMSLIB00017315047","spectrum_index":48507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 13.0316 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.097,"smiles":null,"spectrum_id":"CCMSLIB00017315048","spectrum_index":48508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Diaminotoluene (delta mass: 11.9886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.08,"smiles":null,"spectrum_id":"CCMSLIB00017315049","spectrum_index":48509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(4-Fluorophenoxy)phenyl]-N-methylmethanamine (delta mass: 15.0313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.145,"smiles":null,"spectrum_id":"CCMSLIB00017315050","spectrum_index":48510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 194.1529 Da; putative annotation: N/A; putative formula: C10H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.218,"smiles":null,"spectrum_id":"CCMSLIB00017315051","spectrum_index":48511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 88.0638 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.134,"smiles":null,"spectrum_id":"CCMSLIB00017315052","spectrum_index":48512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 827.2919 Da; putative annotation: N/A; putative formula: C45H53N3O4S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1170.42,"smiles":null,"spectrum_id":"CCMSLIB00017315053","spectrum_index":48513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydroxybutorphanol (delta mass: 253.1391 Da; putative annotation: N/A; putative formula: C17H20NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.361,"smiles":null,"spectrum_id":"CCMSLIB00017315054","spectrum_index":48514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 12.0548 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.135,"smiles":null,"spectrum_id":"CCMSLIB00017315055","spectrum_index":48515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 164.1567 Da; putative annotation: N/A; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.28,"smiles":null,"spectrum_id":"CCMSLIB00017315056","spectrum_index":48516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 110.037 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.15,"smiles":null,"spectrum_id":"CCMSLIB00017315057","spectrum_index":48517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Glycolylneuraminic acid (delta mass: 27.988 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.096,"smiles":null,"spectrum_id":"CCMSLIB00017315058","spectrum_index":48518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thiodiglycol sulfoxide (delta mass: 10.0536 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.096,"smiles":null,"spectrum_id":"CCMSLIB00017315059","spectrum_index":48519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 67.0785 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.154,"smiles":null,"spectrum_id":"CCMSLIB00017315060","spectrum_index":48520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 257.1997 Da; putative annotation: N/A; putative formula: C14H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.296,"smiles":null,"spectrum_id":"CCMSLIB00017315061","spectrum_index":48521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 265.0786 Da; putative annotation: N/A; putative formula: C14H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.201,"smiles":null,"spectrum_id":"CCMSLIB00017315062","spectrum_index":48522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanylleucine (delta mass: 85.0526 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.192,"smiles":null,"spectrum_id":"CCMSLIB00017315063","spectrum_index":48523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 276.0827 Da; putative annotation: N/A; putative formula: C18H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.211,"smiles":null,"spectrum_id":"CCMSLIB00017315064","spectrum_index":48524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 101.0941 Da; putative annotation: N/A; putative formula: C4H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.181,"smiles":null,"spectrum_id":"CCMSLIB00017315065","spectrum_index":48525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Scoulerine (delta mass: 144.0273 Da; putative annotation: N/A; putative formula: C5H9N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.182,"smiles":null,"spectrum_id":"CCMSLIB00017315066","spectrum_index":48526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 275.0331 Da; putative annotation: N/A; putative formula: C15H5N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.13,"smiles":null,"spectrum_id":"CCMSLIB00017315067","spectrum_index":48527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 310.191 Da; putative annotation: N/A; putative formula: C21H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.277,"smiles":null,"spectrum_id":"CCMSLIB00017315068","spectrum_index":48528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 150.1751 Da; putative annotation: N/A; putative formula: C12H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.24,"smiles":null,"spectrum_id":"CCMSLIB00017315069","spectrum_index":48529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 336.3118 Da; putative annotation: N/A; putative formula: C17H36N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.353,"smiles":null,"spectrum_id":"CCMSLIB00017315070","spectrum_index":48530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 337.1154 Da; putative annotation: N/A; putative formula: C10H20N5O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.186,"smiles":null,"spectrum_id":"CCMSLIB00017315071","spectrum_index":48531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-hydroxy-1,7-diphenylhept-1-en-3-one (delta mass: 84.0639 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.217,"smiles":null,"spectrum_id":"CCMSLIB00017315072","spectrum_index":48532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 180.0634 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.085,"smiles":null,"spectrum_id":"CCMSLIB00017315073","spectrum_index":48533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 423.2373 Da; putative annotation: N/A; putative formula: C21H33N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.318,"smiles":null,"spectrum_id":"CCMSLIB00017315074","spectrum_index":48534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1090.5563 Da; putative annotation: N/A; putative formula: C59H78N8O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1253.62,"smiles":null,"spectrum_id":"CCMSLIB00017315075","spectrum_index":48535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 140.0102 Da; putative annotation: N/A; putative formula: C6H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.06,"smiles":null,"spectrum_id":"CCMSLIB00017315076","spectrum_index":48536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 257.148 Da; putative annotation: N/A; putative formula: C12H24N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.208,"smiles":null,"spectrum_id":"CCMSLIB00017315077","spectrum_index":48537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 77.0839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.196,"smiles":null,"spectrum_id":"CCMSLIB00017315078","spectrum_index":48538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 13.0132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.11,"smiles":null,"spectrum_id":"CCMSLIB00017315079","spectrum_index":48539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-O-Cyclouridine (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.061,"smiles":null,"spectrum_id":"CCMSLIB00017315080","spectrum_index":48540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 314.172 Da; putative annotation: N/A; putative formula: C20H28O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.211,"smiles":null,"spectrum_id":"CCMSLIB00017315081","spectrum_index":48541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 9.9832 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.21,"smiles":null,"spectrum_id":"CCMSLIB00017315082","spectrum_index":48542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 498.1648 Da; putative annotation: N/A; putative formula: C26H30N2O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.262,"smiles":null,"spectrum_id":"CCMSLIB00017315083","spectrum_index":48543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 32.9947 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017315084","spectrum_index":48544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 58.0942 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.154,"smiles":null,"spectrum_id":"CCMSLIB00017315085","spectrum_index":48545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000234 Sorbitol (delta mass: 39.0471 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.133,"smiles":null,"spectrum_id":"CCMSLIB00017315086","spectrum_index":48546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 441.2199 Da; putative annotation: N/A; putative formula: C23H31N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.348,"smiles":null,"spectrum_id":"CCMSLIB00017315087","spectrum_index":48547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 398.291 Da; putative annotation: N/A; putative formula: C21H34N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.419,"smiles":null,"spectrum_id":"CCMSLIB00017315088","spectrum_index":48548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 260.0257 Da; putative annotation: N/A; putative formula: C12H8N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":927.255,"smiles":null,"spectrum_id":"CCMSLIB00017315089","spectrum_index":48549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-QUINOLINECARBOXYLIC ACID (delta mass: 91.0265 Da; putative annotation: N/A; putative formula: C2H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.082,"smiles":null,"spectrum_id":"CCMSLIB00017315090","spectrum_index":48550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 168.0891 Da; putative annotation: N/A; putative formula: C8H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.16,"smiles":null,"spectrum_id":"CCMSLIB00017315091","spectrum_index":48551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 296.1118 Da; putative annotation: N/A; putative formula: C17H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.281,"smiles":null,"spectrum_id":"CCMSLIB00017315092","spectrum_index":48552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3-ethyl-4-hydroxy-5,7-dimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 31.9899 Da; putative annotation: N/A; putative formula: O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.107,"smiles":null,"spectrum_id":"CCMSLIB00017315093","spectrum_index":48553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 52.1041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.216,"smiles":null,"spectrum_id":"CCMSLIB00017315094","spectrum_index":48554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 118.1157 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.358,"smiles":null,"spectrum_id":"CCMSLIB00017315095","spectrum_index":48555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET170201 PYR_272.1759_11.0|N-demethylpyrilamine|N`-[(4-methoxyphenyl)methyl]-N-methyl-N`-pyridin-2-ylethane-1,2-diamine (delta mass: 125.0246 Da; putative annotation: N/A; putative formula: C3H4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.2,"smiles":null,"spectrum_id":"CCMSLIB00017315096","spectrum_index":48556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 131.0572 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.117,"smiles":null,"spectrum_id":"CCMSLIB00017315097","spectrum_index":48557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 92.0511 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.2,"smiles":null,"spectrum_id":"CCMSLIB00017315098","spectrum_index":48558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 184.0735 Da; putative annotation: N/A; putative formula: C9H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.243,"smiles":null,"spectrum_id":"CCMSLIB00017315099","spectrum_index":48559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 276.1727 Da; putative annotation: N/A; putative formula: C17H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.327,"smiles":null,"spectrum_id":"CCMSLIB00017315100","spectrum_index":48560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 511.1515 Da; putative annotation: N/A; putative formula: C17H32N5O7P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.212,"smiles":null,"spectrum_id":"CCMSLIB00017315101","spectrum_index":48561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 111.0705 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.167,"smiles":null,"spectrum_id":"CCMSLIB00017315102","spectrum_index":48562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 313.3407 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.51,"smiles":null,"spectrum_id":"CCMSLIB00017315103","spectrum_index":48563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 42.0101 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.07,"smiles":null,"spectrum_id":"CCMSLIB00017315104","spectrum_index":48564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 128.0834 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.143,"smiles":null,"spectrum_id":"CCMSLIB00017315105","spectrum_index":48565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 555.445 Da; putative annotation: N/A; putative formula: C24H53N13O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.521,"smiles":null,"spectrum_id":"CCMSLIB00017315106","spectrum_index":48566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 434.3578 Da; putative annotation: N/A; putative formula: C28H50OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.512,"smiles":null,"spectrum_id":"CCMSLIB00017315107","spectrum_index":48567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C6:0 (delta mass: 17.9472 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.107,"smiles":null,"spectrum_id":"CCMSLIB00017315108","spectrum_index":48568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 14.9695 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.061,"smiles":null,"spectrum_id":"CCMSLIB00017315109","spectrum_index":48569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 19.0171 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.15,"smiles":null,"spectrum_id":"CCMSLIB00017315110","spectrum_index":48570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 125.0479 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.16,"smiles":null,"spectrum_id":"CCMSLIB00017315111","spectrum_index":48571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline CollisionEnergy:102040\"\" (delta mass: 17.0267 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.176,"smiles":null,"spectrum_id":"CCMSLIB00017315112","spectrum_index":48572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vindoline (delta mass: 103.048 Da; putative annotation: N/A; putative formula: CH5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.281,"smiles":null,"spectrum_id":"CCMSLIB00017315113","spectrum_index":48573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 482.2343 Da; putative annotation: N/A; putative formula: C26H42O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.388,"smiles":null,"spectrum_id":"CCMSLIB00017315114","spectrum_index":48574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 684.0511 Da; putative annotation: N/A; putative formula: C26H20N8O9S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":906.148,"smiles":null,"spectrum_id":"CCMSLIB00017315115","spectrum_index":48575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 252.1038 Da; putative annotation: N/A; putative formula: C10H20O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.192,"smiles":null,"spectrum_id":"CCMSLIB00017315116","spectrum_index":48576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 289.1233 Da; putative annotation: N/A; putative formula: C16H20NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.277,"smiles":null,"spectrum_id":"CCMSLIB00017315117","spectrum_index":48577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyripyropene A (delta mass: 40.9973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.246,"smiles":null,"spectrum_id":"CCMSLIB00017315118","spectrum_index":48578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ365701 Cimaterol|2-amino-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile (delta mass: 17.9643 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.109,"smiles":null,"spectrum_id":"CCMSLIB00017315119","spectrum_index":48579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-(2-naphthyl)acetamide (delta mass: 59.0812 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017315120","spectrum_index":48580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 74.0735 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.243,"smiles":null,"spectrum_id":"CCMSLIB00017315121","spectrum_index":48581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 150.1973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.346,"smiles":null,"spectrum_id":"CCMSLIB00017315122","spectrum_index":48582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 243.1581 Da; putative annotation: N/A; putative formula: C11H21N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.26,"smiles":null,"spectrum_id":"CCMSLIB00017315123","spectrum_index":48583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (delta mass: 96.066 Da; putative annotation: N/A; putative formula: C5H8N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.155,"smiles":null,"spectrum_id":"CCMSLIB00017315124","spectrum_index":48584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385126-01!1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 80.0625 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.331,"smiles":null,"spectrum_id":"CCMSLIB00017315125","spectrum_index":48585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 541.2677 Da; putative annotation: N/A; putative formula: C23H47N3O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.365,"smiles":null,"spectrum_id":"CCMSLIB00017315126","spectrum_index":48586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE10; CorrDec (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":104.07,"smiles":null,"spectrum_id":"CCMSLIB00017315127","spectrum_index":48587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 20.062 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":132.101,"smiles":null,"spectrum_id":"CCMSLIB00017315128","spectrum_index":48588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 833.4692 Da; putative annotation: N/A; putative formula: C44H63N7O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1013.56,"smiles":null,"spectrum_id":"CCMSLIB00017315129","spectrum_index":48589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 21.9812 Da; putative annotation: N/A; putative formula: C2H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.093,"smiles":null,"spectrum_id":"CCMSLIB00017315130","spectrum_index":48590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 34.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.165,"smiles":null,"spectrum_id":"CCMSLIB00017315131","spectrum_index":48591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 131.0218 Da; putative annotation: N/A; putative formula: C4H5NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.144,"smiles":null,"spectrum_id":"CCMSLIB00017315132","spectrum_index":48592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 70.0483 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.223,"smiles":null,"spectrum_id":"CCMSLIB00017315133","spectrum_index":48593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 261.1101 Da; putative annotation: N/A; putative formula: C15H20NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.222,"smiles":null,"spectrum_id":"CCMSLIB00017315134","spectrum_index":48594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 137.0468 Da; putative annotation: N/A; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.128,"smiles":null,"spectrum_id":"CCMSLIB00017315135","spectrum_index":48595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 112.0517 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.186,"smiles":null,"spectrum_id":"CCMSLIB00017315136","spectrum_index":48596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 112.0522 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.212,"smiles":null,"spectrum_id":"CCMSLIB00017315137","spectrum_index":48597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 80.0341 Da; putative annotation: N/A; putative formula: C4H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.079,"smiles":null,"spectrum_id":"CCMSLIB00017315138","spectrum_index":48598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 339.1708 Da; putative annotation: N/A; putative formula: C16H26N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.251,"smiles":null,"spectrum_id":"CCMSLIB00017315139","spectrum_index":48599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 154.0627 Da; putative annotation: N/A; putative formula: C8H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.149,"smiles":null,"spectrum_id":"CCMSLIB00017315140","spectrum_index":48600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 56.0289 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.136,"smiles":null,"spectrum_id":"CCMSLIB00017315141","spectrum_index":48601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 7.0053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.086,"smiles":null,"spectrum_id":"CCMSLIB00017315142","spectrum_index":48602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 65.063 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.118,"smiles":null,"spectrum_id":"CCMSLIB00017315143","spectrum_index":48603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-((4-hydroxy-6-methyl-5-oxo-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl)furan-2-carboxamide (delta mass: 50.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.145,"smiles":null,"spectrum_id":"CCMSLIB00017315144","spectrum_index":48604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 94.0699 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017315145","spectrum_index":48605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 255.1133 Da; putative annotation: N/A; putative formula: C11H18N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.206,"smiles":null,"spectrum_id":"CCMSLIB00017315146","spectrum_index":48606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 26.0146 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.091,"smiles":null,"spectrum_id":"CCMSLIB00017315147","spectrum_index":48607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-N-(2-phenylethyl)benzamide (delta mass: 16.0235 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.157,"smiles":null,"spectrum_id":"CCMSLIB00017315148","spectrum_index":48608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (delta mass: 14.4764 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.538,"smiles":null,"spectrum_id":"CCMSLIB00017315149","spectrum_index":48609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 14.9927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.998,"smiles":null,"spectrum_id":"CCMSLIB00017315150","spectrum_index":48610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 167.2093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.368,"smiles":null,"spectrum_id":"CCMSLIB00017315151","spectrum_index":48611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 84.021 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.134,"smiles":null,"spectrum_id":"CCMSLIB00017315152","spectrum_index":48612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 142.9732 Da; putative annotation: N/A; putative formula: C2HN5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.097,"smiles":null,"spectrum_id":"CCMSLIB00017315153","spectrum_index":48613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 256.1426 Da; putative annotation: N/A; putative formula: C17H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.223,"smiles":null,"spectrum_id":"CCMSLIB00017315154","spectrum_index":48614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 222.0932 Da; putative annotation: N/A; putative formula: C9H18O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.181,"smiles":null,"spectrum_id":"CCMSLIB00017315155","spectrum_index":48615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 372.2655 Da; putative annotation: N/A; putative formula: C24H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.362,"smiles":null,"spectrum_id":"CCMSLIB00017315156","spectrum_index":48616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 45.0216 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.108,"smiles":null,"spectrum_id":"CCMSLIB00017315157","spectrum_index":48617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 212.1524 Da; putative annotation: DL-Leu-DL-Val; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.307,"smiles":null,"spectrum_id":"CCMSLIB00017315158","spectrum_index":48618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 171.0692 Da; putative annotation: 1H-Indole-3-propanoic acid; putative formula: C11H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.193,"smiles":null,"spectrum_id":"CCMSLIB00017315159","spectrum_index":48619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 108.0214 Da; putative annotation: 5-(Hydroxymethyl)-2-furaldehyde; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.145,"smiles":null,"spectrum_id":"CCMSLIB00017315160","spectrum_index":48620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 142.0023 Da; putative annotation: 2-Chloro-N-(4H-1,2,4-triazol-3-yl)acetamide; putative formula: C4H3ClN4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.073,"smiles":null,"spectrum_id":"CCMSLIB00017315161","spectrum_index":48621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 172.0523 Da; putative annotation: 3,6-Dimethyl-4-hydroxycoumarin; putative formula: C11H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.112,"smiles":null,"spectrum_id":"CCMSLIB00017315162","spectrum_index":48622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 115.0779 Da; putative annotation: 2-Methylindoline; putative formula: C9H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.185,"smiles":null,"spectrum_id":"CCMSLIB00017315163","spectrum_index":48623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 196.1215 Da; putative annotation: d-Dethiobiotin CollisionEnergy:102040; putative formula: C10H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.245,"smiles":null,"spectrum_id":"CCMSLIB00017315164","spectrum_index":48624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 228.1098 Da; putative annotation: Asp-Leu; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.223,"smiles":null,"spectrum_id":"CCMSLIB00017315165","spectrum_index":48625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 244.1105 Da; putative annotation: 8-Hydroxy-5,8a-dimethyl-3-methylidene-3a,4,4a,8,9,9a-hexahydrobenzo[f][1]benzofuran-2,7-dione; putative formula: C15H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.181,"smiles":null,"spectrum_id":"CCMSLIB00017315166","spectrum_index":48626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 278.165 Da; putative annotation: MassbankEU:SM872102 17-alpha-Ethinylestradiol; putative formula: C20H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.277,"smiles":null,"spectrum_id":"CCMSLIB00017315167","spectrum_index":48627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 266.1511 Da; putative annotation: (4E,6E)-2-(Hydroxymethyl)-3-(3-methoxy-3-oxopropyl)deca-4,6-dienoic acid; putative formula: C15H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.211,"smiles":null,"spectrum_id":"CCMSLIB00017315168","spectrum_index":48628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 115.0784 Da; putative annotation: N/A; putative formula: C6H10FN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017315169","spectrum_index":48629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 136.0333 Da; putative annotation: N/A; putative formula: C8H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.157,"smiles":null,"spectrum_id":"CCMSLIB00017315170","spectrum_index":48630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 317.111 Da; putative annotation: N/A; putative formula: C13H19NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.208,"smiles":null,"spectrum_id":"CCMSLIB00017315171","spectrum_index":48631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 145.0528 Da; putative annotation: N/A; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.203,"smiles":null,"spectrum_id":"CCMSLIB00017315172","spectrum_index":48632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 417.2636 Da; putative annotation: N/A; putative formula: C24H39N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.371,"smiles":null,"spectrum_id":"CCMSLIB00017315173","spectrum_index":48633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 98.0553 Da; putative annotation: N/A; putative formula: C6H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.157,"smiles":null,"spectrum_id":"CCMSLIB00017315174","spectrum_index":48634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine CollisionEnergy:102040 (delta mass: 229.9665 Da; putative annotation: N/A; putative formula: C5H3N4O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.063,"smiles":null,"spectrum_id":"CCMSLIB00017315175","spectrum_index":48635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 35.0721 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.158,"smiles":null,"spectrum_id":"CCMSLIB00017315176","spectrum_index":48636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol (delta mass: 89.0264 Da; putative annotation: N/A; putative formula: C6H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017315177","spectrum_index":48637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 208.2396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.3,"smiles":null,"spectrum_id":"CCMSLIB00017315178","spectrum_index":48638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopycnarrhine (delta mass: 18.0093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.111,"smiles":null,"spectrum_id":"CCMSLIB00017315179","spectrum_index":48639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 158.0733 Da; putative annotation: N/A; putative formula: C11H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.144,"smiles":null,"spectrum_id":"CCMSLIB00017315180","spectrum_index":48640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 166.0463 Da; putative annotation: N/A; putative formula: C2H2N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.148,"smiles":null,"spectrum_id":"CCMSLIB00017315181","spectrum_index":48641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 62.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.175,"smiles":null,"spectrum_id":"CCMSLIB00017315182","spectrum_index":48642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 497.2739 Da; putative annotation: N/A; putative formula: C24H39N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.354,"smiles":null,"spectrum_id":"CCMSLIB00017315183","spectrum_index":48643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 144.1149 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.29,"smiles":null,"spectrum_id":"CCMSLIB00017315184","spectrum_index":48644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 415.0868 Da; putative annotation: N/A; putative formula: C18H18N5O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.162,"smiles":null,"spectrum_id":"CCMSLIB00017315185","spectrum_index":48645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Met-Arg (delta mass: 41.9997 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.207,"smiles":null,"spectrum_id":"CCMSLIB00017315186","spectrum_index":48646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 144.0016 Da; putative annotation: N/A; putative formula: C3H5N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.093,"smiles":null,"spectrum_id":"CCMSLIB00017315187","spectrum_index":48647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[4-[Acetyl(hydroxy)amino]butylcarbamoyl]-5-[3-[acetyl(hydroxy)amino]propylamino]-3-hydroxy-5-oxopentanoic acid (delta mass: 175.0875 Da; putative annotation: N/A; putative formula: C6H14N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.296,"smiles":null,"spectrum_id":"CCMSLIB00017315188","spectrum_index":48648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 194.0397 Da; putative annotation: N/A; putative formula: C12H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.142,"smiles":null,"spectrum_id":"CCMSLIB00017315189","spectrum_index":48649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltryptamine (delta mass: 90.0554 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.178,"smiles":null,"spectrum_id":"CCMSLIB00017315190","spectrum_index":48650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT211470 D-Glucuronic acid|Glucuronate|Glucosiduronic Acid|D-Glucopyranuronic acid|(2S,3S,4S,5R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid (delta mass: 143.0369 Da; putative annotation: N/A; putative formula: C9H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.087,"smiles":null,"spectrum_id":"CCMSLIB00017315191","spectrum_index":48651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 50.0462 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.106,"smiles":null,"spectrum_id":"CCMSLIB00017315192","spectrum_index":48652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Chloro-2,3,4,9-tetrahydro-1H-carbazole-7-carboxylic acid (delta mass: 85.053 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.116,"smiles":null,"spectrum_id":"CCMSLIB00017315193","spectrum_index":48653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 42.0118 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.117,"smiles":null,"spectrum_id":"CCMSLIB00017315194","spectrum_index":48654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 638.2552 Da; putative annotation: N/A; putative formula: C30H39N8O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":953.414,"smiles":null,"spectrum_id":"CCMSLIB00017315195","spectrum_index":48655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 613.3822 Da; putative annotation: N/A; putative formula: C45H47N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.458,"smiles":null,"spectrum_id":"CCMSLIB00017315196","spectrum_index":48656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 890.4655 Da; putative annotation: N/A; putative formula: C60H62N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1071.54,"smiles":null,"spectrum_id":"CCMSLIB00017315197","spectrum_index":48657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 4.3984 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.5,"smiles":null,"spectrum_id":"CCMSLIB00017315198","spectrum_index":48658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 275.0061 Da; putative annotation: N/A; putative formula: C8H13N3P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.092,"smiles":null,"spectrum_id":"CCMSLIB00017315199","spectrum_index":48659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 67.0426 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017315200","spectrum_index":48660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 401.1945 Da; putative annotation: N/A; putative formula: C23H32NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.291,"smiles":null,"spectrum_id":"CCMSLIB00017315201","spectrum_index":48661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 104.0899 Da; putative annotation: N/A; putative formula: H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.38,"smiles":null,"spectrum_id":"CCMSLIB00017315202","spectrum_index":48662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinemethanol (delta mass: 10.0207 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":120.081,"smiles":null,"spectrum_id":"CCMSLIB00017315203","spectrum_index":48663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 119.0378 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.088,"smiles":null,"spectrum_id":"CCMSLIB00017315204","spectrum_index":48664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 135.0384 Da; putative annotation: N/A; putative formula: C3H10N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.097,"smiles":null,"spectrum_id":"CCMSLIB00017315205","spectrum_index":48665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 84.0206 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.096,"smiles":null,"spectrum_id":"CCMSLIB00017315206","spectrum_index":48666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 66.0696 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.171,"smiles":null,"spectrum_id":"CCMSLIB00017315207","spectrum_index":48667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine 3-O-sulfate (delta mass: 192.1504 Da; putative annotation: N/A; putative formula: C13H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.209,"smiles":null,"spectrum_id":"CCMSLIB00017315208","spectrum_index":48668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benz[a]anthracen-1-ol, 8-methoxy-3-methyl- (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.143,"smiles":null,"spectrum_id":"CCMSLIB00017315209","spectrum_index":48669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 413.1628 Da; putative annotation: N/A; putative formula: C26H23NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.312,"smiles":null,"spectrum_id":"CCMSLIB00017315210","spectrum_index":48670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 156.9963 Da; putative annotation: N/A; putative formula: C12H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.078,"smiles":null,"spectrum_id":"CCMSLIB00017315211","spectrum_index":48671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 40.0788 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.113,"smiles":null,"spectrum_id":"CCMSLIB00017315212","spectrum_index":48672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 168.0419 Da; putative annotation: N/A; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.149,"smiles":null,"spectrum_id":"CCMSLIB00017315213","spectrum_index":48673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 229.204 Da; putative annotation: N/A; putative formula: C13H27NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.264,"smiles":null,"spectrum_id":"CCMSLIB00017315214","spectrum_index":48674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 56.0485 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.203,"smiles":null,"spectrum_id":"CCMSLIB00017315215","spectrum_index":48675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-1,2,3,4-tetrahydropyrazino[1,2-a]indole (delta mass: 18.0192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.088,"smiles":null,"spectrum_id":"CCMSLIB00017315216","spectrum_index":48676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 152.0991 Da; putative annotation: N/A; putative formula: C13H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.164,"smiles":null,"spectrum_id":"CCMSLIB00017315217","spectrum_index":48677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT211470 D-Glucuronic acid|Glucuronate|Glucosiduronic Acid|D-Glucopyranuronic acid|(2S,3S,4S,5R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid (delta mass: 194.0691 Da; putative annotation: N/A; putative formula: C9H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.119,"smiles":null,"spectrum_id":"CCMSLIB00017315218","spectrum_index":48678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE0; MS2Dec (delta mass: 529.8157 Da; putative annotation: N/A; putative formula: C12H18O-1S12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.897,"smiles":null,"spectrum_id":"CCMSLIB00017315219","spectrum_index":48679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine; AIF; CE0; MS2Dec (delta mass: 92.026 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.123,"smiles":null,"spectrum_id":"CCMSLIB00017315220","spectrum_index":48680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 455.2009 Da; putative annotation: N/A; putative formula: C21H34N3O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.266,"smiles":null,"spectrum_id":"CCMSLIB00017315221","spectrum_index":48681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 204.1122 Da; putative annotation: N/A; putative formula: C9H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.235,"smiles":null,"spectrum_id":"CCMSLIB00017315222","spectrum_index":48682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Formoterol (delta mass: 92.0734 Da; putative annotation: N/A; putative formula: C6H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.254,"smiles":null,"spectrum_id":"CCMSLIB00017315223","spectrum_index":48683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 293.2912 Da; putative annotation: N/A; putative formula: C17H35N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.383,"smiles":null,"spectrum_id":"CCMSLIB00017315224","spectrum_index":48684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017315225","spectrum_index":48685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 37.0016 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.171,"smiles":null,"spectrum_id":"CCMSLIB00017315226","spectrum_index":48686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 124.1608 Da; putative annotation: N/A; putative formula: C10H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.258,"smiles":null,"spectrum_id":"CCMSLIB00017315227","spectrum_index":48687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 357.0727 Da; putative annotation: N/A; putative formula: C13H16N3O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.159,"smiles":null,"spectrum_id":"CCMSLIB00017315228","spectrum_index":48688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 218.967 Da; putative annotation: N/A; putative formula: C7H9NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.065,"smiles":null,"spectrum_id":"CCMSLIB00017315229","spectrum_index":48689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 95.074 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.118,"smiles":null,"spectrum_id":"CCMSLIB00017315230","spectrum_index":48690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 324.1321 Da; putative annotation: N/A; putative formula: C15H20N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.218,"smiles":null,"spectrum_id":"CCMSLIB00017315231","spectrum_index":48691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 28.0156 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.164,"smiles":null,"spectrum_id":"CCMSLIB00017315232","spectrum_index":48692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 4.0313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.091,"smiles":null,"spectrum_id":"CCMSLIB00017315233","spectrum_index":48693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 76.039 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.074,"smiles":null,"spectrum_id":"CCMSLIB00017315234","spectrum_index":48694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ACETALDEHYDE - 20.0 eV (delta mass: 40.0173 Da; putative annotation: N/A; putative formula: N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.093,"smiles":null,"spectrum_id":"CCMSLIB00017315235","spectrum_index":48695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 365.6956 Da; putative annotation: N/A; putative formula: H2O-1P4S8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.782,"smiles":null,"spectrum_id":"CCMSLIB00017315236","spectrum_index":48696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 682.6043 Da; putative annotation: N/A; putative formula: C41H82N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":868.676,"smiles":null,"spectrum_id":"CCMSLIB00017315237","spectrum_index":48697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 90.0497 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.162,"smiles":null,"spectrum_id":"CCMSLIB00017315238","spectrum_index":48698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 32.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.179,"smiles":null,"spectrum_id":"CCMSLIB00017315239","spectrum_index":48699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C4:0 (delta mass: 71.0735 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.223,"smiles":null,"spectrum_id":"CCMSLIB00017315240","spectrum_index":48700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 108.0421 Da; putative annotation: N/A; putative formula: C4H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.191,"smiles":null,"spectrum_id":"CCMSLIB00017315241","spectrum_index":48701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 667.624 Da; putative annotation: N/A; putative formula: C40H81N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":777.684,"smiles":null,"spectrum_id":"CCMSLIB00017315242","spectrum_index":48702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 89.1224 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.292,"smiles":null,"spectrum_id":"CCMSLIB00017315243","spectrum_index":48703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 301.2253 Da; putative annotation: N/A; putative formula: C16H31NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.306,"smiles":null,"spectrum_id":"CCMSLIB00017315244","spectrum_index":48704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 34.0413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.133,"smiles":null,"spectrum_id":"CCMSLIB00017315245","spectrum_index":48705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 168.0528 Da; putative annotation: N/A; putative formula: C7H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.15,"smiles":null,"spectrum_id":"CCMSLIB00017315246","spectrum_index":48706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 270.0859 Da; putative annotation: N/A; putative formula: C12H18N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.172,"smiles":null,"spectrum_id":"CCMSLIB00017315247","spectrum_index":48707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 85.0536 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.124,"smiles":null,"spectrum_id":"CCMSLIB00017315248","spectrum_index":48708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 27.3984 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.458,"smiles":null,"spectrum_id":"CCMSLIB00017315249","spectrum_index":48709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Palatinose (delta mass: 300.1906 Da; putative annotation: N/A; putative formula: C12H24N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.314,"smiles":null,"spectrum_id":"CCMSLIB00017315250","spectrum_index":48710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 194.0481 Da; putative annotation: N/A; putative formula: C12H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.108,"smiles":null,"spectrum_id":"CCMSLIB00017315251","spectrum_index":48711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Lys from NIST14 (delta mass: 226.1674 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.364,"smiles":null,"spectrum_id":"CCMSLIB00017315252","spectrum_index":48712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 70.0 eV (delta mass: 158.0579 Da; putative annotation: N/A; putative formula: C7H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.16,"smiles":null,"spectrum_id":"CCMSLIB00017315253","spectrum_index":48713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 98.097 Da; putative annotation: N/A; putative formula: C4H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.246,"smiles":null,"spectrum_id":"CCMSLIB00017315254","spectrum_index":48714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 100.059 Da; putative annotation: N/A; putative formula: H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.119,"smiles":null,"spectrum_id":"CCMSLIB00017315255","spectrum_index":48715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 63.0175 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.166,"smiles":null,"spectrum_id":"CCMSLIB00017315256","spectrum_index":48716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 32.0201 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.054,"smiles":null,"spectrum_id":"CCMSLIB00017315257","spectrum_index":48717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 339.13 Da; putative annotation: N/A; putative formula: C13H21N7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.253,"smiles":null,"spectrum_id":"CCMSLIB00017315258","spectrum_index":48718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 174.1415 Da; putative annotation: N/A; putative formula: C13H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.265,"smiles":null,"spectrum_id":"CCMSLIB00017315259","spectrum_index":48719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 104.0163 Da; putative annotation: N/A; putative formula: CH4N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.243,"smiles":null,"spectrum_id":"CCMSLIB00017315260","spectrum_index":48720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxymorphinan (delta mass: 128.0433 Da; putative annotation: N/A; putative formula: C2H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.213,"smiles":null,"spectrum_id":"CCMSLIB00017315261","spectrum_index":48721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 148.0123 Da; putative annotation: N/A; putative formula: C5H11O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.151,"smiles":null,"spectrum_id":"CCMSLIB00017315262","spectrum_index":48722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 907.4943 Da; putative annotation: N/A; putative formula: C48H69N5O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1070.55,"smiles":null,"spectrum_id":"CCMSLIB00017315263","spectrum_index":48723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 149.1115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.203,"smiles":null,"spectrum_id":"CCMSLIB00017315264","spectrum_index":48724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-3-carbaldehyde (delta mass: 41.0298 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.08,"smiles":null,"spectrum_id":"CCMSLIB00017315265","spectrum_index":48725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 524.1528 Da; putative annotation: N/A; putative formula: C30H28N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":855.307,"smiles":null,"spectrum_id":"CCMSLIB00017315266","spectrum_index":48726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 208.22 Da; putative annotation: N/A; putative formula: C15H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.327,"smiles":null,"spectrum_id":"CCMSLIB00017315267","spectrum_index":48727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 158.0202 Da; putative annotation: N/A; putative formula: C3H-2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.2,"smiles":null,"spectrum_id":"CCMSLIB00017315268","spectrum_index":48728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 87.0298 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.1,"smiles":null,"spectrum_id":"CCMSLIB00017315269","spectrum_index":48729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-methoxyphenyl)propylamine CollisionEnergy:102040 (delta mass: 144.0897 Da; putative annotation: N/A; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.212,"smiles":null,"spectrum_id":"CCMSLIB00017315270","spectrum_index":48730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 66.0307 Da; putative annotation: N/A; putative formula: C2H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.153,"smiles":null,"spectrum_id":"CCMSLIB00017315271","spectrum_index":48731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 507.2107 Da; putative annotation: N/A; putative formula: C25H33NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.297,"smiles":null,"spectrum_id":"CCMSLIB00017315272","spectrum_index":48732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin///(-)-citrinin CollisionEnergy:205060 (delta mass: 123.0902 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.182,"smiles":null,"spectrum_id":"CCMSLIB00017315273","spectrum_index":48733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 204.0377 Da; putative annotation: N/A; putative formula: C8H13O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.087,"smiles":null,"spectrum_id":"CCMSLIB00017315274","spectrum_index":48734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 58.0316 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.102,"smiles":null,"spectrum_id":"CCMSLIB00017315275","spectrum_index":48735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Pro-Arg from NIST14 (delta mass: 115.0281 Da; putative annotation: N/A; putative formula: C5HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.284,"smiles":null,"spectrum_id":"CCMSLIB00017315276","spectrum_index":48736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 870.1792 Da; putative annotation: N/A; putative formula: C45H30N10O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1537.41,"smiles":null,"spectrum_id":"CCMSLIB00017315277","spectrum_index":48737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 35.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.17,"smiles":null,"spectrum_id":"CCMSLIB00017315278","spectrum_index":48738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine hydrochloride (delta mass: 32.0231 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017315279","spectrum_index":48739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 1033.0959 Da; putative annotation: N/A; putative formula: C41H31N9O18S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1538.27,"smiles":null,"spectrum_id":"CCMSLIB00017315280","spectrum_index":48740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 82.0779 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.19,"smiles":null,"spectrum_id":"CCMSLIB00017315281","spectrum_index":48741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 48.0347 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.303,"smiles":null,"spectrum_id":"CCMSLIB00017315282","spectrum_index":48742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 339.0932 Da; putative annotation: N/A; putative formula: C19H17NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.19,"smiles":null,"spectrum_id":"CCMSLIB00017315283","spectrum_index":48743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one (delta mass: 225.1008 Da; putative annotation: N/A; putative formula: C12H19NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.194,"smiles":null,"spectrum_id":"CCMSLIB00017315284","spectrum_index":48744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 30.1012 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017315285","spectrum_index":48745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 204.1003 Da; putative annotation: N/A; putative formula: C10H20S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.27,"smiles":null,"spectrum_id":"CCMSLIB00017315286","spectrum_index":48746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 95.0744 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.129,"smiles":null,"spectrum_id":"CCMSLIB00017315287","spectrum_index":48747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(2-methoxyphenyl)methanamine (delta mass: 122.1881 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.326,"smiles":null,"spectrum_id":"CCMSLIB00017315288","spectrum_index":48748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-(Furan-2-yl)pyridin-3-yl)methanamine (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.092,"smiles":null,"spectrum_id":"CCMSLIB00017315289","spectrum_index":48749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 41.0346 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.074,"smiles":null,"spectrum_id":"CCMSLIB00017315290","spectrum_index":48750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 221.0789 Da; putative annotation: N/A; putative formula: C12H16NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.165,"smiles":null,"spectrum_id":"CCMSLIB00017315291","spectrum_index":48751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 17.0767 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.174,"smiles":null,"spectrum_id":"CCMSLIB00017315292","spectrum_index":48752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy-5-pentyl-2-prenylphenol (delta mass: 102.0676 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.268,"smiles":null,"spectrum_id":"CCMSLIB00017315293","spectrum_index":48753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004403 1-hydroxypyrene|pyren-1-ol (delta mass: 189.0973 Da; putative annotation: N/A; putative formula: C4H11N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.178,"smiles":null,"spectrum_id":"CCMSLIB00017315294","spectrum_index":48754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000737546-01! (delta mass: 31.029 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.168,"smiles":null,"spectrum_id":"CCMSLIB00017315295","spectrum_index":48755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 868.6057 Da; putative annotation: N/A; putative formula: C65H76N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1178.72,"smiles":null,"spectrum_id":"CCMSLIB00017315296","spectrum_index":48756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 447.8389 Da; putative annotation: N/A; putative formula: C14H8OS8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.962,"smiles":null,"spectrum_id":"CCMSLIB00017315297","spectrum_index":48757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 63.078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.186,"smiles":null,"spectrum_id":"CCMSLIB00017315298","spectrum_index":48758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 201.0611 Da; putative annotation: N/A; putative formula: C4H7N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.147,"smiles":null,"spectrum_id":"CCMSLIB00017315299","spectrum_index":48759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (L-proline betaine) (delta mass: 58.0419 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.144,"smiles":null,"spectrum_id":"CCMSLIB00017315300","spectrum_index":48760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 616.5872 Da; putative annotation: N/A; putative formula: C36H72N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":838.684,"smiles":null,"spectrum_id":"CCMSLIB00017315301","spectrum_index":48761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dehydroluciferin (delta mass: 22.9961 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.985,"smiles":null,"spectrum_id":"CCMSLIB00017315302","spectrum_index":48762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 218.15 Da; putative annotation: N/A; putative formula: C15H22O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.273,"smiles":null,"spectrum_id":"CCMSLIB00017315303","spectrum_index":48763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 78.0294 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.147,"smiles":null,"spectrum_id":"CCMSLIB00017315304","spectrum_index":48764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 142.5034 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.595,"smiles":null,"spectrum_id":"CCMSLIB00017315305","spectrum_index":48765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 244.0845 Da; putative annotation: N/A; putative formula: C13H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.129,"smiles":null,"spectrum_id":"CCMSLIB00017315306","spectrum_index":48766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 170.1426 Da; putative annotation: N/A; putative formula: C9H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.26,"smiles":null,"spectrum_id":"CCMSLIB00017315307","spectrum_index":48767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 26.8829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.964,"smiles":null,"spectrum_id":"CCMSLIB00017315308","spectrum_index":48768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 82.0779 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.3,"smiles":null,"spectrum_id":"CCMSLIB00017315309","spectrum_index":48769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 634.3001 Da; putative annotation: N/A; putative formula: C44H43O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.392,"smiles":null,"spectrum_id":"CCMSLIB00017315310","spectrum_index":48770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lyngbyatoxin A  Me ether putative or related isomer (delta mass: 495.3107 Da; putative annotation: N/A; putative formula: C30H45N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":947.638,"smiles":null,"spectrum_id":"CCMSLIB00017315311","spectrum_index":48771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 218.1907 Da; putative annotation: N/A; putative formula: C13H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.345,"smiles":null,"spectrum_id":"CCMSLIB00017315312","spectrum_index":48772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephromopsic acid (delta mass: 96.0942 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.347,"smiles":null,"spectrum_id":"CCMSLIB00017315313","spectrum_index":48773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 44.4403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017315314","spectrum_index":48774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 235.0719 Da; putative annotation: N/A; putative formula: C10H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.134,"smiles":null,"spectrum_id":"CCMSLIB00017315315","spectrum_index":48775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 194.1059 Da; putative annotation: N/A; putative formula: C10H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.213,"smiles":null,"spectrum_id":"CCMSLIB00017315316","spectrum_index":48776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 50.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.217,"smiles":null,"spectrum_id":"CCMSLIB00017315317","spectrum_index":48777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 101.1214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.202,"smiles":null,"spectrum_id":"CCMSLIB00017315318","spectrum_index":48778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNITOL - 60.0 eV (delta mass: 58.9123 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.999,"smiles":null,"spectrum_id":"CCMSLIB00017315319","spectrum_index":48779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 71.0516 Da; putative annotation: N/A; putative formula: C2H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.138,"smiles":null,"spectrum_id":"CCMSLIB00017315320","spectrum_index":48780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of UHQ (mixed MS2 C11:db:UHQ) (delta mass: 17.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.258,"smiles":null,"spectrum_id":"CCMSLIB00017315321","spectrum_index":48781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 175.0882 Da; putative annotation: N/A; putative formula: C6H14N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.17,"smiles":null,"spectrum_id":"CCMSLIB00017315322","spectrum_index":48782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 162.053 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.239,"smiles":null,"spectrum_id":"CCMSLIB00017315323","spectrum_index":48783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Norepinephrine from NIST14 (delta mass: 133.0519 Da; putative annotation: 2,4-Dimethylnicotinic acid; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.133,"smiles":null,"spectrum_id":"CCMSLIB00017315324","spectrum_index":48784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 156.0781 Da; putative annotation: 4-Phenyl-1H-imidazole-1,2-diamine; putative formula: C9H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.138,"smiles":null,"spectrum_id":"CCMSLIB00017315325","spectrum_index":48785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 40.0 eV (delta mass: 124.0893 Da; putative annotation: 2-Propyl-4-pentenoic acid; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.176,"smiles":null,"spectrum_id":"CCMSLIB00017315326","spectrum_index":48786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 159.0683 Da; putative annotation: 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester; putative formula: C10H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.144,"smiles":null,"spectrum_id":"CCMSLIB00017315327","spectrum_index":48787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 126.0235 Da; putative annotation: 5-Fluoro-2-methoxy-4(1H)-pyrimidinone; putative formula: C5H3FN2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.058,"smiles":null,"spectrum_id":"CCMSLIB00017315328","spectrum_index":48788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 178.1361 Da; putative annotation: Dodeca-2(E),4(E)-dienoic acid; putative formula: C12H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.248,"smiles":null,"spectrum_id":"CCMSLIB00017315329","spectrum_index":48789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100301 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole (delta mass: 54.0459 Da; putative annotation: 2-Buten-1-ol; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.094,"smiles":null,"spectrum_id":"CCMSLIB00017315330","spectrum_index":48790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 292.0738 Da; putative annotation: Osajaxanthone; putative formula: C18H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.134,"smiles":null,"spectrum_id":"CCMSLIB00017315331","spectrum_index":48791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 290.1151 Da; putative annotation: N/A; putative formula: C16H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.238,"smiles":null,"spectrum_id":"CCMSLIB00017315332","spectrum_index":48792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 144.0306 Da; putative annotation: N/A; putative formula: C2H5N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017315333","spectrum_index":48793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 189.1091 Da; putative annotation: N/A; putative formula: C9H20NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.144,"smiles":null,"spectrum_id":"CCMSLIB00017315334","spectrum_index":48794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 92.0469 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.201,"smiles":null,"spectrum_id":"CCMSLIB00017315335","spectrum_index":48795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 176.1242 Da; putative annotation: N/A; putative formula: C2H12N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.278,"smiles":null,"spectrum_id":"CCMSLIB00017315336","spectrum_index":48796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 300.1624 Da; putative annotation: N/A; putative formula: C21H20N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.249,"smiles":null,"spectrum_id":"CCMSLIB00017315337","spectrum_index":48797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 112.0489 Da; putative annotation: N/A; putative formula: C2H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.125,"smiles":null,"spectrum_id":"CCMSLIB00017315338","spectrum_index":48798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 117.0381 Da; putative annotation: N/A; putative formula: H3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.14,"smiles":null,"spectrum_id":"CCMSLIB00017315339","spectrum_index":48799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 78.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.165,"smiles":null,"spectrum_id":"CCMSLIB00017315340","spectrum_index":48800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 86.0474 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.217,"smiles":null,"spectrum_id":"CCMSLIB00017315341","spectrum_index":48801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 311.2095 Da; putative annotation: N/A; putative formula: C24H25NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.29,"smiles":null,"spectrum_id":"CCMSLIB00017315342","spectrum_index":48802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 603.3932 Da; putative annotation: N/A; putative formula: C31H53N7O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.49,"smiles":null,"spectrum_id":"CCMSLIB00017315343","spectrum_index":48803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 550.2224 Da; putative annotation: N/A; putative formula: C25H30N10O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.345,"smiles":null,"spectrum_id":"CCMSLIB00017315344","spectrum_index":48804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 324.0627 Da; putative annotation: N/A; putative formula: C10H16N2O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.133,"smiles":null,"spectrum_id":"CCMSLIB00017315345","spectrum_index":48805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 303.2056 Da; putative annotation: N/A; putative formula: C16H33NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.318,"smiles":null,"spectrum_id":"CCMSLIB00017315346","spectrum_index":48806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 348.1209 Da; putative annotation: N/A; putative formula: C18H20O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.176,"smiles":null,"spectrum_id":"CCMSLIB00017315347","spectrum_index":48807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 70.042 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.216,"smiles":null,"spectrum_id":"CCMSLIB00017315348","spectrum_index":48808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 153.0579 Da; putative annotation: N/A; putative formula: C11H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.123,"smiles":null,"spectrum_id":"CCMSLIB00017315349","spectrum_index":48809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-beta-D-galactosamine - 40.0 eV (delta mass: 200.0668 Da; putative annotation: N/A; putative formula: C6H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.164,"smiles":null,"spectrum_id":"CCMSLIB00017315350","spectrum_index":48810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 53.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.177,"smiles":null,"spectrum_id":"CCMSLIB00017315351","spectrum_index":48811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 46.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.232,"smiles":null,"spectrum_id":"CCMSLIB00017315352","spectrum_index":48812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(5-fluoropentyl)- (delta mass: 113.0661 Da; putative annotation: N/A; putative formula: C6H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.19,"smiles":null,"spectrum_id":"CCMSLIB00017315353","spectrum_index":48813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 42.0097 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.122,"smiles":null,"spectrum_id":"CCMSLIB00017315354","spectrum_index":48814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 238.0625 Da; putative annotation: N/A; putative formula: C7H14N2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.186,"smiles":null,"spectrum_id":"CCMSLIB00017315355","spectrum_index":48815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 16.0206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.1,"smiles":null,"spectrum_id":"CCMSLIB00017315356","spectrum_index":48816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000488 Spermine|N,N'-bis(3-aminopropyl)butane-1,4-diamine (delta mass: 154.0995 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.323,"smiles":null,"spectrum_id":"CCMSLIB00017315357","spectrum_index":48817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 149.0956 Da; putative annotation: N/A; putative formula: C8H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.145,"smiles":null,"spectrum_id":"CCMSLIB00017315358","spectrum_index":48818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 147.0539 Da; putative annotation: N/A; putative formula: C6H13NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.15,"smiles":null,"spectrum_id":"CCMSLIB00017315359","spectrum_index":48819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 165.58 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.755,"smiles":null,"spectrum_id":"CCMSLIB00017315360","spectrum_index":48820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 48.0215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.092,"smiles":null,"spectrum_id":"CCMSLIB00017315361","spectrum_index":48821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 22.0057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017315362","spectrum_index":48822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TURANOSE (delta mass: 84.1046 Da; putative annotation: N/A; putative formula: C5H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.228,"smiles":null,"spectrum_id":"CCMSLIB00017315363","spectrum_index":48823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Ile (delta mass: 99.0684 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.218,"smiles":null,"spectrum_id":"CCMSLIB00017315364","spectrum_index":48824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 176.1243 Da; putative annotation: N/A; putative formula: C2H12N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.2,"smiles":null,"spectrum_id":"CCMSLIB00017315365","spectrum_index":48825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 111.0785 Da; putative annotation: N/A; putative formula: C5H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017315366","spectrum_index":48826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 63.0324 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.207,"smiles":null,"spectrum_id":"CCMSLIB00017315367","spectrum_index":48827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 204.1329 Da; putative annotation: N/A; putative formula: C6H16N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.219,"smiles":null,"spectrum_id":"CCMSLIB00017315368","spectrum_index":48828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 158.0172 Da; putative annotation: N/A; putative formula: C4H7N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.104,"smiles":null,"spectrum_id":"CCMSLIB00017315369","spectrum_index":48829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 297.1675 Da; putative annotation: N/A; putative formula: C18H23N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.296,"smiles":null,"spectrum_id":"CCMSLIB00017315370","spectrum_index":48830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 292.1058 Da; putative annotation: N/A; putative formula: C14H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.27,"smiles":null,"spectrum_id":"CCMSLIB00017315371","spectrum_index":48831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 263.1251 Da; putative annotation: N/A; putative formula: C9H13N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.196,"smiles":null,"spectrum_id":"CCMSLIB00017315372","spectrum_index":48832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 468.4246 Da; putative annotation: N/A; putative formula: C33H57O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.465,"smiles":null,"spectrum_id":"CCMSLIB00017315373","spectrum_index":48833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 318.1666 Da; putative annotation: N/A; putative formula: C19H28P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.326,"smiles":null,"spectrum_id":"CCMSLIB00017315374","spectrum_index":48834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 30.0524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.154,"smiles":null,"spectrum_id":"CCMSLIB00017315375","spectrum_index":48835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 29.0266 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.032,"smiles":null,"spectrum_id":"CCMSLIB00017315376","spectrum_index":48836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 88.0063 Da; putative annotation: N/A; putative formula: C5N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.124,"smiles":null,"spectrum_id":"CCMSLIB00017315377","spectrum_index":48837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 406.3283 Da; putative annotation: N/A; putative formula: C26H48O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.482,"smiles":null,"spectrum_id":"CCMSLIB00017315378","spectrum_index":48838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 388.0234 Da; putative annotation: N/A; putative formula: C15H12N6OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.182,"smiles":null,"spectrum_id":"CCMSLIB00017315379","spectrum_index":48839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 150.1165 Da; putative annotation: N/A; putative formula: C9H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.192,"smiles":null,"spectrum_id":"CCMSLIB00017315380","spectrum_index":48840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 51.0473 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.113,"smiles":null,"spectrum_id":"CCMSLIB00017315381","spectrum_index":48841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 627.3233 Da; putative annotation: N/A; putative formula: C35H49NO7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":924.472,"smiles":null,"spectrum_id":"CCMSLIB00017315382","spectrum_index":48842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aflatoxin M1 (delta mass: 88.009 Da; putative annotation: N/A; putative formula: C2H4N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.075,"smiles":null,"spectrum_id":"CCMSLIB00017315383","spectrum_index":48843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolidine (delta mass: 275.1117 Da; putative annotation: N/A; putative formula: C10H17N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.245,"smiles":null,"spectrum_id":"CCMSLIB00017315384","spectrum_index":48844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole_3_butyric_acid (delta mass: 142.072 Da; putative annotation: N/A; putative formula: C2H6N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.174,"smiles":null,"spectrum_id":"CCMSLIB00017315385","spectrum_index":48845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 162.0528 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.15,"smiles":null,"spectrum_id":"CCMSLIB00017315386","spectrum_index":48846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 79.0112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.076,"smiles":null,"spectrum_id":"CCMSLIB00017315387","spectrum_index":48847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-3-(2-oxo-2-phenylethyl)-1,3-dihydro-2H-indol-2-one (delta mass: 111.1366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.233,"smiles":null,"spectrum_id":"CCMSLIB00017315388","spectrum_index":48848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 108.0217 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.081,"smiles":null,"spectrum_id":"CCMSLIB00017315389","spectrum_index":48849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 683.2518 Da; putative annotation: N/A; putative formula: C42H37NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1026.38,"smiles":null,"spectrum_id":"CCMSLIB00017315390","spectrum_index":48850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 256.1673 Da; putative annotation: N/A; putative formula: C14H24O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.249,"smiles":null,"spectrum_id":"CCMSLIB00017315391","spectrum_index":48851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 329.2561 Da; putative annotation: N/A; putative formula: C18H35NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.337,"smiles":null,"spectrum_id":"CCMSLIB00017315392","spectrum_index":48852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 298.2139 Da; putative annotation: N/A; putative formula: C17H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.295,"smiles":null,"spectrum_id":"CCMSLIB00017315393","spectrum_index":48853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Fluoro-2,3-dihydro-1H-indole (delta mass: 59.0581 Da; putative annotation: N/A; putative formula: H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.13,"smiles":null,"spectrum_id":"CCMSLIB00017315394","spectrum_index":48854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Trifluoromethylphenyl)ethylamine (delta mass: 71.0347 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.118,"smiles":null,"spectrum_id":"CCMSLIB00017315395","spectrum_index":48855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 208.0663 Da; putative annotation: N/A; putative formula: C2H8N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.153,"smiles":null,"spectrum_id":"CCMSLIB00017315396","spectrum_index":48856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 422.2337 Da; putative annotation: N/A; putative formula: C20H38O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.294,"smiles":null,"spectrum_id":"CCMSLIB00017315397","spectrum_index":48857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 125.0465 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.096,"smiles":null,"spectrum_id":"CCMSLIB00017315398","spectrum_index":48858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 132.0059 Da; putative annotation: N/A; putative formula: C4H4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.092,"smiles":null,"spectrum_id":"CCMSLIB00017315399","spectrum_index":48859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 125.0629 Da; putative annotation: N/A; putative formula: C10H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.142,"smiles":null,"spectrum_id":"CCMSLIB00017315400","spectrum_index":48860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 137.0841 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.171,"smiles":null,"spectrum_id":"CCMSLIB00017315401","spectrum_index":48861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 113.1269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017315402","spectrum_index":48862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Phosphogluconic acid (delta mass: 140.0018 Da; putative annotation: N/A; putative formula: CN8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.034,"smiles":null,"spectrum_id":"CCMSLIB00017315403","spectrum_index":48863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 520.2524 Da; putative annotation: N/A; putative formula: C30H32N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.312,"smiles":null,"spectrum_id":"CCMSLIB00017315404","spectrum_index":48864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 273.6241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.742,"smiles":null,"spectrum_id":"CCMSLIB00017315405","spectrum_index":48865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301555 Harman (delta mass: 43.9901 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.082,"smiles":null,"spectrum_id":"CCMSLIB00017315406","spectrum_index":48866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 487.2936 Da; putative annotation: N/A; putative formula: C28H41NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":830.417,"smiles":null,"spectrum_id":"CCMSLIB00017315407","spectrum_index":48867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 97.9766 Da; putative annotation: N/A; putative formula: C2H-2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.052,"smiles":null,"spectrum_id":"CCMSLIB00017315408","spectrum_index":48868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 617.2251 Da; putative annotation: N/A; putative formula: C28H36N5O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":839.322,"smiles":null,"spectrum_id":"CCMSLIB00017315409","spectrum_index":48869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 84.0789 Da; putative annotation: N/A; putative formula: C3H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.155,"smiles":null,"spectrum_id":"CCMSLIB00017315410","spectrum_index":48870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 60.083 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.174,"smiles":null,"spectrum_id":"CCMSLIB00017315411","spectrum_index":48871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 164.092 Da; putative annotation: N/A; putative formula: C5H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.194,"smiles":null,"spectrum_id":"CCMSLIB00017315412","spectrum_index":48872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 77.0841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.197,"smiles":null,"spectrum_id":"CCMSLIB00017315413","spectrum_index":48873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 78.0319 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.139,"smiles":null,"spectrum_id":"CCMSLIB00017315414","spectrum_index":48874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 347.3416 Da; putative annotation: N/A; putative formula: C21H41N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.433,"smiles":null,"spectrum_id":"CCMSLIB00017315415","spectrum_index":48875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 85.1063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.234,"smiles":null,"spectrum_id":"CCMSLIB00017315416","spectrum_index":48876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 450.4776 Da; putative annotation: N/A; putative formula: C27H58N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.616,"smiles":null,"spectrum_id":"CCMSLIB00017315417","spectrum_index":48877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 118.0191 Da; putative annotation: N/A; putative formula: C4H7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.09,"smiles":null,"spectrum_id":"CCMSLIB00017315418","spectrum_index":48878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 66.0104 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.07,"smiles":null,"spectrum_id":"CCMSLIB00017315419","spectrum_index":48879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 144.0537 Da; putative annotation: N/A; putative formula: C5H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.14,"smiles":null,"spectrum_id":"CCMSLIB00017315420","spectrum_index":48880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 94.0403 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.137,"smiles":null,"spectrum_id":"CCMSLIB00017315421","spectrum_index":48881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 184.0193 Da; putative annotation: N/A; putative formula: C8H8O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.09,"smiles":null,"spectrum_id":"CCMSLIB00017315422","spectrum_index":48882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380746-01!1,7-bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 260.1169 Da; putative annotation: N/A; putative formula: C11H20N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.292,"smiles":null,"spectrum_id":"CCMSLIB00017315423","spectrum_index":48883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 144.057 Da; putative annotation: N/A; putative formula: C10H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.227,"smiles":null,"spectrum_id":"CCMSLIB00017315424","spectrum_index":48884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 360.21 Da; putative annotation: N/A; putative formula: C18H28N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.346,"smiles":null,"spectrum_id":"CCMSLIB00017315425","spectrum_index":48885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 183.2032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.383,"smiles":null,"spectrum_id":"CCMSLIB00017315426","spectrum_index":48886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 104.0591 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.119,"smiles":null,"spectrum_id":"CCMSLIB00017315427","spectrum_index":48887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Apixaban (delta mass: 186.1072 Da; putative annotation: N/A; putative formula: C10H18OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.305,"smiles":null,"spectrum_id":"CCMSLIB00017315428","spectrum_index":48888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 47.11 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.269,"smiles":null,"spectrum_id":"CCMSLIB00017315429","spectrum_index":48889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 218.2069 Da; putative annotation: N/A; putative formula: C6H22N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.377,"smiles":null,"spectrum_id":"CCMSLIB00017315430","spectrum_index":48890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-ylmethylene)malononitrile (delta mass: 121.0457 Da; putative annotation: N/A; putative formula: C7H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.117,"smiles":null,"spectrum_id":"CCMSLIB00017315431","spectrum_index":48891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 156.0457 Da; putative annotation: N/A; putative formula: C6H9N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.111,"smiles":null,"spectrum_id":"CCMSLIB00017315432","spectrum_index":48892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 80.0624 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.128,"smiles":null,"spectrum_id":"CCMSLIB00017315433","spectrum_index":48893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 114.9978 Da; putative annotation: N/A; putative formula: CHN5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.094,"smiles":null,"spectrum_id":"CCMSLIB00017315434","spectrum_index":48894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 83.0732 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017315435","spectrum_index":48895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 365.2427 Da; putative annotation: N/A; putative formula: C18H31N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.334,"smiles":null,"spectrum_id":"CCMSLIB00017315436","spectrum_index":48896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(6,7-diethoxy(1,2,3,4-tetrahydroisoquinolyl))-2,4-dimethoxybenzene CollisionEnergy:102040\"\" (delta mass: 146.0984 Da; putative annotation: N/A; putative formula: C5H14N4O-1S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.3,"smiles":null,"spectrum_id":"CCMSLIB00017315437","spectrum_index":48897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 102.0496 Da; putative annotation: N/A; putative formula: C5H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.138,"smiles":null,"spectrum_id":"CCMSLIB00017315438","spectrum_index":48898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 261.2459 Da; putative annotation: N/A; putative formula: C18H31N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.359,"smiles":null,"spectrum_id":"CCMSLIB00017315439","spectrum_index":48899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 118.0414 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017315440","spectrum_index":48900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Ethyltryptamine (delta mass: 199.1173 Da; putative annotation: N/A; putative formula: C6H13N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.256,"smiles":null,"spectrum_id":"CCMSLIB00017315441","spectrum_index":48901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 182.0727 Da; putative annotation: N/A; putative formula: C13H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.148,"smiles":null,"spectrum_id":"CCMSLIB00017315442","spectrum_index":48902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 46.0616 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.137,"smiles":null,"spectrum_id":"CCMSLIB00017315443","spectrum_index":48903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 86.044 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.187,"smiles":null,"spectrum_id":"CCMSLIB00017315444","spectrum_index":48904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 315.9855 Da; putative annotation: N/A; putative formula: C14H4O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.056,"smiles":null,"spectrum_id":"CCMSLIB00017315445","spectrum_index":48905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 340.2616 Da; putative annotation: N/A; putative formula: C20H36O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.327,"smiles":null,"spectrum_id":"CCMSLIB00017315446","spectrum_index":48906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2R,3S)-rel- (delta mass: 84.0113 Da; putative annotation: N/A; putative formula: C6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.092,"smiles":null,"spectrum_id":"CCMSLIB00017315447","spectrum_index":48907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 510.4626 Da; putative annotation: N/A; putative formula: C36H62O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.549,"smiles":null,"spectrum_id":"CCMSLIB00017315448","spectrum_index":48908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 44.099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017315449","spectrum_index":48909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 190.0954 Da; putative annotation: N/A; putative formula: C7H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.16,"smiles":null,"spectrum_id":"CCMSLIB00017315450","spectrum_index":48910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benserazide (delta mass: 75.0356 Da; putative annotation: N/A; putative formula: CH6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.144,"smiles":null,"spectrum_id":"CCMSLIB00017315451","spectrum_index":48911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 85.9762 Da; putative annotation: N/A; putative formula: CH-2N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.014,"smiles":null,"spectrum_id":"CCMSLIB00017315452","spectrum_index":48912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 17.0513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.111,"smiles":null,"spectrum_id":"CCMSLIB00017315453","spectrum_index":48913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 62.0117 Da; putative annotation: N/A; putative formula: H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.087,"smiles":null,"spectrum_id":"CCMSLIB00017315454","spectrum_index":48914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 40.9597 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.062,"smiles":null,"spectrum_id":"CCMSLIB00017315455","spectrum_index":48915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine (delta mass: 143.0983 Da; putative annotation: N/A; putative formula: C6H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.226,"smiles":null,"spectrum_id":"CCMSLIB00017315456","spectrum_index":48916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-.alpha.-Aminopimelic acid (delta mass: 111.0688 Da; putative annotation: Cyclopentanecarboxylic acid, 3-amino-, (1S,3R)-; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.16,"smiles":null,"spectrum_id":"CCMSLIB00017315457","spectrum_index":48917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 160.0367 Da; putative annotation: D-Gluconic acid, .delta.-lactone; putative formula: C6H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.097,"smiles":null,"spectrum_id":"CCMSLIB00017315458","spectrum_index":48918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 130.051 Da; putative annotation: 5-Aminooxindole; putative formula: C8H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.142,"smiles":null,"spectrum_id":"CCMSLIB00017315459","spectrum_index":48919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 121.0534 Da; putative annotation: 3-Amino-2,3-dihydrobenzoic acid; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.14,"smiles":null,"spectrum_id":"CCMSLIB00017315460","spectrum_index":48920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 144.0212 Da; putative annotation: (4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.15,"smiles":null,"spectrum_id":"CCMSLIB00017315461","spectrum_index":48921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 11.0046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":147.117,"smiles":null,"spectrum_id":"CCMSLIB00017315462","spectrum_index":48922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 204.136 Da; putative annotation: N/A; putative formula: C10H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017315463","spectrum_index":48923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM836003 Indoline|Indoline|2,3-dihydro-1H-indole (delta mass: 18.8576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.938,"smiles":null,"spectrum_id":"CCMSLIB00017315464","spectrum_index":48924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 383.2533 Da; putative annotation: N/A; putative formula: C18H33N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.345,"smiles":null,"spectrum_id":"CCMSLIB00017315465","spectrum_index":48925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 162.9879 Da; putative annotation: N/A; putative formula: C3H5N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.147,"smiles":null,"spectrum_id":"CCMSLIB00017315466","spectrum_index":48926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 26.0412 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.129,"smiles":null,"spectrum_id":"CCMSLIB00017315467","spectrum_index":48927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 333.2661 Da; putative annotation: N/A; putative formula: C21H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.352,"smiles":null,"spectrum_id":"CCMSLIB00017315468","spectrum_index":48928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 42.014 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.076,"smiles":null,"spectrum_id":"CCMSLIB00017315469","spectrum_index":48929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017315470","spectrum_index":48930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Naphthyl)-1H-indole (delta mass: 43.0161 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.128,"smiles":null,"spectrum_id":"CCMSLIB00017315471","spectrum_index":48931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 377.0567 Da; putative annotation: N/A; putative formula: C19H12N3O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.169,"smiles":null,"spectrum_id":"CCMSLIB00017315472","spectrum_index":48932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 883.4933 Da; putative annotation: N/A; putative formula: C59H69N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1090.58,"smiles":null,"spectrum_id":"CCMSLIB00017315473","spectrum_index":48933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 63.0172 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.108,"smiles":null,"spectrum_id":"CCMSLIB00017315474","spectrum_index":48934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 132.0788 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.248,"smiles":null,"spectrum_id":"CCMSLIB00017315475","spectrum_index":48935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 63.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.103,"smiles":null,"spectrum_id":"CCMSLIB00017315476","spectrum_index":48936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 124.1352 Da; putative annotation: N/A; putative formula: C8H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.237,"smiles":null,"spectrum_id":"CCMSLIB00017315477","spectrum_index":48937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 146.9549 Da; putative annotation: N/A; putative formula: C3H2NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.035,"smiles":null,"spectrum_id":"CCMSLIB00017315478","spectrum_index":48938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 98.1728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.27,"smiles":null,"spectrum_id":"CCMSLIB00017315479","spectrum_index":48939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 4-ethyl-2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 102.0527 Da; putative annotation: N/A; putative formula: C2H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.259,"smiles":null,"spectrum_id":"CCMSLIB00017315480","spectrum_index":48940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,5S)-9-Methyl-9-azabicyclo[3.3.1]nonan-3-amine (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.15,"smiles":null,"spectrum_id":"CCMSLIB00017315481","spectrum_index":48941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 13.0314 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.118,"smiles":null,"spectrum_id":"CCMSLIB00017315482","spectrum_index":48942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 113.0843 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.234,"smiles":null,"spectrum_id":"CCMSLIB00017315483","spectrum_index":48943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 91.2564 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.31,"smiles":null,"spectrum_id":"CCMSLIB00017315484","spectrum_index":48944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 24.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017315485","spectrum_index":48945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 63.0024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.062,"smiles":null,"spectrum_id":"CCMSLIB00017315486","spectrum_index":48946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 218.0956 Da; putative annotation: N/A; putative formula: C14H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.14,"smiles":null,"spectrum_id":"CCMSLIB00017315487","spectrum_index":48947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 50.052 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.117,"smiles":null,"spectrum_id":"CCMSLIB00017315488","spectrum_index":48948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ala-Thr (delta mass: 154.1361 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.239,"smiles":null,"spectrum_id":"CCMSLIB00017315489","spectrum_index":48949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 526.2705 Da; putative annotation: N/A; putative formula: C31H30N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.362,"smiles":null,"spectrum_id":"CCMSLIB00017315490","spectrum_index":48950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-8a-hydroxy-1-methoxy-7-methyl-6,8-dioxo-1H-isochromen-7-yl] acetate (delta mass: 509.6492 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":948.801,"smiles":null,"spectrum_id":"CCMSLIB00017315491","spectrum_index":48951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 214.2294 Da; putative annotation: N/A; putative formula: C10H26N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.321,"smiles":null,"spectrum_id":"CCMSLIB00017315492","spectrum_index":48952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 266.1418 Da; putative annotation: N/A; putative formula: C17H18N2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.228,"smiles":null,"spectrum_id":"CCMSLIB00017315493","spectrum_index":48953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole; AIF; CE10; MS2Dec (delta mass: 46.0017 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.062,"smiles":null,"spectrum_id":"CCMSLIB00017315494","spectrum_index":48954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 80.0623 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.211,"smiles":null,"spectrum_id":"CCMSLIB00017315495","spectrum_index":48955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSAMINE (delta mass: 197.0334 Da; putative annotation: N/A; putative formula: C9H11NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.12,"smiles":null,"spectrum_id":"CCMSLIB00017315496","spectrum_index":48956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 406.2206 Da; putative annotation: N/A; putative formula: C22H35N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.307,"smiles":null,"spectrum_id":"CCMSLIB00017315497","spectrum_index":48957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 502.2193 Da; putative annotation: N/A; putative formula: C21H35N4O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.337,"smiles":null,"spectrum_id":"CCMSLIB00017315498","spectrum_index":48958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 456.2245 Da; putative annotation: N/A; putative formula: C29H34N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.305,"smiles":null,"spectrum_id":"CCMSLIB00017315499","spectrum_index":48959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 326.1526 Da; putative annotation: N/A; putative formula: C21H26O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.223,"smiles":null,"spectrum_id":"CCMSLIB00017315500","spectrum_index":48960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Di(2-naphthyl)amine (delta mass: 63.0166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.144,"smiles":null,"spectrum_id":"CCMSLIB00017315501","spectrum_index":48961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 247.278 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.39,"smiles":null,"spectrum_id":"CCMSLIB00017315502","spectrum_index":48962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Hydroxybutorphanol (delta mass: 142.1361 Da; putative annotation: N/A; putative formula: C9H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.358,"smiles":null,"spectrum_id":"CCMSLIB00017315503","spectrum_index":48963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 48.0158 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.129,"smiles":null,"spectrum_id":"CCMSLIB00017315504","spectrum_index":48964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norpropoxyphene (delta mass: 131.058 Da; putative annotation: N/A; putative formula: C5H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.27,"smiles":null,"spectrum_id":"CCMSLIB00017315505","spectrum_index":48965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 330.112 Da; putative annotation: N/A; putative formula: C12H22N6O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.172,"smiles":null,"spectrum_id":"CCMSLIB00017315506","spectrum_index":48966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 505.2028 Da; putative annotation: N/A; putative formula: C30H36NPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.315,"smiles":null,"spectrum_id":"CCMSLIB00017315507","spectrum_index":48967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 507.3387 Da; putative annotation: N/A; putative formula: C29H49NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.435,"smiles":null,"spectrum_id":"CCMSLIB00017315508","spectrum_index":48968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 107.0912 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.113,"smiles":null,"spectrum_id":"CCMSLIB00017315509","spectrum_index":48969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100147 Indole-3-acetaldehyde (delta mass: 57.0112 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.087,"smiles":null,"spectrum_id":"CCMSLIB00017315510","spectrum_index":48970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Jatrorrhizine (delta mass: 14.022 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.161,"smiles":null,"spectrum_id":"CCMSLIB00017315511","spectrum_index":48971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 80.0537 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.18,"smiles":null,"spectrum_id":"CCMSLIB00017315512","spectrum_index":48972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 126.0834 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.154,"smiles":null,"spectrum_id":"CCMSLIB00017315513","spectrum_index":48973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 200.1228 Da; putative annotation: N/A; putative formula: C11H20OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.287,"smiles":null,"spectrum_id":"CCMSLIB00017315514","spectrum_index":48974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MMV688938 (delta mass: 390.1442 Da; putative annotation: N/A; putative formula: C28H22S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.287,"smiles":null,"spectrum_id":"CCMSLIB00017315515","spectrum_index":48975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 535.5031 Da; putative annotation: N/A; putative formula: C33H65N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.575,"smiles":null,"spectrum_id":"CCMSLIB00017315516","spectrum_index":48976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU244306 2-Amino-9H-pyrido[2,3-b]indole (AalphaC)|2-Amino-9H-pyrido[2,3-b]indole|9H-pyrido[2,3-b]indol-2-amine (delta mass: 620.5885 Da; putative annotation: N/A; putative formula: C44H76O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.675,"smiles":null,"spectrum_id":"CCMSLIB00017315517","spectrum_index":48977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1047.5303 Da; putative annotation: N/A; putative formula: C56H77N3O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1228.6,"smiles":null,"spectrum_id":"CCMSLIB00017315518","spectrum_index":48978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 886.6475 Da; putative annotation: N/A; putative formula: C60H86O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1188.71,"smiles":null,"spectrum_id":"CCMSLIB00017315519","spectrum_index":48979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-5-(1H-pyrrol-2-yl)-1,3-dihydro-1,4-benzodiazepin-2-one (delta mass: 46.0019 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.06,"smiles":null,"spectrum_id":"CCMSLIB00017315520","spectrum_index":48980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 309.2392 Da; putative annotation: N/A; putative formula: C17H31N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":638.414,"smiles":null,"spectrum_id":"CCMSLIB00017315521","spectrum_index":48981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 130.0632 Da; putative annotation: N/A; putative formula: C6H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.108,"smiles":null,"spectrum_id":"CCMSLIB00017315522","spectrum_index":48982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 82.0252 Da; putative annotation: N/A; putative formula: C5H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017315523","spectrum_index":48983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 104.0652 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.152,"smiles":null,"spectrum_id":"CCMSLIB00017315524","spectrum_index":48984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371605 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 78.0323 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.103,"smiles":null,"spectrum_id":"CCMSLIB00017315525","spectrum_index":48985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 11.0172 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.093,"smiles":null,"spectrum_id":"CCMSLIB00017315526","spectrum_index":48986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 354.2253 Da; putative annotation: N/A; putative formula: C21H30N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.395,"smiles":null,"spectrum_id":"CCMSLIB00017315527","spectrum_index":48987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 139.1183 Da; putative annotation: N/A; putative formula: C6H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.236,"smiles":null,"spectrum_id":"CCMSLIB00017315528","spectrum_index":48988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 42.01 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.096,"smiles":null,"spectrum_id":"CCMSLIB00017315529","spectrum_index":48989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 216.0693 Da; putative annotation: N/A; putative formula: C7H14N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.223,"smiles":null,"spectrum_id":"CCMSLIB00017315530","spectrum_index":48990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ333903 Phenylephrine|3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol (delta mass: 55.0381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.14,"smiles":null,"spectrum_id":"CCMSLIB00017315531","spectrum_index":48991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 127.0356 Da; putative annotation: N/A; putative formula: HN9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.148,"smiles":null,"spectrum_id":"CCMSLIB00017315532","spectrum_index":48992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-3,4-(methylenedioxy)benzylamine (delta mass: 104.0255 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.112,"smiles":null,"spectrum_id":"CCMSLIB00017315533","spectrum_index":48993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 99.0651 Da; putative annotation: N/A; putative formula: CH5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.141,"smiles":null,"spectrum_id":"CCMSLIB00017315534","spectrum_index":48994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 343.1861 Da; putative annotation: N/A; putative formula: C15H29N5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.277,"smiles":null,"spectrum_id":"CCMSLIB00017315535","spectrum_index":48995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 50.0155 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.086,"smiles":null,"spectrum_id":"CCMSLIB00017315536","spectrum_index":48996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mannitol (delta mass: 5.0067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.093,"smiles":null,"spectrum_id":"CCMSLIB00017315537","spectrum_index":48997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 265.08 Da; putative annotation: N/A; putative formula: C9H15NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.234,"smiles":null,"spectrum_id":"CCMSLIB00017315538","spectrum_index":48998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 408.1243 Da; putative annotation: N/A; putative formula: C20H24O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":735.253,"smiles":null,"spectrum_id":"CCMSLIB00017315539","spectrum_index":48999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 242.1174 Da; putative annotation: N/A; putative formula: C13H14N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.24,"smiles":null,"spectrum_id":"CCMSLIB00017315540","spectrum_index":49000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclopropylacetic acid (delta mass: 26.0158 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.076,"smiles":null,"spectrum_id":"CCMSLIB00017315541","spectrum_index":49001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C13:0 (delta mass: 71.0814 Da; putative annotation: N/A; putative formula: C3H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.429,"smiles":null,"spectrum_id":"CCMSLIB00017315542","spectrum_index":49002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 169.2245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.389,"smiles":null,"spectrum_id":"CCMSLIB00017315543","spectrum_index":49003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 84.0293 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.1,"smiles":null,"spectrum_id":"CCMSLIB00017315544","spectrum_index":49004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 189.0815 Da; putative annotation: N/A; putative formula: C10H12N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.183,"smiles":null,"spectrum_id":"CCMSLIB00017315545","spectrum_index":49005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 103.0854 Da; putative annotation: N/A; putative formula: C2H9N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.13,"smiles":null,"spectrum_id":"CCMSLIB00017315546","spectrum_index":49006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 106.0995 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.186,"smiles":null,"spectrum_id":"CCMSLIB00017315547","spectrum_index":49007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084605 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 16.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017315548","spectrum_index":49008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.122,"smiles":null,"spectrum_id":"CCMSLIB00017315549","spectrum_index":49009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 52.0313 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017315550","spectrum_index":49010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 336.2663 Da; putative annotation: N/A; putative formula: C21H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.337,"smiles":null,"spectrum_id":"CCMSLIB00017315551","spectrum_index":49011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 224.1048 Da; putative annotation: N/A; putative formula: C12H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.212,"smiles":null,"spectrum_id":"CCMSLIB00017315552","spectrum_index":49012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 173.0688 Da; putative annotation: N/A; putative formula: C7H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.149,"smiles":null,"spectrum_id":"CCMSLIB00017315553","spectrum_index":49013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucitol (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.118,"smiles":null,"spectrum_id":"CCMSLIB00017315554","spectrum_index":49014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 117.0885 Da; putative annotation: N/A; putative formula: H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.17,"smiles":null,"spectrum_id":"CCMSLIB00017315555","spectrum_index":49015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one [IIN-based: Match] (delta mass: 160.0099 Da; putative annotation: N/A; putative formula: C8H4N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.112,"smiles":null,"spectrum_id":"CCMSLIB00017315556","spectrum_index":49016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 41.0719 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.104,"smiles":null,"spectrum_id":"CCMSLIB00017315557","spectrum_index":49017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Pro (delta mass: 99.0679 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.223,"smiles":null,"spectrum_id":"CCMSLIB00017315558","spectrum_index":49018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-.beta.-D-mannosamine (delta mass: 213.0918 Da; putative annotation: N/A; putative formula: C12H11N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.189,"smiles":null,"spectrum_id":"CCMSLIB00017315559","spectrum_index":49019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 33.0479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.108,"smiles":null,"spectrum_id":"CCMSLIB00017315560","spectrum_index":49020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 114.0835 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.165,"smiles":null,"spectrum_id":"CCMSLIB00017315561","spectrum_index":49021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 82.0532 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.145,"smiles":null,"spectrum_id":"CCMSLIB00017315562","spectrum_index":49022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 262.0454 Da; putative annotation: N/A; putative formula: C17H10OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.121,"smiles":null,"spectrum_id":"CCMSLIB00017315563","spectrum_index":49023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 57.0346 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.11,"smiles":null,"spectrum_id":"CCMSLIB00017315564","spectrum_index":49024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 360.1265 Da; putative annotation: N/A; putative formula: C25H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.253,"smiles":null,"spectrum_id":"CCMSLIB00017315565","spectrum_index":49025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 80.0602 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.141,"smiles":null,"spectrum_id":"CCMSLIB00017315566","spectrum_index":49026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE0; MS2Dec (delta mass: 258.2545 Da; putative annotation: N/A; putative formula: C12H30N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.315,"smiles":null,"spectrum_id":"CCMSLIB00017315567","spectrum_index":49027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Leu-Arg (delta mass: 267.1262 Da; putative annotation: N/A; putative formula: C17H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.351,"smiles":null,"spectrum_id":"CCMSLIB00017315568","spectrum_index":49028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 15.9952 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.035,"smiles":null,"spectrum_id":"CCMSLIB00017315569","spectrum_index":49029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline [M+H-H2O]+; AIF; CE10; MS2Dec (delta mass: 170.0941 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.191,"smiles":null,"spectrum_id":"CCMSLIB00017315570","spectrum_index":49030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 158.024 Da; putative annotation: N/A; putative formula: C5H7N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.21,"smiles":null,"spectrum_id":"CCMSLIB00017315571","spectrum_index":49031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 131.1509 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.211,"smiles":null,"spectrum_id":"CCMSLIB00017315572","spectrum_index":49032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 881.6065 Da; putative annotation: N/A; putative formula: C42H79N11O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1044.67,"smiles":null,"spectrum_id":"CCMSLIB00017315573","spectrum_index":49033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385475-01!3-hydroxy-6-(2-methyl-4-oxochromen-5-yl)-5-oxohexanoic acid (delta mass: 66.0104 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.112,"smiles":null,"spectrum_id":"CCMSLIB00017315574","spectrum_index":49034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 32.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.124,"smiles":null,"spectrum_id":"CCMSLIB00017315575","spectrum_index":49035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 278.2441 Da; putative annotation: N/A; putative formula: C19H34O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.341,"smiles":null,"spectrum_id":"CCMSLIB00017315576","spectrum_index":49036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 708.6214 Da; putative annotation: N/A; putative formula: C51H80O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.693,"smiles":null,"spectrum_id":"CCMSLIB00017315577","spectrum_index":49037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1084.5108 Da; putative annotation: N/A; putative formula: C54H76N4O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1277.58,"smiles":null,"spectrum_id":"CCMSLIB00017315578","spectrum_index":49038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 972.3182 Da; putative annotation: N/A; putative formula: C42H54N8O15P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1315.44,"smiles":null,"spectrum_id":"CCMSLIB00017315579","spectrum_index":49039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Indolinone (delta mass: 80.1565 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.217,"smiles":null,"spectrum_id":"CCMSLIB00017315580","spectrum_index":49040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosamine (delta mass: 486.2702 Da; putative annotation: N/A; putative formula: C23H34N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.367,"smiles":null,"spectrum_id":"CCMSLIB00017315581","spectrum_index":49041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 56.0348 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.076,"smiles":null,"spectrum_id":"CCMSLIB00017315582","spectrum_index":49042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 102.0701 Da; putative annotation: N/A; putative formula: C4H11N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.167,"smiles":null,"spectrum_id":"CCMSLIB00017315583","spectrum_index":49043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 53.0113 Da; putative annotation: N/A; putative formula: H-1N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.165,"smiles":null,"spectrum_id":"CCMSLIB00017315584","spectrum_index":49044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 149.0469 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.118,"smiles":null,"spectrum_id":"CCMSLIB00017315585","spectrum_index":49045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 325.2179 Da; putative annotation: N/A; putative formula: C17H31N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.387,"smiles":null,"spectrum_id":"CCMSLIB00017315586","spectrum_index":49046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 104.0305 Da; putative annotation: N/A; putative formula: C4H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.106,"smiles":null,"spectrum_id":"CCMSLIB00017315587","spectrum_index":49047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 53.0048 Da; putative annotation: N/A; putative formula: CH-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.174,"smiles":null,"spectrum_id":"CCMSLIB00017315588","spectrum_index":49048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 137.0432 Da; putative annotation: N/A; putative formula: C2H7N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.124,"smiles":null,"spectrum_id":"CCMSLIB00017315589","spectrum_index":49049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 41.0499 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.115,"smiles":null,"spectrum_id":"CCMSLIB00017315590","spectrum_index":49050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylcadaverine - 40.0 eV (delta mass: 344.1314 Da; putative annotation: N/A; putative formula: C25H16N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.265,"smiles":null,"spectrum_id":"CCMSLIB00017315591","spectrum_index":49051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 274.1487 Da; putative annotation: N/A; putative formula: C17H23OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.302,"smiles":null,"spectrum_id":"CCMSLIB00017315592","spectrum_index":49052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 765.3155 Da; putative annotation: N/A; putative formula: C29H43N13O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.413,"smiles":null,"spectrum_id":"CCMSLIB00017315593","spectrum_index":49053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7,8,9,10,11-Hexahydro-5H-cycloocta[b]indole (delta mass: 111.0365 Da; putative annotation: N/A; putative formula: C4H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.18,"smiles":null,"spectrum_id":"CCMSLIB00017315594","spectrum_index":49054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 4-ethyl-2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]- (delta mass: 72.0423 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.249,"smiles":null,"spectrum_id":"CCMSLIB00017315595","spectrum_index":49055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 540.308 Da; putative annotation: N/A; putative formula: C24H48N2O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":747.394,"smiles":null,"spectrum_id":"CCMSLIB00017315596","spectrum_index":49056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 167.038 Da; putative annotation: N/A; putative formula: C4H5N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.151,"smiles":null,"spectrum_id":"CCMSLIB00017315597","spectrum_index":49057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 26.0513 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":136.111,"smiles":null,"spectrum_id":"CCMSLIB00017315598","spectrum_index":49058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptamine (delta mass: 66.0214 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.129,"smiles":null,"spectrum_id":"CCMSLIB00017315599","spectrum_index":49059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 436.2594 Da; putative annotation: N/A; putative formula: C21H41O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.356,"smiles":null,"spectrum_id":"CCMSLIB00017315600","spectrum_index":49060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of lysergol (delta mass: 35.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.197,"smiles":null,"spectrum_id":"CCMSLIB00017315601","spectrum_index":49061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Ile (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.139,"smiles":null,"spectrum_id":"CCMSLIB00017315602","spectrum_index":49062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 17.035 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.102,"smiles":null,"spectrum_id":"CCMSLIB00017315603","spectrum_index":49063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 132.021 Da; putative annotation: N/A; putative formula: C8H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.145,"smiles":null,"spectrum_id":"CCMSLIB00017315604","spectrum_index":49064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 130.0787 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.202,"smiles":null,"spectrum_id":"CCMSLIB00017315605","spectrum_index":49065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 155.0468 Da; putative annotation: N/A; putative formula: C9H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.144,"smiles":null,"spectrum_id":"CCMSLIB00017315606","spectrum_index":49066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 382.0906 Da; putative annotation: N/A; putative formula: C20H19N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.155,"smiles":null,"spectrum_id":"CCMSLIB00017315607","spectrum_index":49067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 187.0996 Da; putative annotation: N/A; putative formula: C12H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.207,"smiles":null,"spectrum_id":"CCMSLIB00017315608","spectrum_index":49068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 322.0456 Da; putative annotation: N/A; putative formula: C11H15O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.113,"smiles":null,"spectrum_id":"CCMSLIB00017315609","spectrum_index":49069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-((methylamino)methyl)quinolin-2(1H)-one (delta mass: 211.0804 Da; putative annotation: N/A; putative formula: C9H15N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.183,"smiles":null,"spectrum_id":"CCMSLIB00017315610","spectrum_index":49070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 122.0732 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.159,"smiles":null,"spectrum_id":"CCMSLIB00017315611","spectrum_index":49071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 22.0952 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.107,"smiles":null,"spectrum_id":"CCMSLIB00017315612","spectrum_index":49072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 95.0777 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.175,"smiles":null,"spectrum_id":"CCMSLIB00017315613","spectrum_index":49073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 217.0737 Da; putative annotation: N/A; putative formula: C12H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.165,"smiles":null,"spectrum_id":"CCMSLIB00017315614","spectrum_index":49074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 58.3765 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.5,"smiles":null,"spectrum_id":"CCMSLIB00017315615","spectrum_index":49075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 304.264 Da; putative annotation: N/A; putative formula: C18H32N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.355,"smiles":null,"spectrum_id":"CCMSLIB00017315616","spectrum_index":49076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 68.9046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.001,"smiles":null,"spectrum_id":"CCMSLIB00017315617","spectrum_index":49077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ureidopropionic acid (delta mass: 58.0094 Da; putative annotation: N/A; putative formula: CH3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.07,"smiles":null,"spectrum_id":"CCMSLIB00017315618","spectrum_index":49078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 387.2576 Da; putative annotation: N/A; putative formula: C20H33N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.381,"smiles":null,"spectrum_id":"CCMSLIB00017315619","spectrum_index":49079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 42.0132 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.078,"smiles":null,"spectrum_id":"CCMSLIB00017315620","spectrum_index":49080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 111.1258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.185,"smiles":null,"spectrum_id":"CCMSLIB00017315621","spectrum_index":49081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 92.0519 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.155,"smiles":null,"spectrum_id":"CCMSLIB00017315622","spectrum_index":49082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 441.2261 Da; putative annotation: N/A; putative formula: C24H31N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.339,"smiles":null,"spectrum_id":"CCMSLIB00017315623","spectrum_index":49083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 276.2968 Da; putative annotation: N/A; putative formula: C19H36N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.367,"smiles":null,"spectrum_id":"CCMSLIB00017315624","spectrum_index":49084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 76.0678 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017315625","spectrum_index":49085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 9.9857 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":144.082,"smiles":null,"spectrum_id":"CCMSLIB00017315626","spectrum_index":49086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 85.0653 Da; putative annotation: N/A; putative formula: C3H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.146,"smiles":null,"spectrum_id":"CCMSLIB00017315627","spectrum_index":49087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 113.048 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.171,"smiles":null,"spectrum_id":"CCMSLIB00017315628","spectrum_index":49088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 325.3515 Da; putative annotation: N/A; putative formula: C19H43N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.443,"smiles":null,"spectrum_id":"CCMSLIB00017315629","spectrum_index":49089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 210.1368 Da; putative annotation: Ile-Pro; putative formula: C11H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.313,"smiles":null,"spectrum_id":"CCMSLIB00017315630","spectrum_index":49090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 134.0474 Da; putative annotation: 5-Nitro-2-toluidine; putative formula: C7H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.113,"smiles":null,"spectrum_id":"CCMSLIB00017315631","spectrum_index":49091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Ile (delta mass: 212.1518 Da; putative annotation: Leu-Val; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.301,"smiles":null,"spectrum_id":"CCMSLIB00017315632","spectrum_index":49092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 260.2139 Da; putative annotation: 9Z,11E,13E-Octadecatrienoic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.29,"smiles":null,"spectrum_id":"CCMSLIB00017315633","spectrum_index":49093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 316.2405 Da; putative annotation: 5.beta.-Pregnane-3.alpha.,17-diol-20-one; putative formula: C21H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.311,"smiles":null,"spectrum_id":"CCMSLIB00017315634","spectrum_index":49094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 470.1803 Da; putative annotation: Eugenol gentiobioside; putative formula: C22H30O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.24,"smiles":null,"spectrum_id":"CCMSLIB00017315635","spectrum_index":49095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 165.0426 Da; putative annotation: 4-Pyridoxic acid; AIF; CE10; CorrDec; putative formula: C8H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017315636","spectrum_index":49096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 273.1012 Da; putative annotation: Benzoic acid, 4-[[tetrahydro-2-(3-hydroxy-1-butenyl)-5-oxo-3-furanyl]amino]-; putative formula: C15H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.225,"smiles":null,"spectrum_id":"CCMSLIB00017315637","spectrum_index":49097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 105.0574 Da; putative annotation: 2-(4-Pyridinyl)ethanol; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.154,"smiles":null,"spectrum_id":"CCMSLIB00017315638","spectrum_index":49098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 282.2552 Da; putative annotation: Spectral Match to 3-Hydroxyoctadecanoic Acid from NIST14; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.32,"smiles":null,"spectrum_id":"CCMSLIB00017315639","spectrum_index":49099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 297.1571 Da; putative annotation: N/A; putative formula: C15H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.327,"smiles":null,"spectrum_id":"CCMSLIB00017315640","spectrum_index":49100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 264.2929 Da; putative annotation: N/A; putative formula: C18H36N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.358,"smiles":null,"spectrum_id":"CCMSLIB00017315641","spectrum_index":49101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 138.0463 Da; putative annotation: N/A; putative formula: C5H7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.17,"smiles":null,"spectrum_id":"CCMSLIB00017315642","spectrum_index":49102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxymorphinan (delta mass: 45.0126 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.182,"smiles":null,"spectrum_id":"CCMSLIB00017315643","spectrum_index":49103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 166.078 Da; putative annotation: N/A; putative formula: C13H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.202,"smiles":null,"spectrum_id":"CCMSLIB00017315644","spectrum_index":49104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 119.0575 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.117,"smiles":null,"spectrum_id":"CCMSLIB00017315645","spectrum_index":49105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 164.1532 Da; putative annotation: N/A; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.25,"smiles":null,"spectrum_id":"CCMSLIB00017315646","spectrum_index":49106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.144,"smiles":null,"spectrum_id":"CCMSLIB00017315647","spectrum_index":49107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 405.1154 Da; putative annotation: N/A; putative formula: C30H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.196,"smiles":null,"spectrum_id":"CCMSLIB00017315648","spectrum_index":49108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7-Trimethyl-4(1H)-quinolinone (delta mass: 31.0813 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.188,"smiles":null,"spectrum_id":"CCMSLIB00017315649","spectrum_index":49109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 351.1682 Da; putative annotation: N/A; putative formula: C18H25NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.233,"smiles":null,"spectrum_id":"CCMSLIB00017315650","spectrum_index":49110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 8.9887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.091,"smiles":null,"spectrum_id":"CCMSLIB00017315651","spectrum_index":49111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coumaroyl putrescin (delta mass: 148.1828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.327,"smiles":null,"spectrum_id":"CCMSLIB00017315652","spectrum_index":49112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 126.0861 Da; putative annotation: N/A; putative formula: C8H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.21,"smiles":null,"spectrum_id":"CCMSLIB00017315653","spectrum_index":49113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxytryptamine (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.144,"smiles":null,"spectrum_id":"CCMSLIB00017315654","spectrum_index":49114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSAMINE (delta mass: 160.9152 Da; putative annotation: N/A; putative formula: C2H-1N3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.002,"smiles":null,"spectrum_id":"CCMSLIB00017315655","spectrum_index":49115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 112.9325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.003,"smiles":null,"spectrum_id":"CCMSLIB00017315656","spectrum_index":49116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 374.1105 Da; putative annotation: N/A; putative formula: C20H23O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.244,"smiles":null,"spectrum_id":"CCMSLIB00017315657","spectrum_index":49117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 54.9223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.082,"smiles":null,"spectrum_id":"CCMSLIB00017315658","spectrum_index":49118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 364.2261 Da; putative annotation: N/A; putative formula: C22H28N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.297,"smiles":null,"spectrum_id":"CCMSLIB00017315659","spectrum_index":49119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 74.0392 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.08,"smiles":null,"spectrum_id":"CCMSLIB00017315660","spectrum_index":49120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005787 Indole-3-carboxylic acid|1H-indole-3-carboxylic acid (delta mass: 148.0371 Da; putative annotation: N/A; putative formula: C5H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.092,"smiles":null,"spectrum_id":"CCMSLIB00017315661","spectrum_index":49121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 45.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.223,"smiles":null,"spectrum_id":"CCMSLIB00017315662","spectrum_index":49122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 327.0903 Da; putative annotation: N/A; putative formula: C14H13N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.177,"smiles":null,"spectrum_id":"CCMSLIB00017315663","spectrum_index":49123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310692 Disaccharide(Hex-Hex) (delta mass: 342.1162 Da; putative annotation: N/A; putative formula: C12H22O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.24,"smiles":null,"spectrum_id":"CCMSLIB00017315664","spectrum_index":49124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of lysergol (delta mass: 59.9843 Da; putative annotation: N/A; putative formula: CO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017315665","spectrum_index":49125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 141.0778 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.133,"smiles":null,"spectrum_id":"CCMSLIB00017315666","spectrum_index":49126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 234.097 Da; putative annotation: N/A; putative formula: C9H21N2O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.168,"smiles":null,"spectrum_id":"CCMSLIB00017315667","spectrum_index":49127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 762.4138 Da; putative annotation: N/A; putative formula: C41H58N6O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.484,"smiles":null,"spectrum_id":"CCMSLIB00017315668","spectrum_index":49128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 36.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.16,"smiles":null,"spectrum_id":"CCMSLIB00017315669","spectrum_index":49129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 206.0574 Da; putative annotation: N/A; putative formula: C5H11N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.18,"smiles":null,"spectrum_id":"CCMSLIB00017315670","spectrum_index":49130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 63.9993 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.081,"smiles":null,"spectrum_id":"CCMSLIB00017315671","spectrum_index":49131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 325.1817 Da; putative annotation: N/A; putative formula: C18H24N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.258,"smiles":null,"spectrum_id":"CCMSLIB00017315672","spectrum_index":49132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 356.2954 Da; putative annotation: N/A; putative formula: C20H41N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.364,"smiles":null,"spectrum_id":"CCMSLIB00017315673","spectrum_index":49133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 731.3043 Da; putative annotation: N/A; putative formula: C44H41N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":882.364,"smiles":null,"spectrum_id":"CCMSLIB00017315674","spectrum_index":49134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 2.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.128,"smiles":null,"spectrum_id":"CCMSLIB00017315675","spectrum_index":49135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 15.9714 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.13,"smiles":null,"spectrum_id":"CCMSLIB00017315676","spectrum_index":49136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 120.0976 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.273,"smiles":null,"spectrum_id":"CCMSLIB00017315677","spectrum_index":49137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 376.0946 Da; putative annotation: N/A; putative formula: C22H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.186,"smiles":null,"spectrum_id":"CCMSLIB00017315678","spectrum_index":49138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 629.2156 Da; putative annotation: N/A; putative formula: C29H35N5O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.339,"smiles":null,"spectrum_id":"CCMSLIB00017315679","spectrum_index":49139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 81.045 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.168,"smiles":null,"spectrum_id":"CCMSLIB00017315680","spectrum_index":49140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 43.0631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.154,"smiles":null,"spectrum_id":"CCMSLIB00017315681","spectrum_index":49141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 259.1417 Da; putative annotation: N/A; putative formula: C12H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.217,"smiles":null,"spectrum_id":"CCMSLIB00017315682","spectrum_index":49142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pindolol (delta mass: 226.1655 Da; putative annotation: N/A; putative formula: C8H18N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.325,"smiles":null,"spectrum_id":"CCMSLIB00017315683","spectrum_index":49143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 407.1931 Da; putative annotation: N/A; putative formula: C18H21N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.347,"smiles":null,"spectrum_id":"CCMSLIB00017315684","spectrum_index":49144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 92.1221 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.276,"smiles":null,"spectrum_id":"CCMSLIB00017315685","spectrum_index":49145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 64.0393 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.151,"smiles":null,"spectrum_id":"CCMSLIB00017315686","spectrum_index":49146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 78.0825 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.163,"smiles":null,"spectrum_id":"CCMSLIB00017315687","spectrum_index":49147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Thr (delta mass: 72.0035 Da; putative annotation: N/A; putative formula: C3H4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.096,"smiles":null,"spectrum_id":"CCMSLIB00017315688","spectrum_index":49148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 386.3024 Da; putative annotation: N/A; putative formula: C19H34N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":647.339,"smiles":null,"spectrum_id":"CCMSLIB00017315689","spectrum_index":49149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 140.1572 Da; putative annotation: N/A; putative formula: C10H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.222,"smiles":null,"spectrum_id":"CCMSLIB00017315690","spectrum_index":49150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 61.0253 Da; putative annotation: N/A; putative formula: H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017315691","spectrum_index":49151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 289.166 Da; putative annotation: N/A; putative formula: C11H24N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.299,"smiles":null,"spectrum_id":"CCMSLIB00017315692","spectrum_index":49152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 149.1206 Da; putative annotation: N/A; putative formula: C10H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.223,"smiles":null,"spectrum_id":"CCMSLIB00017315693","spectrum_index":49153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 212.1493 Da; putative annotation: N/A; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.304,"smiles":null,"spectrum_id":"CCMSLIB00017315694","spectrum_index":49154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Nitro-1-propenyl)indole (delta mass: 161.0465 Da; putative annotation: N/A; putative formula: C3H8N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.128,"smiles":null,"spectrum_id":"CCMSLIB00017315695","spectrum_index":49155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 93.0556 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.204,"smiles":null,"spectrum_id":"CCMSLIB00017315696","spectrum_index":49156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 142.1136 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.195,"smiles":null,"spectrum_id":"CCMSLIB00017315697","spectrum_index":49157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 327.1327 Da; putative annotation: N/A; putative formula: C16H25NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.271,"smiles":null,"spectrum_id":"CCMSLIB00017315698","spectrum_index":49158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 205.0621 Da; putative annotation: N/A; putative formula: C6H12N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.148,"smiles":null,"spectrum_id":"CCMSLIB00017315699","spectrum_index":49159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 23.0288 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.089,"smiles":null,"spectrum_id":"CCMSLIB00017315700","spectrum_index":49160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 48.0678 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.159,"smiles":null,"spectrum_id":"CCMSLIB00017315701","spectrum_index":49161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 103.0049 Da; putative annotation: N/A; putative formula: H2N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.081,"smiles":null,"spectrum_id":"CCMSLIB00017315702","spectrum_index":49162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 18.0925 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.211,"smiles":null,"spectrum_id":"CCMSLIB00017315703","spectrum_index":49163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 651.5413 Da; putative annotation: N/A; putative formula: C39H73NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":837.613,"smiles":null,"spectrum_id":"CCMSLIB00017315704","spectrum_index":49164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 64.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.118,"smiles":null,"spectrum_id":"CCMSLIB00017315705","spectrum_index":49165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 91.0644 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.145,"smiles":null,"spectrum_id":"CCMSLIB00017315706","spectrum_index":49166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-methoxybenzyl)ethanamine (delta mass: 112.07 Da; putative annotation: N/A; putative formula: C7H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.215,"smiles":null,"spectrum_id":"CCMSLIB00017315707","spectrum_index":49167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU244306 2-Amino-9H-pyrido[2,3-b]indole (AalphaC)|2-Amino-9H-pyrido[2,3-b]indole|9H-pyrido[2,3-b]indol-2-amine (delta mass: 606.5331 Da; putative annotation: N/A; putative formula: C37H70N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.62,"smiles":null,"spectrum_id":"CCMSLIB00017315708","spectrum_index":49168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 150.1622 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.254,"smiles":null,"spectrum_id":"CCMSLIB00017315709","spectrum_index":49169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 193.0347 Da; putative annotation: N/A; putative formula: C5H3N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.105,"smiles":null,"spectrum_id":"CCMSLIB00017315710","spectrum_index":49170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 127.0644 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.177,"smiles":null,"spectrum_id":"CCMSLIB00017315711","spectrum_index":49171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 116.0817 Da; putative annotation: N/A; putative formula: C2H8N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.225,"smiles":null,"spectrum_id":"CCMSLIB00017315712","spectrum_index":49172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 532.2506 Da; putative annotation: N/A; putative formula: C22H32N10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.347,"smiles":null,"spectrum_id":"CCMSLIB00017315713","spectrum_index":49173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 382.222 Da; putative annotation: N/A; putative formula: C20H37N2O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.346,"smiles":null,"spectrum_id":"CCMSLIB00017315714","spectrum_index":49174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 249.1731 Da; putative annotation: N/A; putative formula: C15H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.297,"smiles":null,"spectrum_id":"CCMSLIB00017315715","spectrum_index":49175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 142.1562 Da; putative annotation: N/A; putative formula: C7H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.263,"smiles":null,"spectrum_id":"CCMSLIB00017315716","spectrum_index":49176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 24.0611 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.121,"smiles":null,"spectrum_id":"CCMSLIB00017315717","spectrum_index":49177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 134.0709 Da; putative annotation: N/A; putative formula: C5H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.151,"smiles":null,"spectrum_id":"CCMSLIB00017315718","spectrum_index":49178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 194.0434 Da; putative annotation: N/A; putative formula: C7H14O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.176,"smiles":null,"spectrum_id":"CCMSLIB00017315719","spectrum_index":49179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004803 2-naphthoic acid|naphthalene-2-carboxylic acid (delta mass: 58.0059 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.066,"smiles":null,"spectrum_id":"CCMSLIB00017315720","spectrum_index":49180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 28.0314 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.112,"smiles":null,"spectrum_id":"CCMSLIB00017315721","spectrum_index":49181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 132.2221 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.319,"smiles":null,"spectrum_id":"CCMSLIB00017315722","spectrum_index":49182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 55.99 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.05,"smiles":null,"spectrum_id":"CCMSLIB00017315723","spectrum_index":49183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 266.1314 Da; putative annotation: N/A; putative formula: C11H18N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.197,"smiles":null,"spectrum_id":"CCMSLIB00017315724","spectrum_index":49184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006041 (+/-) Salsolinol|1-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 224.1621 Da; putative annotation: N/A; putative formula: C7H16N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.264,"smiles":null,"spectrum_id":"CCMSLIB00017315725","spectrum_index":49185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 110.0285 Da; putative annotation: N/A; putative formula: C6H7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.155,"smiles":null,"spectrum_id":"CCMSLIB00017315726","spectrum_index":49186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 275.0826 Da; putative annotation: N/A; putative formula: C11H17NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.168,"smiles":null,"spectrum_id":"CCMSLIB00017315727","spectrum_index":49187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 168.0055 Da; putative annotation: N/A; putative formula: C7H4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.128,"smiles":null,"spectrum_id":"CCMSLIB00017315728","spectrum_index":49188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2,9,10-trimethoxy-5,6-dihydroisoquinolino[3,2-a]isoquinolinium cation (delta mass: 220.0608 Da; putative annotation: N/A; putative formula: C10H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.2,"smiles":null,"spectrum_id":"CCMSLIB00017315729","spectrum_index":49189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 432.2501 Da; putative annotation: N/A; putative formula: C19H37N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.347,"smiles":null,"spectrum_id":"CCMSLIB00017315730","spectrum_index":49190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 281.1996 Da; putative annotation: N/A; putative formula: C16H27NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.27,"smiles":null,"spectrum_id":"CCMSLIB00017315731","spectrum_index":49191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 172.0524 Da; putative annotation: N/A; putative formula: C11H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.118,"smiles":null,"spectrum_id":"CCMSLIB00017315732","spectrum_index":49192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 132.0932 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.383,"smiles":null,"spectrum_id":"CCMSLIB00017315733","spectrum_index":49193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 138.1403 Da; putative annotation: N/A; putative formula: C10H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.232,"smiles":null,"spectrum_id":"CCMSLIB00017315734","spectrum_index":49194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 17.0664 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.179,"smiles":null,"spectrum_id":"CCMSLIB00017315735","spectrum_index":49195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 89.9403 Da; putative annotation: N/A; putative formula: CH-2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.0,"smiles":null,"spectrum_id":"CCMSLIB00017315736","spectrum_index":49196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 143.1309 Da; putative annotation: N/A; putative formula: C8H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.243,"smiles":null,"spectrum_id":"CCMSLIB00017315737","spectrum_index":49197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(5-Nitro-1H-indol-3-yl)ethan-1-one (delta mass: 42.0132 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.074,"smiles":null,"spectrum_id":"CCMSLIB00017315738","spectrum_index":49198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 517.2901 Da; putative annotation: N/A; putative formula: C26H39N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.361,"smiles":null,"spectrum_id":"CCMSLIB00017315739","spectrum_index":49199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 120.0216 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.082,"smiles":null,"spectrum_id":"CCMSLIB00017315740","spectrum_index":49200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 125.0469 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.165,"smiles":null,"spectrum_id":"CCMSLIB00017315741","spectrum_index":49201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 60.0082 Da; putative annotation: N/A; putative formula: C4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.145,"smiles":null,"spectrum_id":"CCMSLIB00017315742","spectrum_index":49202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 789.629 Da; putative annotation: N/A; putative formula: C37H75N17O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1294.81,"smiles":null,"spectrum_id":"CCMSLIB00017315743","spectrum_index":49203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 36.0365 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.258,"smiles":null,"spectrum_id":"CCMSLIB00017315744","spectrum_index":49204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 252.1468 Da; putative annotation: N/A; putative formula: C15H25O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.238,"smiles":null,"spectrum_id":"CCMSLIB00017315745","spectrum_index":49205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 113.9843 Da; putative annotation: N/A; putative formula: H-1N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.086,"smiles":null,"spectrum_id":"CCMSLIB00017315746","spectrum_index":49206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 213.1589 Da; putative annotation: N/A; putative formula: C9H19N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.276,"smiles":null,"spectrum_id":"CCMSLIB00017315747","spectrum_index":49207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 120.0424 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.217,"smiles":null,"spectrum_id":"CCMSLIB00017315748","spectrum_index":49208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 200.1051 Da; putative annotation: N/A; putative formula: C10H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.16,"smiles":null,"spectrum_id":"CCMSLIB00017315749","spectrum_index":49209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 238.2028 Da; putative annotation: N/A; putative formula: C10H22N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.305,"smiles":null,"spectrum_id":"CCMSLIB00017315750","spectrum_index":49210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 356.2352 Da; putative annotation: N/A; putative formula: C23H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.311,"smiles":null,"spectrum_id":"CCMSLIB00017315751","spectrum_index":49211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 1251.5904 Da; putative annotation: N/A; putative formula: C73H77N11O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1444.66,"smiles":null,"spectrum_id":"CCMSLIB00017315752","spectrum_index":49212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 34.0205 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.122,"smiles":null,"spectrum_id":"CCMSLIB00017315753","spectrum_index":49213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 74.0514 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.091,"smiles":null,"spectrum_id":"CCMSLIB00017315754","spectrum_index":49214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 68.0623 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.305,"smiles":null,"spectrum_id":"CCMSLIB00017315755","spectrum_index":49215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 64.0675 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.227,"smiles":null,"spectrum_id":"CCMSLIB00017315756","spectrum_index":49216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 61.0311 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.118,"smiles":null,"spectrum_id":"CCMSLIB00017315757","spectrum_index":49217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 148.0515 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.138,"smiles":null,"spectrum_id":"CCMSLIB00017315758","spectrum_index":49218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 176.1205 Da; putative annotation: N/A; putative formula: C12H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.217,"smiles":null,"spectrum_id":"CCMSLIB00017315759","spectrum_index":49219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 657.2557 Da; putative annotation: N/A; putative formula: C42H43NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":984.384,"smiles":null,"spectrum_id":"CCMSLIB00017315760","spectrum_index":49220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephromopsic acid (delta mass: 134.1106 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.364,"smiles":null,"spectrum_id":"CCMSLIB00017315761","spectrum_index":49221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS001250169-01! (delta mass: 51.0531 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.171,"smiles":null,"spectrum_id":"CCMSLIB00017315762","spectrum_index":49222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 225.1444 Da; putative annotation: N/A; putative formula: C10H19N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.268,"smiles":null,"spectrum_id":"CCMSLIB00017315763","spectrum_index":49223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 311.909 Da; putative annotation: N/A; putative formula: C4H8O8S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017315764","spectrum_index":49224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 359.617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.714,"smiles":null,"spectrum_id":"CCMSLIB00017315765","spectrum_index":49225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100300 4-Methyl-5-thiazoleethanol|MHT|Sulfurol|Hemineurine|4-Methyl-5-hydroxyethylthiazole (delta mass: 16.0622 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.11,"smiles":null,"spectrum_id":"CCMSLIB00017315766","spectrum_index":49226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 263.2532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.35,"smiles":null,"spectrum_id":"CCMSLIB00017315767","spectrum_index":49227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 174.1624 Da; putative annotation: N/A; putative formula: C6H18N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.389,"smiles":null,"spectrum_id":"CCMSLIB00017315768","spectrum_index":49228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 240.1736 Da; putative annotation: N/A; putative formula: C15H20N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.333,"smiles":null,"spectrum_id":"CCMSLIB00017315769","spectrum_index":49229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 61.0415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017315770","spectrum_index":49230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 331.1382 Da; putative annotation: N/A; putative formula: C16H22N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.246,"smiles":null,"spectrum_id":"CCMSLIB00017315771","spectrum_index":49231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopyridine (delta mass: 81.0417 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.102,"smiles":null,"spectrum_id":"CCMSLIB00017315772","spectrum_index":49232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 100.0164 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.108,"smiles":null,"spectrum_id":"CCMSLIB00017315773","spectrum_index":49233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 306.053 Da; putative annotation: N/A; putative formula: C11H18N2O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.113,"smiles":null,"spectrum_id":"CCMSLIB00017315774","spectrum_index":49234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 100.0633 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.108,"smiles":null,"spectrum_id":"CCMSLIB00017315775","spectrum_index":49235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 174.0437 Da; putative annotation: N/A; putative formula: C9H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.125,"smiles":null,"spectrum_id":"CCMSLIB00017315776","spectrum_index":49236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-3-(4-piperidinyl)-1H-indole (delta mass: 32.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.15,"smiles":null,"spectrum_id":"CCMSLIB00017315777","spectrum_index":49237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 87.032 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.059,"smiles":null,"spectrum_id":"CCMSLIB00017315778","spectrum_index":49238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-8a-hydroxy-1-methoxy-7-methyl-6,8-dioxo-1H-isochromen-7-yl] acetate (delta mass: 50.1691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.321,"smiles":null,"spectrum_id":"CCMSLIB00017315779","spectrum_index":49239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 191.1522 Da; putative annotation: N/A; putative formula: C10H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.233,"smiles":null,"spectrum_id":"CCMSLIB00017315780","spectrum_index":49240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 51.0473 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.113,"smiles":null,"spectrum_id":"CCMSLIB00017315781","spectrum_index":49241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 88.009 Da; putative annotation: N/A; putative formula: C2H4N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.074,"smiles":null,"spectrum_id":"CCMSLIB00017315782","spectrum_index":49242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N ALPHA-ACETYL-L-LYSINE (delta mass: 147.0686 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.192,"smiles":null,"spectrum_id":"CCMSLIB00017315783","spectrum_index":49243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 156.0401 Da; putative annotation: N/A; putative formula: C11H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.137,"smiles":null,"spectrum_id":"CCMSLIB00017315784","spectrum_index":49244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol (delta mass: 199.1541 Da; putative annotation: N/A; putative formula: C7H17N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.314,"smiles":null,"spectrum_id":"CCMSLIB00017315785","spectrum_index":49245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 119.9907 Da; putative annotation: N/A; putative formula: C2H5N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.089,"smiles":null,"spectrum_id":"CCMSLIB00017315786","spectrum_index":49246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Asp-Leu from NIST14 (delta mass: 99.069 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.198,"smiles":null,"spectrum_id":"CCMSLIB00017315787","spectrum_index":49247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 61.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.17,"smiles":null,"spectrum_id":"CCMSLIB00017315788","spectrum_index":49248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140301 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 101.0479 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.144,"smiles":null,"spectrum_id":"CCMSLIB00017315789","spectrum_index":49249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 55.0126 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.12,"smiles":null,"spectrum_id":"CCMSLIB00017315790","spectrum_index":49250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 65.0067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.056,"smiles":null,"spectrum_id":"CCMSLIB00017315791","spectrum_index":49251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7S,7aR)-N-Methylhexahydro-1H-1,6-epoxypyrrolizin-7-amine (delta mass: 40.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.129,"smiles":null,"spectrum_id":"CCMSLIB00017315792","spectrum_index":49252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 124.0124 Da; putative annotation: N/A; putative formula: CH4N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.083,"smiles":null,"spectrum_id":"CCMSLIB00017315793","spectrum_index":49253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 73.075 Da; putative annotation: N/A; putative formula: CH7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.193,"smiles":null,"spectrum_id":"CCMSLIB00017315794","spectrum_index":49254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 130.1802 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.221,"smiles":null,"spectrum_id":"CCMSLIB00017315795","spectrum_index":49255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 26.9957 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.108,"smiles":null,"spectrum_id":"CCMSLIB00017315796","spectrum_index":49256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 353.075 Da; putative annotation: N/A; putative formula: C10H12N9O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.172,"smiles":null,"spectrum_id":"CCMSLIB00017315797","spectrum_index":49257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 113.0836 Da; putative annotation: Massbank:CE000619 Isoleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.212,"smiles":null,"spectrum_id":"CCMSLIB00017315798","spectrum_index":49258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100215 alpha-Methyl-DL-serine|DL-2-Methylserine|2-Amino-3-hydroxy-2-methylpropanoic Acid|DL-2-Amino-3-hydroxy-2-methylpropionic Acid|DL-alpha-(Hydroxymethyl)alanine|alpha-Methylserine (delta mass: 129.0424 Da; putative annotation: O-Acetyl-L-serine; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.108,"smiles":null,"spectrum_id":"CCMSLIB00017315799","spectrum_index":49259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 164.068 Da; putative annotation: D-Sorbitol; putative formula: C6H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.133,"smiles":null,"spectrum_id":"CCMSLIB00017315800","spectrum_index":49260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 140.0467 Da; putative annotation: 4,6-Dioxoheptanoic acid; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.107,"smiles":null,"spectrum_id":"CCMSLIB00017315801","spectrum_index":49261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 243.1109 Da; putative annotation: Lotaustralin; putative formula: C11H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.182,"smiles":null,"spectrum_id":"CCMSLIB00017315802","spectrum_index":49262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 174.0681 Da; putative annotation: Ethyl p-coumarate; putative formula: C11H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.118,"smiles":null,"spectrum_id":"CCMSLIB00017315803","spectrum_index":49263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 280.2403 Da; putative annotation: 3-Oxostearic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.311,"smiles":null,"spectrum_id":"CCMSLIB00017315804","spectrum_index":49264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 242.093 Da; putative annotation: 8-Deoxylactucin; putative formula: C15H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.169,"smiles":null,"spectrum_id":"CCMSLIB00017315805","spectrum_index":49265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 162.0681 Da; putative annotation: 4-Hydroxy-3-methoxyphenylacetone; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.139,"smiles":null,"spectrum_id":"CCMSLIB00017315806","spectrum_index":49266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 216.0781 Da; putative annotation: 7-Acetyl-3,6-dihydroxy-8-methyl-3,4-dihydronaphthalen-1(2H)-one; putative formula: C13H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.143,"smiles":null,"spectrum_id":"CCMSLIB00017315807","spectrum_index":49267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 164.0982 Da; putative annotation: 2,8-Diazaspiro[5.5]undecane-1,7-dione; putative formula: C9H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.195,"smiles":null,"spectrum_id":"CCMSLIB00017315808","spectrum_index":49268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 808.4242 Da; putative annotation: 1-O-((2.beta.,3.beta.,5.Xi.,9.Xi.,18.Xi.)-3-(.beta.-D-Glucopyranuronosyloxy)-2,23-dihydroxy-28-oxoolean-12-en-28-yl)-.beta.-D-glucopyranose; putative formula: C42H64O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.5,"smiles":null,"spectrum_id":"CCMSLIB00017315809","spectrum_index":49269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 95.0945 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.181,"smiles":null,"spectrum_id":"CCMSLIB00017315810","spectrum_index":49270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 107.0372 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.118,"smiles":null,"spectrum_id":"CCMSLIB00017315811","spectrum_index":49271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-trans-Dihydroxy-10,11-dihydrocarbamazepine (delta mass: 208.1103 Da; putative annotation: N/A; putative formula: C12H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.218,"smiles":null,"spectrum_id":"CCMSLIB00017315812","spectrum_index":49272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 173.0689 Da; putative annotation: N/A; putative formula: C7H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.124,"smiles":null,"spectrum_id":"CCMSLIB00017315813","spectrum_index":49273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-crinamine (delta mass: 43.9892 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.128,"smiles":null,"spectrum_id":"CCMSLIB00017315814","spectrum_index":49274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 68.0626 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.237,"smiles":null,"spectrum_id":"CCMSLIB00017315815","spectrum_index":49275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 144.089 Da; putative annotation: N/A; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.238,"smiles":null,"spectrum_id":"CCMSLIB00017315816","spectrum_index":49276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 701.2712 Da; putative annotation: N/A; putative formula: C45H39N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1044.39,"smiles":null,"spectrum_id":"CCMSLIB00017315817","spectrum_index":49277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 927.4493 Da; putative annotation: N/A; putative formula: C55H65N3O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1134.54,"smiles":null,"spectrum_id":"CCMSLIB00017315818","spectrum_index":49278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381327-01_C21H28O6_2H,11H-Naphtho[2,1-b]pyrano[3,2-e]pyran-9-carboxylic acid, 1,3,4,4a,5,6,6a,12,12a,12b-decahydro-3-hydroxy-4,4,6a,12b-tetramethyl-11-oxo- (delta mass: 203.0658 Da; putative annotation: N/A; putative formula: C5H9N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.262,"smiles":null,"spectrum_id":"CCMSLIB00017315819","spectrum_index":49279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 646.2559 Da; putative annotation: N/A; putative formula: C24H38N8O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.368,"smiles":null,"spectrum_id":"CCMSLIB00017315820","spectrum_index":49280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380147-01_C26H34O8_ (delta mass: 78.0133 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.246,"smiles":null,"spectrum_id":"CCMSLIB00017315821","spectrum_index":49281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 146.0755 Da; putative annotation: N/A; putative formula: C7H14OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.183,"smiles":null,"spectrum_id":"CCMSLIB00017315822","spectrum_index":49282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 238.1048 Da; putative annotation: N/A; putative formula: C9H18O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.216,"smiles":null,"spectrum_id":"CCMSLIB00017315823","spectrum_index":49283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Digalacturonic acid (delta mass: 68.0685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.151,"smiles":null,"spectrum_id":"CCMSLIB00017315824","spectrum_index":49284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 37.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017315825","spectrum_index":49285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 17.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.107,"smiles":null,"spectrum_id":"CCMSLIB00017315826","spectrum_index":49286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 311.1218 Da; putative annotation: N/A; putative formula: C11H21NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.182,"smiles":null,"spectrum_id":"CCMSLIB00017315827","spectrum_index":49287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 28.9137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017315828","spectrum_index":49288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 88.0251 Da; putative annotation: N/A; putative formula: C2H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.138,"smiles":null,"spectrum_id":"CCMSLIB00017315829","spectrum_index":49289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 36.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.118,"smiles":null,"spectrum_id":"CCMSLIB00017315830","spectrum_index":49290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 89.0486 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.146,"smiles":null,"spectrum_id":"CCMSLIB00017315831","spectrum_index":49291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 201.1367 Da; putative annotation: N/A; putative formula: C10H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.26,"smiles":null,"spectrum_id":"CCMSLIB00017315832","spectrum_index":49292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 162.1255 Da; putative annotation: N/A; putative formula: C9H14N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.295,"smiles":null,"spectrum_id":"CCMSLIB00017315833","spectrum_index":49293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 61.9457 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.042,"smiles":null,"spectrum_id":"CCMSLIB00017315834","spectrum_index":49294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 104.0619 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.174,"smiles":null,"spectrum_id":"CCMSLIB00017315835","spectrum_index":49295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 44.999 Da; putative annotation: N/A; putative formula: C4H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.085,"smiles":null,"spectrum_id":"CCMSLIB00017315836","spectrum_index":49296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 200.008 Da; putative annotation: N/A; putative formula: C7H8N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.105,"smiles":null,"spectrum_id":"CCMSLIB00017315837","spectrum_index":49297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 53.933 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017315838","spectrum_index":49298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(2-Oxo-2,3-dihydro-1H-benzimidazol-1-yl)butanoic acid (delta mass: 130.0669 Da; putative annotation: N/A; putative formula: C4H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.159,"smiles":null,"spectrum_id":"CCMSLIB00017315839","spectrum_index":49299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 876.2377 Da; putative annotation: N/A; putative formula: C39H48N4O13S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1039.3,"smiles":null,"spectrum_id":"CCMSLIB00017315840","spectrum_index":49300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 84.0481 Da; putative annotation: N/A; putative formula: C5H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.15,"smiles":null,"spectrum_id":"CCMSLIB00017315841","spectrum_index":49301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 109.0623 Da; putative annotation: N/A; putative formula: C5H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017315842","spectrum_index":49302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indole-3-carbonitrile (delta mass: 154.0672 Da; putative annotation: N/A; putative formula: C6H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.118,"smiles":null,"spectrum_id":"CCMSLIB00017315843","spectrum_index":49303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 132.0532 Da; putative annotation: N/A; putative formula: C4H8N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.182,"smiles":null,"spectrum_id":"CCMSLIB00017315844","spectrum_index":49304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 215.152 Da; putative annotation: N/A; putative formula: C11H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.264,"smiles":null,"spectrum_id":"CCMSLIB00017315845","spectrum_index":49305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 126.9928 Da; putative annotation: N/A; putative formula: C3H2N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.126,"smiles":null,"spectrum_id":"CCMSLIB00017315846","spectrum_index":49306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aloesin (delta mass: 204.0674 Da; putative annotation: N/A; putative formula: C6H12N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.201,"smiles":null,"spectrum_id":"CCMSLIB00017315847","spectrum_index":49307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 18.0826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.216,"smiles":null,"spectrum_id":"CCMSLIB00017315848","spectrum_index":49308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 102.0799 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.37,"smiles":null,"spectrum_id":"CCMSLIB00017315849","spectrum_index":49309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 137.084 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.197,"smiles":null,"spectrum_id":"CCMSLIB00017315850","spectrum_index":49310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 102.0678 Da; putative annotation: N/A; putative formula: C5H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.232,"smiles":null,"spectrum_id":"CCMSLIB00017315851","spectrum_index":49311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 168.0488 Da; putative annotation: N/A; putative formula: C12H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.202,"smiles":null,"spectrum_id":"CCMSLIB00017315852","spectrum_index":49312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(3-(5-isopropyl-1H-1,2,4-triazol-3-yl)phenyl)-4-methylpentanamide (delta mass: 18.0038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.359,"smiles":null,"spectrum_id":"CCMSLIB00017315853","spectrum_index":49313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Armepavine (delta mass: 152.0185 Da; putative annotation: N/A; putative formula: C3H11N2O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.194,"smiles":null,"spectrum_id":"CCMSLIB00017315854","spectrum_index":49314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 420.3442 Da; putative annotation: N/A; putative formula: C27H50O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":751.498,"smiles":null,"spectrum_id":"CCMSLIB00017315855","spectrum_index":49315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 483.1956 Da; putative annotation: N/A; putative formula: C22H34N3O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.266,"smiles":null,"spectrum_id":"CCMSLIB00017315856","spectrum_index":49316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 49.9926 Da; putative annotation: N/A; putative formula: C2H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.089,"smiles":null,"spectrum_id":"CCMSLIB00017315857","spectrum_index":49317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 138.0299 Da; putative annotation: N/A; putative formula: CH7N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.168,"smiles":null,"spectrum_id":"CCMSLIB00017315858","spectrum_index":49318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 290.2531 Da; putative annotation: N/A; putative formula: C20H35O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":688.543,"smiles":null,"spectrum_id":"CCMSLIB00017315859","spectrum_index":49319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 86.0126 Da; putative annotation: N/A; putative formula: C2H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.056,"smiles":null,"spectrum_id":"CCMSLIB00017315860","spectrum_index":49320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 60.0546 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.229,"smiles":null,"spectrum_id":"CCMSLIB00017315861","spectrum_index":49321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 82.033 Da; putative annotation: N/A; putative formula: C5H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.159,"smiles":null,"spectrum_id":"CCMSLIB00017315862","spectrum_index":49322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5,5-Trimethyl-1-hexanol (delta mass: 130.005 Da; putative annotation: N/A; putative formula: C8H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.164,"smiles":null,"spectrum_id":"CCMSLIB00017315863","spectrum_index":49323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 18.1191 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.231,"smiles":null,"spectrum_id":"CCMSLIB00017315864","spectrum_index":49324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 238.0849 Da; putative annotation: N/A; putative formula: C13H18S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.13,"smiles":null,"spectrum_id":"CCMSLIB00017315865","spectrum_index":49325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 796.5097 Da; putative annotation: N/A; putative formula: C43H68N6O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":959.57,"smiles":null,"spectrum_id":"CCMSLIB00017315866","spectrum_index":49326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-3-pyridazinol (delta mass: 24.0241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.079,"smiles":null,"spectrum_id":"CCMSLIB00017315867","spectrum_index":49327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 173.0316 Da; putative annotation: N/A; putative formula: C6H7NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.118,"smiles":null,"spectrum_id":"CCMSLIB00017315868","spectrum_index":49328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 163.1627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.311,"smiles":null,"spectrum_id":"CCMSLIB00017315869","spectrum_index":49329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Phe (delta mass: 113.0844 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.213,"smiles":null,"spectrum_id":"CCMSLIB00017315870","spectrum_index":49330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 547.3684 Da; putative annotation: N/A; putative formula: C34H50N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.444,"smiles":null,"spectrum_id":"CCMSLIB00017315871","spectrum_index":49331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-(3S)-3-Hydroxyquinine (delta mass: 294.1001 Da; putative annotation: N/A; putative formula: C17H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.286,"smiles":null,"spectrum_id":"CCMSLIB00017315872","spectrum_index":49332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 67.0167 Da; putative annotation: N/A; putative formula: C2HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.066,"smiles":null,"spectrum_id":"CCMSLIB00017315873","spectrum_index":49333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 18.0849 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.26,"smiles":null,"spectrum_id":"CCMSLIB00017315874","spectrum_index":49334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 325.855 Da; putative annotation: N/A; putative formula: C10H2N2O-1S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.941,"smiles":null,"spectrum_id":"CCMSLIB00017315875","spectrum_index":49335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 386.2781 Da; putative annotation: N/A; putative formula: C20H38N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.343,"smiles":null,"spectrum_id":"CCMSLIB00017315876","spectrum_index":49336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001048999-01!1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole\"\" (delta mass: 30.0093 Da; putative annotation: N/A; putative formula: CH2O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.117,"smiles":null,"spectrum_id":"CCMSLIB00017315877","spectrum_index":49337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 221.4028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.5,"smiles":null,"spectrum_id":"CCMSLIB00017315878","spectrum_index":49338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 158.0589 Da; putative annotation: N/A; putative formula: C8H14O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.218,"smiles":null,"spectrum_id":"CCMSLIB00017315879","spectrum_index":49339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 152.0462 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.132,"smiles":null,"spectrum_id":"CCMSLIB00017315880","spectrum_index":49340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 30.0099 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.148,"smiles":null,"spectrum_id":"CCMSLIB00017315881","spectrum_index":49341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 95.0373 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017315882","spectrum_index":49342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 653.205 Da; putative annotation: N/A; putative formula: C25H35N9O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.266,"smiles":null,"spectrum_id":"CCMSLIB00017315883","spectrum_index":49343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-pyrrolo[2,3-c]pyridin-5-yl- (delta mass: 32.0345 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.132,"smiles":null,"spectrum_id":"CCMSLIB00017315884","spectrum_index":49344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 74.1162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.243,"smiles":null,"spectrum_id":"CCMSLIB00017315885","spectrum_index":49345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 44.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017315886","spectrum_index":49346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 235.1422 Da; putative annotation: N/A; putative formula: C10H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.296,"smiles":null,"spectrum_id":"CCMSLIB00017315887","spectrum_index":49347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 255.2209 Da; putative annotation: N/A; putative formula: C15H29NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.323,"smiles":null,"spectrum_id":"CCMSLIB00017315888","spectrum_index":49348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 89.0471 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.107,"smiles":null,"spectrum_id":"CCMSLIB00017315889","spectrum_index":49349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 273.1077 Da; putative annotation: N/A; putative formula: C9H15N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.261,"smiles":null,"spectrum_id":"CCMSLIB00017315890","spectrum_index":49350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 192.0269 Da; putative annotation: N/A; putative formula: C6H8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.207,"smiles":null,"spectrum_id":"CCMSLIB00017315891","spectrum_index":49351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 684.212 Da; putative annotation: N/A; putative formula: C51H29N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":880.288,"smiles":null,"spectrum_id":"CCMSLIB00017315892","spectrum_index":49352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 207.021 Da; putative annotation: N/A; putative formula: C7H13NS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.108,"smiles":null,"spectrum_id":"CCMSLIB00017315893","spectrum_index":49353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:102040\"\" (delta mass: 59.0159 Da; putative annotation: N/A; putative formula: C5HNO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.113,"smiles":null,"spectrum_id":"CCMSLIB00017315894","spectrum_index":49354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Thr (delta mass: 358.2543 Da; putative annotation: N/A; putative formula: C20H38O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.347,"smiles":null,"spectrum_id":"CCMSLIB00017315895","spectrum_index":49355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 36.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.18,"smiles":null,"spectrum_id":"CCMSLIB00017315896","spectrum_index":49356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 88.0677 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.138,"smiles":null,"spectrum_id":"CCMSLIB00017315897","spectrum_index":49357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 393.1786 Da; putative annotation: N/A; putative formula: C20H27NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.291,"smiles":null,"spectrum_id":"CCMSLIB00017315898","spectrum_index":49358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 501.2933 Da; putative annotation: N/A; putative formula: C25H43NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.353,"smiles":null,"spectrum_id":"CCMSLIB00017315899","spectrum_index":49359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 541.1798 Da; putative annotation: N/A; putative formula: C19H28N9O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.24,"smiles":null,"spectrum_id":"CCMSLIB00017315900","spectrum_index":49360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 373.174 Da; putative annotation: N/A; putative formula: C20H28N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.328,"smiles":null,"spectrum_id":"CCMSLIB00017315901","spectrum_index":49361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 46.0058 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.077,"smiles":null,"spectrum_id":"CCMSLIB00017315902","spectrum_index":49362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 204.2087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.268,"smiles":null,"spectrum_id":"CCMSLIB00017315903","spectrum_index":49363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Pyridinyl)ethanol (delta mass: 38.9996 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.075,"smiles":null,"spectrum_id":"CCMSLIB00017315904","spectrum_index":49364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline [M+H-H2O]+; AIF; CE10; MS2Dec (delta mass: 154.0991 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.196,"smiles":null,"spectrum_id":"CCMSLIB00017315905","spectrum_index":49365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 284.146 Da; putative annotation: N/A; putative formula: C16H20N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.3,"smiles":null,"spectrum_id":"CCMSLIB00017315906","spectrum_index":49366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 259.0948 Da; putative annotation: N/A; putative formula: C15H18NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.192,"smiles":null,"spectrum_id":"CCMSLIB00017315907","spectrum_index":49367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 346.1281 Da; putative annotation: N/A; putative formula: C17H30O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.24,"smiles":null,"spectrum_id":"CCMSLIB00017315908","spectrum_index":49368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 55.027 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.087,"smiles":null,"spectrum_id":"CCMSLIB00017315909","spectrum_index":49369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 158.0843 Da; putative annotation: N/A; putative formula: C10H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.212,"smiles":null,"spectrum_id":"CCMSLIB00017315910","spectrum_index":49370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 207.1018 Da; putative annotation: N/A; putative formula: C8H18NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.188,"smiles":null,"spectrum_id":"CCMSLIB00017315911","spectrum_index":49371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 327.0869 Da; putative annotation: N/A; putative formula: C17H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.2,"smiles":null,"spectrum_id":"CCMSLIB00017315912","spectrum_index":49372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 389.2752 Da; putative annotation: N/A; putative formula: C24H39NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.388,"smiles":null,"spectrum_id":"CCMSLIB00017315913","spectrum_index":49373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 125.1067 Da; putative annotation: N/A; putative formula: C5H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.245,"smiles":null,"spectrum_id":"CCMSLIB00017315914","spectrum_index":49374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 158.1101 Da; putative annotation: N/A; putative formula: C12H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.191,"smiles":null,"spectrum_id":"CCMSLIB00017315915","spectrum_index":49375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-(methylsulfanyl)-1H-indole-2-carboxylate (delta mass: 121.0925 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.151,"smiles":null,"spectrum_id":"CCMSLIB00017315916","spectrum_index":49376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 115.0684 Da; putative annotation: N/A; putative formula: C4H10N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.248,"smiles":null,"spectrum_id":"CCMSLIB00017315917","spectrum_index":49377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-dimethoxy-5-oxo-6,7,8,13b-tetrahydroisoindolino[1,2-a]beta-carboline-7-car boxylic acid CollisionEnergy:102040\"\" (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.155,"smiles":null,"spectrum_id":"CCMSLIB00017315918","spectrum_index":49378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 173.9909 Da; putative annotation: N/A; putative formula: C4H2N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.088,"smiles":null,"spectrum_id":"CCMSLIB00017315919","spectrum_index":49379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 214.1256 Da; putative annotation: N/A; putative formula: C9H18N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.17,"smiles":null,"spectrum_id":"CCMSLIB00017315920","spectrum_index":49380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 200.157 Da; putative annotation: N/A; putative formula: C15H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.217,"smiles":null,"spectrum_id":"CCMSLIB00017315921","spectrum_index":49381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 135.0321 Da; putative annotation: N/A; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.103,"smiles":null,"spectrum_id":"CCMSLIB00017315922","spectrum_index":49382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 42.9363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.116,"smiles":null,"spectrum_id":"CCMSLIB00017315923","spectrum_index":49383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 41.063 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.139,"smiles":null,"spectrum_id":"CCMSLIB00017315924","spectrum_index":49384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 65.0609 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.2,"smiles":null,"spectrum_id":"CCMSLIB00017315925","spectrum_index":49385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 245.0947 Da; putative annotation: N/A; putative formula: C8H15N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.186,"smiles":null,"spectrum_id":"CCMSLIB00017315926","spectrum_index":49386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 369.106 Da; putative annotation: N/A; putative formula: C16H19NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":594.218,"smiles":null,"spectrum_id":"CCMSLIB00017315927","spectrum_index":49387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 146.0732 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.197,"smiles":null,"spectrum_id":"CCMSLIB00017315928","spectrum_index":49388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 110.0811 Da; putative annotation: N/A; putative formula: C6H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.204,"smiles":null,"spectrum_id":"CCMSLIB00017315929","spectrum_index":49389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-hydroxybenzo(a)pyrene (delta mass: 23.0186 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.115,"smiles":null,"spectrum_id":"CCMSLIB00017315930","spectrum_index":49390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 134.1085 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.346,"smiles":null,"spectrum_id":"CCMSLIB00017315931","spectrum_index":49391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 169.112 Da; putative annotation: N/A; putative formula: C8H16N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.183,"smiles":null,"spectrum_id":"CCMSLIB00017315932","spectrum_index":49392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 300.1724 Da; putative annotation: N/A; putative formula: C19H24O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.243,"smiles":null,"spectrum_id":"CCMSLIB00017315933","spectrum_index":49393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-2-phenylethylamine (delta mass: 78.175 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.282,"smiles":null,"spectrum_id":"CCMSLIB00017315934","spectrum_index":49394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 69.0582 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017315935","spectrum_index":49395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 144.0419 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.122,"smiles":null,"spectrum_id":"CCMSLIB00017315936","spectrum_index":49396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 31.0279 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.229,"smiles":null,"spectrum_id":"CCMSLIB00017315937","spectrum_index":49397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS000860012-01! (delta mass: 130.0349 Da; putative annotation: N/A; putative formula: H2N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.187,"smiles":null,"spectrum_id":"CCMSLIB00017315938","spectrum_index":49398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(benzimidazol-2-ylthiomethyl)-4-methoxybenzaldehyde CollisionEnergy:102040 (delta mass: 167.1204 Da; putative annotation: N/A; putative formula: C10H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.205,"smiles":null,"spectrum_id":"CCMSLIB00017315939","spectrum_index":49399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 143.0584 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.182,"smiles":null,"spectrum_id":"CCMSLIB00017315940","spectrum_index":49400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyluridine (delta mass: 66.0189 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.111,"smiles":null,"spectrum_id":"CCMSLIB00017315941","spectrum_index":49401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 158.0733 Da; putative annotation: 7-Methyl-2,3-dihydro-1H-indene-4-carboxylic acid; putative formula: C11H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017315942","spectrum_index":49402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 339.2408 Da; putative annotation: Glu-C14:0; putative formula: C19H33NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.344,"smiles":null,"spectrum_id":"CCMSLIB00017315943","spectrum_index":49403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 850.4342 Da; putative annotation: Ruscin; putative formula: C44H66O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1043.5,"smiles":null,"spectrum_id":"CCMSLIB00017315944","spectrum_index":49404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 129.0794 Da; putative annotation: 4-Hydroxy-L-isoleucine; putative formula: C6H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.166,"smiles":null,"spectrum_id":"CCMSLIB00017315945","spectrum_index":49405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 140.0588 Da; putative annotation: (3-Oxo-2-piperazinyl)acetic acid; putative formula: C6H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.156,"smiles":null,"spectrum_id":"CCMSLIB00017315946","spectrum_index":49406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 293.0892 Da; putative annotation: [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate; putative formula: C14H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.213,"smiles":null,"spectrum_id":"CCMSLIB00017315947","spectrum_index":49407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (delta mass: 91.0442 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.177,"smiles":null,"spectrum_id":"CCMSLIB00017315948","spectrum_index":49408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 136.0529 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.139,"smiles":null,"spectrum_id":"CCMSLIB00017315949","spectrum_index":49409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 74.0204 Da; putative annotation: N/A; putative formula: C3H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.174,"smiles":null,"spectrum_id":"CCMSLIB00017315950","spectrum_index":49410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 145.0373 Da; putative annotation: N/A; putative formula: C5H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.134,"smiles":null,"spectrum_id":"CCMSLIB00017315951","spectrum_index":49411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 60.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.179,"smiles":null,"spectrum_id":"CCMSLIB00017315952","spectrum_index":49412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 8.7832 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.901,"smiles":null,"spectrum_id":"CCMSLIB00017315953","spectrum_index":49413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 63.0321 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.217,"smiles":null,"spectrum_id":"CCMSLIB00017315954","spectrum_index":49414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 139.0638 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.129,"smiles":null,"spectrum_id":"CCMSLIB00017315955","spectrum_index":49415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 90.047 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.17,"smiles":null,"spectrum_id":"CCMSLIB00017315956","spectrum_index":49416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydrocarbamazepine (delta mass: 58.0521 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.17,"smiles":null,"spectrum_id":"CCMSLIB00017315957","spectrum_index":49417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 161.0146 Da; putative annotation: N/A; putative formula: C5H7NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.069,"smiles":null,"spectrum_id":"CCMSLIB00017315958","spectrum_index":49418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 721.2933 Da; putative annotation: N/A; putative formula: C32H39N11O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":928.38,"smiles":null,"spectrum_id":"CCMSLIB00017315959","spectrum_index":49419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 679.2997 Da; putative annotation: N/A; putative formula: C29H51N3O11P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.386,"smiles":null,"spectrum_id":"CCMSLIB00017315960","spectrum_index":49420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 704.3762 Da; putative annotation: N/A; putative formula: C32H57N4O11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.463,"smiles":null,"spectrum_id":"CCMSLIB00017315961","spectrum_index":49421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 146.8944 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.921,"smiles":null,"spectrum_id":"CCMSLIB00017315962","spectrum_index":49422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1072.5784 Da; putative annotation: N/A; putative formula: C63H76N8O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1415.7,"smiles":null,"spectrum_id":"CCMSLIB00017315963","spectrum_index":49423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1207.7935 Da; putative annotation: N/A; putative formula: C63H105N11O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1429.89,"smiles":null,"spectrum_id":"CCMSLIB00017315964","spectrum_index":49424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 104.0076 Da; putative annotation: N/A; putative formula: C7H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.053,"smiles":null,"spectrum_id":"CCMSLIB00017315965","spectrum_index":49425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 177.0463 Da; putative annotation: N/A; putative formula: C6H11NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.109,"smiles":null,"spectrum_id":"CCMSLIB00017315966","spectrum_index":49426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 242.1228 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.203,"smiles":null,"spectrum_id":"CCMSLIB00017315967","spectrum_index":49427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 209.026 Da; putative annotation: N/A; putative formula: C8H7N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.149,"smiles":null,"spectrum_id":"CCMSLIB00017315968","spectrum_index":49428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Val-Phe (delta mass: 129.0406 Da; putative annotation: N/A; putative formula: CH3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.238,"smiles":null,"spectrum_id":"CCMSLIB00017315969","spectrum_index":49429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 59.0025 Da; putative annotation: N/A; putative formula: H2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.105,"smiles":null,"spectrum_id":"CCMSLIB00017315970","spectrum_index":49430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 6.9413 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.085,"smiles":null,"spectrum_id":"CCMSLIB00017315971","spectrum_index":49431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 53.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.244,"smiles":null,"spectrum_id":"CCMSLIB00017315972","spectrum_index":49432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 124.0494 Da; putative annotation: N/A; putative formula: C3H4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.151,"smiles":null,"spectrum_id":"CCMSLIB00017315973","spectrum_index":49433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 304.0904 Da; putative annotation: N/A; putative formula: C11H16N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.177,"smiles":null,"spectrum_id":"CCMSLIB00017315974","spectrum_index":49434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]propanamide (delta mass: 143.0939 Da; putative annotation: N/A; putative formula: C7H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.238,"smiles":null,"spectrum_id":"CCMSLIB00017315975","spectrum_index":49435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 278.1069 Da; putative annotation: N/A; putative formula: C15H19O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.204,"smiles":null,"spectrum_id":"CCMSLIB00017315976","spectrum_index":49436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380084-01_C21H30O4_Benzo[b]cyclopenta[e]pyran-8(3H)-one, 3a,5,6,7,9,9a-hexahydro-7-hydroxy-1-[(4E)-6-hydroxy-1,5-dimethyl-4-hexen-1-yl]-3a-methyl- (delta mass: 262.2263 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.448,"smiles":null,"spectrum_id":"CCMSLIB00017315977","spectrum_index":49437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 87.0322 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017315978","spectrum_index":49438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of _130142 (delta mass: 718.3871 Da; putative annotation: N/A; putative formula: C46H54O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1074.5,"smiles":null,"spectrum_id":"CCMSLIB00017315979","spectrum_index":49439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 13.0005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.18,"smiles":null,"spectrum_id":"CCMSLIB00017315980","spectrum_index":49440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 112.0523 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.197,"smiles":null,"spectrum_id":"CCMSLIB00017315981","spectrum_index":49441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 216.0633 Da; putative annotation: N/A; putative formula: C9H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.15,"smiles":null,"spectrum_id":"CCMSLIB00017315982","spectrum_index":49442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 300.1182 Da; putative annotation: N/A; putative formula: C10H16N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.183,"smiles":null,"spectrum_id":"CCMSLIB00017315983","spectrum_index":49443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 95.0376 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.124,"smiles":null,"spectrum_id":"CCMSLIB00017315984","spectrum_index":49444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 55.0319 Da; putative annotation: N/A; putative formula: HN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.092,"smiles":null,"spectrum_id":"CCMSLIB00017315985","spectrum_index":49445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 12.0111 Da; putative annotation: N/A; putative formula: N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.098,"smiles":null,"spectrum_id":"CCMSLIB00017315986","spectrum_index":49446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 173.084 Da; putative annotation: N/A; putative formula: C11H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.222,"smiles":null,"spectrum_id":"CCMSLIB00017315987","spectrum_index":49447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 389.157 Da; putative annotation: N/A; putative formula: C31H19NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.243,"smiles":null,"spectrum_id":"CCMSLIB00017315988","spectrum_index":49448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gln (delta mass: 171.0901 Da; putative annotation: N/A; putative formula: C8H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.209,"smiles":null,"spectrum_id":"CCMSLIB00017315989","spectrum_index":49449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 152.0546 Da; putative annotation: N/A; putative formula: C2H8N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.224,"smiles":null,"spectrum_id":"CCMSLIB00017315990","spectrum_index":49450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 85.0567 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017315991","spectrum_index":49451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 18.011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.108,"smiles":null,"spectrum_id":"CCMSLIB00017315992","spectrum_index":49452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 128.0483 Da; putative annotation: N/A; putative formula: C7H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.145,"smiles":null,"spectrum_id":"CCMSLIB00017315993","spectrum_index":49453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 225.0847 Da; putative annotation: N/A; putative formula: C7H15NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.15,"smiles":null,"spectrum_id":"CCMSLIB00017315994","spectrum_index":49454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 138.0837 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.134,"smiles":null,"spectrum_id":"CCMSLIB00017315995","spectrum_index":49455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 88.1001 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.265,"smiles":null,"spectrum_id":"CCMSLIB00017315996","spectrum_index":49456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 26.015 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.112,"smiles":null,"spectrum_id":"CCMSLIB00017315997","spectrum_index":49457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-indol-3-yl)ethanamine (delta mass: 14.9527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.06,"smiles":null,"spectrum_id":"CCMSLIB00017315998","spectrum_index":49458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 151.1365 Da; putative annotation: N/A; putative formula: C10H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.238,"smiles":null,"spectrum_id":"CCMSLIB00017315999","spectrum_index":49459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 193.0737 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.118,"smiles":null,"spectrum_id":"CCMSLIB00017316000","spectrum_index":49460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 64.0152 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.101,"smiles":null,"spectrum_id":"CCMSLIB00017316001","spectrum_index":49461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 164.0111 Da; putative annotation: N/A; putative formula: C8H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.071,"smiles":null,"spectrum_id":"CCMSLIB00017316002","spectrum_index":49462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 111.1049 Da; putative annotation: N/A; putative formula: C7H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.217,"smiles":null,"spectrum_id":"CCMSLIB00017316003","spectrum_index":49463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 217.9861 Da; putative annotation: N/A; putative formula: C11H6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.057,"smiles":null,"spectrum_id":"CCMSLIB00017316004","spectrum_index":49464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 54.0122 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.072,"smiles":null,"spectrum_id":"CCMSLIB00017316005","spectrum_index":49465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 28.9566 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.074,"smiles":null,"spectrum_id":"CCMSLIB00017316006","spectrum_index":49466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 41.0498 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.141,"smiles":null,"spectrum_id":"CCMSLIB00017316007","spectrum_index":49467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU244306 2-Amino-9H-pyrido[2,3-b]indole (AalphaC)|2-Amino-9H-pyrido[2,3-b]indole|9H-pyrido[2,3-b]indol-2-amine (delta mass: 617.5832 Da; putative annotation: N/A; putative formula: C39H75N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.67,"smiles":null,"spectrum_id":"CCMSLIB00017316008","spectrum_index":49468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 89.0483 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.129,"smiles":null,"spectrum_id":"CCMSLIB00017316009","spectrum_index":49469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 161.1417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.254,"smiles":null,"spectrum_id":"CCMSLIB00017316010","spectrum_index":49470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 227.1164 Da; putative annotation: N/A; putative formula: C12H21NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.192,"smiles":null,"spectrum_id":"CCMSLIB00017316011","spectrum_index":49471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 146.0843 Da; putative annotation: N/A; putative formula: C9H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.223,"smiles":null,"spectrum_id":"CCMSLIB00017316012","spectrum_index":49472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 176.0581 Da; putative annotation: N/A; putative formula: C9H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.144,"smiles":null,"spectrum_id":"CCMSLIB00017316013","spectrum_index":49473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 260.2141 Da; putative annotation: N/A; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.374,"smiles":null,"spectrum_id":"CCMSLIB00017316014","spectrum_index":49474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 36.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.092,"smiles":null,"spectrum_id":"CCMSLIB00017316015","spectrum_index":49475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 517.3391 Da; putative annotation: N/A; putative formula: C34H49NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.463,"smiles":null,"spectrum_id":"CCMSLIB00017316016","spectrum_index":49476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 216.1223 Da; putative annotation: N/A; putative formula: C8H16N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.224,"smiles":null,"spectrum_id":"CCMSLIB00017316017","spectrum_index":49477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 175.0489 Da; putative annotation: N/A; putative formula: C7H13NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.203,"smiles":null,"spectrum_id":"CCMSLIB00017316018","spectrum_index":49478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 63.3249 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.5,"smiles":null,"spectrum_id":"CCMSLIB00017316019","spectrum_index":49479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 56.0446 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.072,"smiles":null,"spectrum_id":"CCMSLIB00017316020","spectrum_index":49480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 176.0382 Da; putative annotation: N/A; putative formula: C12H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.177,"smiles":null,"spectrum_id":"CCMSLIB00017316021","spectrum_index":49481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of uridine CollisionEnergy:102040 (delta mass: 196.0384 Da; putative annotation: N/A; putative formula: C10H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.115,"smiles":null,"spectrum_id":"CCMSLIB00017316022","spectrum_index":49482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 198.2084 Da; putative annotation: N/A; putative formula: C12H26N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.29,"smiles":null,"spectrum_id":"CCMSLIB00017316023","spectrum_index":49483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 64.0149 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.075,"smiles":null,"spectrum_id":"CCMSLIB00017316024","spectrum_index":49484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 84.0207 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.112,"smiles":null,"spectrum_id":"CCMSLIB00017316025","spectrum_index":49485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 289.1168 Da; putative annotation: N/A; putative formula: C13H23NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.188,"smiles":null,"spectrum_id":"CCMSLIB00017316026","spectrum_index":49486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 154.9794 Da; putative annotation: N/A; putative formula: C4HN3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.034,"smiles":null,"spectrum_id":"CCMSLIB00017316027","spectrum_index":49487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 68.1927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.263,"smiles":null,"spectrum_id":"CCMSLIB00017316028","spectrum_index":49488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 221.0591 Da; putative annotation: N/A; putative formula: C13H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.199,"smiles":null,"spectrum_id":"CCMSLIB00017316029","spectrum_index":49489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 153.03 Da; putative annotation: N/A; putative formula: C2H8N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.179,"smiles":null,"spectrum_id":"CCMSLIB00017316030","spectrum_index":49490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 57.0299 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.1,"smiles":null,"spectrum_id":"CCMSLIB00017316031","spectrum_index":49491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hernagine (delta mass: 15.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.181,"smiles":null,"spectrum_id":"CCMSLIB00017316032","spectrum_index":49492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 78.0833 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.258,"smiles":null,"spectrum_id":"CCMSLIB00017316033","spectrum_index":49493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 513.1997 Da; putative annotation: N/A; putative formula: C27H31NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.312,"smiles":null,"spectrum_id":"CCMSLIB00017316034","spectrum_index":49494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 35.0466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.144,"smiles":null,"spectrum_id":"CCMSLIB00017316035","spectrum_index":49495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 510.379 Da; putative annotation: N/A; putative formula: C28H46N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.439,"smiles":null,"spectrum_id":"CCMSLIB00017316036","spectrum_index":49496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-.beta.-carboline (delta mass: 40.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.165,"smiles":null,"spectrum_id":"CCMSLIB00017316037","spectrum_index":49497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 76.0313 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.258,"smiles":null,"spectrum_id":"CCMSLIB00017316038","spectrum_index":49498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-carbinol CollisionEnergy:205060 (delta mass: 165.2453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.321,"smiles":null,"spectrum_id":"CCMSLIB00017316039","spectrum_index":49499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxyadenosine; LC-tDDA; CE20 (delta mass: 80.0359 Da; putative annotation: N/A; putative formula: C4H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.145,"smiles":null,"spectrum_id":"CCMSLIB00017316040","spectrum_index":49500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoroindole-2-carboxylic acid (delta mass: 131.0028 Da; putative annotation: N/A; putative formula: C6H2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.048,"smiles":null,"spectrum_id":"CCMSLIB00017316041","spectrum_index":49501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 245.0281 Da; putative annotation: N/A; putative formula: C7H7N3O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.14,"smiles":null,"spectrum_id":"CCMSLIB00017316042","spectrum_index":49502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 115.0992 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.175,"smiles":null,"spectrum_id":"CCMSLIB00017316043","spectrum_index":49503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 133.0739 Da; putative annotation: N/A; putative formula: C5H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.16,"smiles":null,"spectrum_id":"CCMSLIB00017316044","spectrum_index":49504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 140.0464 Da; putative annotation: N/A; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.117,"smiles":null,"spectrum_id":"CCMSLIB00017316045","spectrum_index":49505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 131.0233 Da; putative annotation: N/A; putative formula: C5HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.125,"smiles":null,"spectrum_id":"CCMSLIB00017316046","spectrum_index":49506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 43.9851 Da; putative annotation: N/A; putative formula: N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.052,"smiles":null,"spectrum_id":"CCMSLIB00017316047","spectrum_index":49507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 198.1257 Da; putative annotation: N/A; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.179,"smiles":null,"spectrum_id":"CCMSLIB00017316048","spectrum_index":49508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 80.0515 Da; putative annotation: N/A; putative formula: C3H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.149,"smiles":null,"spectrum_id":"CCMSLIB00017316049","spectrum_index":49509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levallorphan (delta mass: 204.056 Da; putative annotation: N/A; putative formula: C9H17O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.257,"smiles":null,"spectrum_id":"CCMSLIB00017316050","spectrum_index":49510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.097,"smiles":null,"spectrum_id":"CCMSLIB00017316051","spectrum_index":49511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 128.0666 Da; putative annotation: N/A; putative formula: H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.153,"smiles":null,"spectrum_id":"CCMSLIB00017316052","spectrum_index":49512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 36.0366 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.185,"smiles":null,"spectrum_id":"CCMSLIB00017316053","spectrum_index":49513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 214.8867 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017316054","spectrum_index":49514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 814.8786 Da; putative annotation: N/A; putative formula: C57H115O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1036.98,"smiles":null,"spectrum_id":"CCMSLIB00017316055","spectrum_index":49515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.112,"smiles":null,"spectrum_id":"CCMSLIB00017316056","spectrum_index":49516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 144.0898 Da; putative annotation: N/A; putative formula: C6H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.228,"smiles":null,"spectrum_id":"CCMSLIB00017316057","spectrum_index":49517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 172.1676 Da; putative annotation: N/A; putative formula: C8H20N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.254,"smiles":null,"spectrum_id":"CCMSLIB00017316058","spectrum_index":49518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 309.1066 Da; putative annotation: N/A; putative formula: C14H20N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.156,"smiles":null,"spectrum_id":"CCMSLIB00017316059","spectrum_index":49519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 371.1216 Da; putative annotation: N/A; putative formula: C16H21NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.286,"smiles":null,"spectrum_id":"CCMSLIB00017316060","spectrum_index":49520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 240.1471 Da; putative annotation: N/A; putative formula: C12H20N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.287,"smiles":null,"spectrum_id":"CCMSLIB00017316061","spectrum_index":49521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxypyridine-2-methanol (delta mass: 28.005 Da; putative annotation: N/A; putative formula: N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.06,"smiles":null,"spectrum_id":"CCMSLIB00017316062","spectrum_index":49522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 51.0037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.142,"smiles":null,"spectrum_id":"CCMSLIB00017316063","spectrum_index":49523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 154.1114 Da; putative annotation: N/A; putative formula: C8H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.208,"smiles":null,"spectrum_id":"CCMSLIB00017316064","spectrum_index":49524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 46.0748 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.123,"smiles":null,"spectrum_id":"CCMSLIB00017316065","spectrum_index":49525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Ile (delta mass: 71.0373 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.198,"smiles":null,"spectrum_id":"CCMSLIB00017316066","spectrum_index":49526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 86.0225 Da; putative annotation: N/A; putative formula: CH2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.14,"smiles":null,"spectrum_id":"CCMSLIB00017316067","spectrum_index":49527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 105.006 Da; putative annotation: N/A; putative formula: C2H3NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.108,"smiles":null,"spectrum_id":"CCMSLIB00017316068","spectrum_index":49528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 265.131 Da; putative annotation: N/A; putative formula: C14H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.207,"smiles":null,"spectrum_id":"CCMSLIB00017316069","spectrum_index":49529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 260.1424 Da; putative annotation: N/A; putative formula: C17H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.18,"smiles":null,"spectrum_id":"CCMSLIB00017316070","spectrum_index":49530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 311.3194 Da; putative annotation: N/A; putative formula: C20H41NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.505,"smiles":null,"spectrum_id":"CCMSLIB00017316071","spectrum_index":49531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 456.05 Da; putative annotation: N/A; putative formula: C27H20O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.209,"smiles":null,"spectrum_id":"CCMSLIB00017316072","spectrum_index":49532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-hydroxypyrene (delta mass: 41.0585 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.139,"smiles":null,"spectrum_id":"CCMSLIB00017316073","spectrum_index":49533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 44.9633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.086,"smiles":null,"spectrum_id":"CCMSLIB00017316074","spectrum_index":49534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 106.0786 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017316075","spectrum_index":49535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 67.0788 Da; putative annotation: N/A; putative formula: C5H9NO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.144,"smiles":null,"spectrum_id":"CCMSLIB00017316076","spectrum_index":49536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-methyl-2-aminoindane (delta mass: 60.0273 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.139,"smiles":null,"spectrum_id":"CCMSLIB00017316077","spectrum_index":49537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 142.9435 Da; putative annotation: N/A; putative formula: H2NO4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.067,"smiles":null,"spectrum_id":"CCMSLIB00017316078","spectrum_index":49538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimifugin (delta mass: 68.063 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.181,"smiles":null,"spectrum_id":"CCMSLIB00017316079","spectrum_index":49539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 78.0384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.209,"smiles":null,"spectrum_id":"CCMSLIB00017316080","spectrum_index":49540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 205.0732 Da; putative annotation: N/A; putative formula: C5H12N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.17,"smiles":null,"spectrum_id":"CCMSLIB00017316081","spectrum_index":49541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Pro (delta mass: 99.0689 Da; putative annotation: Spectral Match to valine from NIST14-note this is the rearranged loss of ammonia to form a proline see parent mass; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.224,"smiles":null,"spectrum_id":"CCMSLIB00017316082","spectrum_index":49542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 152.0106 Da; putative annotation: Phloroglucinolcarboxylic acid; putative formula: C7H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.076,"smiles":null,"spectrum_id":"CCMSLIB00017316083","spectrum_index":49543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Ile (delta mass: 214.1324 Da; putative annotation: Ile-Thr; putative formula: C10H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.282,"smiles":null,"spectrum_id":"CCMSLIB00017316084","spectrum_index":49544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 131.0399 Da; putative annotation: Massbank:CE000448 Methionine; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.1,"smiles":null,"spectrum_id":"CCMSLIB00017316085","spectrum_index":49545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 286.2308 Da; putative annotation: Drostanolone; putative formula: C20H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.322,"smiles":null,"spectrum_id":"CCMSLIB00017316086","spectrum_index":49546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 276.0811 Da; putative annotation: (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one; putative formula: C11H16O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.141,"smiles":null,"spectrum_id":"CCMSLIB00017316087","spectrum_index":49547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 60.0209 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.122,"smiles":null,"spectrum_id":"CCMSLIB00017316088","spectrum_index":49548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 110.0362 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.122,"smiles":null,"spectrum_id":"CCMSLIB00017316089","spectrum_index":49549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(2-methoxybenzyl)ethanamine (delta mass: 90.0519 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.196,"smiles":null,"spectrum_id":"CCMSLIB00017316090","spectrum_index":49550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 52.9902 Da; putative annotation: N/A; putative formula: C2H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.103,"smiles":null,"spectrum_id":"CCMSLIB00017316091","spectrum_index":49551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 236.109 Da; putative annotation: N/A; putative formula: C3H12N10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.197,"smiles":null,"spectrum_id":"CCMSLIB00017316092","spectrum_index":49552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 78.082 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.356,"smiles":null,"spectrum_id":"CCMSLIB00017316093","spectrum_index":49553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 84.0169 Da; putative annotation: N/A; putative formula: N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.244,"smiles":null,"spectrum_id":"CCMSLIB00017316094","spectrum_index":49554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 88.9976 Da; putative annotation: N/A; putative formula: C2H5NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.115,"smiles":null,"spectrum_id":"CCMSLIB00017316095","spectrum_index":49555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 320.365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.534,"smiles":null,"spectrum_id":"CCMSLIB00017316096","spectrum_index":49556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 296.1792 Da; putative annotation: N/A; putative formula: C13H24N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.276,"smiles":null,"spectrum_id":"CCMSLIB00017316097","spectrum_index":49557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 848.4918 Da; putative annotation: N/A; putative formula: C59H64N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1175.62,"smiles":null,"spectrum_id":"CCMSLIB00017316098","spectrum_index":49558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C9:0 (delta mass: 141.1478 Da; putative annotation: N/A; putative formula: C9H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.375,"smiles":null,"spectrum_id":"CCMSLIB00017316099","spectrum_index":49559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 115.0315 Da; putative annotation: N/A; putative formula: C2H5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.144,"smiles":null,"spectrum_id":"CCMSLIB00017316100","spectrum_index":49560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxylic acid (delta mass: 279.0195 Da; putative annotation: N/A; putative formula: C6H10N5O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.074,"smiles":null,"spectrum_id":"CCMSLIB00017316101","spectrum_index":49561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.155,"smiles":null,"spectrum_id":"CCMSLIB00017316102","spectrum_index":49562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 67.0431 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.119,"smiles":null,"spectrum_id":"CCMSLIB00017316103","spectrum_index":49563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 609.2271 Da; putative annotation: N/A; putative formula: C31H31N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.287,"smiles":null,"spectrum_id":"CCMSLIB00017316104","spectrum_index":49564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chanoclavine-I (delta mass: 92.0723 Da; putative annotation: N/A; putative formula: C6H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.237,"smiles":null,"spectrum_id":"CCMSLIB00017316105","spectrum_index":49565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 107.0371 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.124,"smiles":null,"spectrum_id":"CCMSLIB00017316106","spectrum_index":49566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 279.2544 Da; putative annotation: N/A; putative formula: C14H29N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.377,"smiles":null,"spectrum_id":"CCMSLIB00017316107","spectrum_index":49567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 60.036 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.326,"smiles":null,"spectrum_id":"CCMSLIB00017316108","spectrum_index":49568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 359.1843 Da; putative annotation: N/A; putative formula: C19H25N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.25,"smiles":null,"spectrum_id":"CCMSLIB00017316109","spectrum_index":49569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Lys (delta mass: 147.0687 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.261,"smiles":null,"spectrum_id":"CCMSLIB00017316110","spectrum_index":49570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 286.146 Da; putative annotation: N/A; putative formula: C14H19N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.28,"smiles":null,"spectrum_id":"CCMSLIB00017316111","spectrum_index":49571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 461.4227 Da; putative annotation: N/A; putative formula: C30H55NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.514,"smiles":null,"spectrum_id":"CCMSLIB00017316112","spectrum_index":49572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 204.1036 Da; putative annotation: N/A; putative formula: C8H17N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.263,"smiles":null,"spectrum_id":"CCMSLIB00017316113","spectrum_index":49573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 76.0465 Da; putative annotation: N/A; putative formula: C5H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.143,"smiles":null,"spectrum_id":"CCMSLIB00017316114","spectrum_index":49574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 448.1013 Da; putative annotation: N/A; putative formula: C22H24O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.177,"smiles":null,"spectrum_id":"CCMSLIB00017316115","spectrum_index":49575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 166.0759 Da; putative annotation: N/A; putative formula: C7H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.14,"smiles":null,"spectrum_id":"CCMSLIB00017316116","spectrum_index":49576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 62.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.237,"smiles":null,"spectrum_id":"CCMSLIB00017316117","spectrum_index":49577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 9.9846 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.139,"smiles":null,"spectrum_id":"CCMSLIB00017316118","spectrum_index":49578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 87.0315 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.181,"smiles":null,"spectrum_id":"CCMSLIB00017316119","spectrum_index":49579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 150.1257 Da; putative annotation: N/A; putative formula: C8H14N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017316120","spectrum_index":49580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 160.0931 Da; putative annotation: N/A; putative formula: C8H18O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.19,"smiles":null,"spectrum_id":"CCMSLIB00017316121","spectrum_index":49581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.165,"smiles":null,"spectrum_id":"CCMSLIB00017316122","spectrum_index":49582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 400.1241 Da; putative annotation: N/A; putative formula: C26H17N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.184,"smiles":null,"spectrum_id":"CCMSLIB00017316123","spectrum_index":49583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 72.0445 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.136,"smiles":null,"spectrum_id":"CCMSLIB00017316124","spectrum_index":49584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006102 Tyramine|4-(2-aminoethyl)phenol (delta mass: 81.0582 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.15,"smiles":null,"spectrum_id":"CCMSLIB00017316125","spectrum_index":49585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 224.1203 Da; putative annotation: N/A; putative formula: C16H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.196,"smiles":null,"spectrum_id":"CCMSLIB00017316126","spectrum_index":49586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 433.3855 Da; putative annotation: N/A; putative formula: C27H51N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.555,"smiles":null,"spectrum_id":"CCMSLIB00017316127","spectrum_index":49587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 101.0665 Da; putative annotation: N/A; putative formula: C5H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.242,"smiles":null,"spectrum_id":"CCMSLIB00017316128","spectrum_index":49588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 26.0287 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.099,"smiles":null,"spectrum_id":"CCMSLIB00017316129","spectrum_index":49589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 294.0852 Da; putative annotation: N/A; putative formula: C13H14N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.166,"smiles":null,"spectrum_id":"CCMSLIB00017316130","spectrum_index":49590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 422.2443 Da; putative annotation: N/A; putative formula: C21H43O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.341,"smiles":null,"spectrum_id":"CCMSLIB00017316131","spectrum_index":49591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 73.0329 Da; putative annotation: N/A; putative formula: C6H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.129,"smiles":null,"spectrum_id":"CCMSLIB00017316132","spectrum_index":49592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 60.0255 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.128,"smiles":null,"spectrum_id":"CCMSLIB00017316133","spectrum_index":49593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3aS,5S,11bR,E)-12-Ethylidene-1,2,3a,4,5,7-hexahydro-3,5-ethanopyrrolo[2,3-d]carbazole-6-carbaldehyde (delta mass: 82.0893 Da; putative annotation: N/A; putative formula: C5H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.254,"smiles":null,"spectrum_id":"CCMSLIB00017316134","spectrum_index":49594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 37.9696 Da; putative annotation: N/A; putative formula: C2H-1O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.018,"smiles":null,"spectrum_id":"CCMSLIB00017316135","spectrum_index":49595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 314.2736 Da; putative annotation: N/A; putative formula: C19H39OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":907.549,"smiles":null,"spectrum_id":"CCMSLIB00017316136","spectrum_index":49596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,5-Diamino-4-methylbenzoic acid (delta mass: 60.0 Da; putative annotation: N/A; putative formula: C5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.081,"smiles":null,"spectrum_id":"CCMSLIB00017316137","spectrum_index":49597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 120.0576 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.154,"smiles":null,"spectrum_id":"CCMSLIB00017316138","spectrum_index":49598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Benzo[g]indole (delta mass: 53.0293 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.11,"smiles":null,"spectrum_id":"CCMSLIB00017316139","spectrum_index":49599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 194.0534 Da; putative annotation: N/A; putative formula: C7H15O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.156,"smiles":null,"spectrum_id":"CCMSLIB00017316140","spectrum_index":49600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Atropine (delta mass: 111.0573 Da; putative annotation: N/A; putative formula: C3H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.232,"smiles":null,"spectrum_id":"CCMSLIB00017316141","spectrum_index":49601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 149.0477 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.145,"smiles":null,"spectrum_id":"CCMSLIB00017316142","spectrum_index":49602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 28.031 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.273,"smiles":null,"spectrum_id":"CCMSLIB00017316143","spectrum_index":49603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 156.1526 Da; putative annotation: N/A; putative formula: C10H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.28,"smiles":null,"spectrum_id":"CCMSLIB00017316144","spectrum_index":49604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 30.0675 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.165,"smiles":null,"spectrum_id":"CCMSLIB00017316145","spectrum_index":49605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 141.0785 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.165,"smiles":null,"spectrum_id":"CCMSLIB00017316146","spectrum_index":49606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 208.1834 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.259,"smiles":null,"spectrum_id":"CCMSLIB00017316147","spectrum_index":49607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 350.0262 Da; putative annotation: N/A; putative formula: C20H6N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.15,"smiles":null,"spectrum_id":"CCMSLIB00017316148","spectrum_index":49608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 26.0298 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.089,"smiles":null,"spectrum_id":"CCMSLIB00017316149","spectrum_index":49609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 8.0249 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.101,"smiles":null,"spectrum_id":"CCMSLIB00017316150","spectrum_index":49610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 114.0788 Da; putative annotation: N/A; putative formula: C5H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.181,"smiles":null,"spectrum_id":"CCMSLIB00017316151","spectrum_index":49611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 60.0296 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.147,"smiles":null,"spectrum_id":"CCMSLIB00017316152","spectrum_index":49612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 441.1841 Da; putative annotation: N/A; putative formula: C30H23N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.308,"smiles":null,"spectrum_id":"CCMSLIB00017316153","spectrum_index":49613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-nitro-1H-indole-2-carboxylate (delta mass: 136.0484 Da; putative annotation: N/A; putative formula: C3H8N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.104,"smiles":null,"spectrum_id":"CCMSLIB00017316154","spectrum_index":49614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HarmalolHCl2H2O///harmalol///Harmalol CollisionEnergy:205060 (delta mass: 93.0613 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.164,"smiles":null,"spectrum_id":"CCMSLIB00017316155","spectrum_index":49615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 213.1114 Da; putative annotation: N/A; putative formula: C9H15N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.214,"smiles":null,"spectrum_id":"CCMSLIB00017316156","spectrum_index":49616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 359.2231 Da; putative annotation: N/A; putative formula: C18H34NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.347,"smiles":null,"spectrum_id":"CCMSLIB00017316157","spectrum_index":49617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 128.0445 Da; putative annotation: N/A; putative formula: C2H4N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.147,"smiles":null,"spectrum_id":"CCMSLIB00017316158","spectrum_index":49618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 255.0054 Da; putative annotation: N/A; putative formula: C7H13NO3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.159,"smiles":null,"spectrum_id":"CCMSLIB00017316159","spectrum_index":49619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 22.0906 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.224,"smiles":null,"spectrum_id":"CCMSLIB00017316160","spectrum_index":49620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 193.0837 Da; putative annotation: N/A; putative formula: C5H7N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.159,"smiles":null,"spectrum_id":"CCMSLIB00017316161","spectrum_index":49621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 28.9789 Da; putative annotation: N/A; putative formula: NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.071,"smiles":null,"spectrum_id":"CCMSLIB00017316162","spectrum_index":49622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 128.0466 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.138,"smiles":null,"spectrum_id":"CCMSLIB00017316163","spectrum_index":49623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclocurcumin (delta mass: 36.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.154,"smiles":null,"spectrum_id":"CCMSLIB00017316164","spectrum_index":49624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 97.0527 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.223,"smiles":null,"spectrum_id":"CCMSLIB00017316165","spectrum_index":49625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 404.0567 Da; putative annotation: N/A; putative formula: C12H24N2O5S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.143,"smiles":null,"spectrum_id":"CCMSLIB00017316166","spectrum_index":49626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 649.4184 Da; putative annotation: N/A; putative formula: C36H59NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.521,"smiles":null,"spectrum_id":"CCMSLIB00017316167","spectrum_index":49627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110001 Salbutamol|Albuterol|4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol (delta mass: 281.2084 Da; putative annotation: N/A; putative formula: C11H23N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.368,"smiles":null,"spectrum_id":"CCMSLIB00017316168","spectrum_index":49628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 356.0717 Da; putative annotation: N/A; putative formula: C19H16O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.158,"smiles":null,"spectrum_id":"CCMSLIB00017316169","spectrum_index":49629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 245.0347 Da; putative annotation: N/A; putative formula: C11H8N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.163,"smiles":null,"spectrum_id":"CCMSLIB00017316170","spectrum_index":49630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 46.0054 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.269,"smiles":null,"spectrum_id":"CCMSLIB00017316171","spectrum_index":49631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C9:0 (delta mass: 43.9868 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.193,"smiles":null,"spectrum_id":"CCMSLIB00017316172","spectrum_index":49632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[8-(2-Hydroxypropan-2-yl)-3-methoxycarbonyl-3,4a,7,10a-tetramethyl-5-methylidene-1,4-dioxo-6,6a,8,9,10,10b-hexahydrobenzo[h]isochromen-7-yl]propanoic acid (delta mass: 74.0514 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.315,"smiles":null,"spectrum_id":"CCMSLIB00017316173","spectrum_index":49633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 222.0345 Da; putative annotation: N/A; putative formula: C13H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.161,"smiles":null,"spectrum_id":"CCMSLIB00017316174","spectrum_index":49634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 208.1831 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.27,"smiles":null,"spectrum_id":"CCMSLIB00017316175","spectrum_index":49635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 404.1467 Da; putative annotation: N/A; putative formula: C21H24O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.259,"smiles":null,"spectrum_id":"CCMSLIB00017316176","spectrum_index":49636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 363.2147 Da; putative annotation: N/A; putative formula: C19H29N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.317,"smiles":null,"spectrum_id":"CCMSLIB00017316177","spectrum_index":49637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 15.9352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.0,"smiles":null,"spectrum_id":"CCMSLIB00017316178","spectrum_index":49638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140302 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 14.9036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.0,"smiles":null,"spectrum_id":"CCMSLIB00017316179","spectrum_index":49639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 76.0299 Da; putative annotation: N/A; putative formula: H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.111,"smiles":null,"spectrum_id":"CCMSLIB00017316180","spectrum_index":49640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 541.3247 Da; putative annotation: N/A; putative formula: C26H35N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.4,"smiles":null,"spectrum_id":"CCMSLIB00017316181","spectrum_index":49641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 125.0464 Da; putative annotation: N/A; putative formula: C6H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.17,"smiles":null,"spectrum_id":"CCMSLIB00017316182","spectrum_index":49642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 32.025 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.127,"smiles":null,"spectrum_id":"CCMSLIB00017316183","spectrum_index":49643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 161.1414 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.244,"smiles":null,"spectrum_id":"CCMSLIB00017316184","spectrum_index":49644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 526.3189 Da; putative annotation: N/A; putative formula: C26H46N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":887.484,"smiles":null,"spectrum_id":"CCMSLIB00017316185","spectrum_index":49645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Histidine methyl ester (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.103,"smiles":null,"spectrum_id":"CCMSLIB00017316186","spectrum_index":49646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 190.0478 Da; putative annotation: N/A; putative formula: C7H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.15,"smiles":null,"spectrum_id":"CCMSLIB00017316187","spectrum_index":49647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 386.2875 Da; putative annotation: N/A; putative formula: C23H38N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.384,"smiles":null,"spectrum_id":"CCMSLIB00017316188","spectrum_index":49648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 151.0487 Da; putative annotation: N/A; putative formula: C4H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.129,"smiles":null,"spectrum_id":"CCMSLIB00017316189","spectrum_index":49649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 50.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017316190","spectrum_index":49650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 132.0934 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.206,"smiles":null,"spectrum_id":"CCMSLIB00017316191","spectrum_index":49651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 193.1514 Da; putative annotation: N/A; putative formula: C2H15N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.21,"smiles":null,"spectrum_id":"CCMSLIB00017316192","spectrum_index":49652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 262.0433 Da; putative annotation: N/A; putative formula: C8H10N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.119,"smiles":null,"spectrum_id":"CCMSLIB00017316193","spectrum_index":49653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 44.0236 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.167,"smiles":null,"spectrum_id":"CCMSLIB00017316194","spectrum_index":49654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 50.0185 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.157,"smiles":null,"spectrum_id":"CCMSLIB00017316195","spectrum_index":49655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 274.1501 Da; putative annotation: N/A; putative formula: C8H18N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.304,"smiles":null,"spectrum_id":"CCMSLIB00017316196","spectrum_index":49656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PLATYPHYLLENONE (delta mass: 252.0958 Da; putative annotation: N/A; putative formula: C8H16N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.244,"smiles":null,"spectrum_id":"CCMSLIB00017316197","spectrum_index":49657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 189.142 Da; putative annotation: N/A; putative formula: C7H19N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.254,"smiles":null,"spectrum_id":"CCMSLIB00017316198","spectrum_index":49658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 951.7805 Da; putative annotation: N/A; putative formula: C54H105N5O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1173.88,"smiles":null,"spectrum_id":"CCMSLIB00017316199","spectrum_index":49659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 30.8263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.907,"smiles":null,"spectrum_id":"CCMSLIB00017316200","spectrum_index":49660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 197.2586 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.418,"smiles":null,"spectrum_id":"CCMSLIB00017316201","spectrum_index":49661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 225.2518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.432,"smiles":null,"spectrum_id":"CCMSLIB00017316202","spectrum_index":49662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norhydrocodone (delta mass: 18.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.212,"smiles":null,"spectrum_id":"CCMSLIB00017316203","spectrum_index":49663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 263.1135 Da; putative annotation: N/A; putative formula: C18H17NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.257,"smiles":null,"spectrum_id":"CCMSLIB00017316204","spectrum_index":49664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4,7,10,13-Pentaazacyclopentadecane (delta mass: 60.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.287,"smiles":null,"spectrum_id":"CCMSLIB00017316205","spectrum_index":49665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 34.0402 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.131,"smiles":null,"spectrum_id":"CCMSLIB00017316206","spectrum_index":49666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6H-Indolo[2,3-b]quinoline (delta mass: 44.0144 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.106,"smiles":null,"spectrum_id":"CCMSLIB00017316207","spectrum_index":49667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01041 Hexahydrocurcumin (delta mass: 121.0371 Da; putative annotation: N/A; putative formula: C3H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.217,"smiles":null,"spectrum_id":"CCMSLIB00017316208","spectrum_index":49668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 9.98 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.134,"smiles":null,"spectrum_id":"CCMSLIB00017316209","spectrum_index":49669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-{[4-(dimethylamino)-3-hydroxyoxolan-2-yl]methyl}morpholine-4-carboxamide (delta mass: 34.03 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.206,"smiles":null,"spectrum_id":"CCMSLIB00017316210","spectrum_index":49670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 95.0375 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.108,"smiles":null,"spectrum_id":"CCMSLIB00017316211","spectrum_index":49671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match] (delta mass: 308.0082 Da; putative annotation: N/A; putative formula: C8H14N4OP2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.277,"smiles":null,"spectrum_id":"CCMSLIB00017316212","spectrum_index":49672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 135.1037 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.227,"smiles":null,"spectrum_id":"CCMSLIB00017316213","spectrum_index":49673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 59.0232 Da; putative annotation: N/A; putative formula: C2H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.125,"smiles":null,"spectrum_id":"CCMSLIB00017316214","spectrum_index":49674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 114.0428 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.14,"smiles":null,"spectrum_id":"CCMSLIB00017316215","spectrum_index":49675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 283.287 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.368,"smiles":null,"spectrum_id":"CCMSLIB00017316216","spectrum_index":49676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 73.0779 Da; putative annotation: N/A; putative formula: CH7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.143,"smiles":null,"spectrum_id":"CCMSLIB00017316217","spectrum_index":49677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylnorfloxacin (delta mass: 54.0086 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.16,"smiles":null,"spectrum_id":"CCMSLIB00017316218","spectrum_index":49678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Leu (delta mass: 113.0846 Da; putative annotation: 2-Amino-2-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.245,"smiles":null,"spectrum_id":"CCMSLIB00017316219","spectrum_index":49679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phe-Pro-Lys (delta mass: 97.0542 Da; putative annotation: PROLINE; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.288,"smiles":null,"spectrum_id":"CCMSLIB00017316220","spectrum_index":49680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-beta-D-galactosamine - 40.0 eV (delta mass: 300.2448 Da; putative annotation: Methasterone; putative formula: C21H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.342,"smiles":null,"spectrum_id":"CCMSLIB00017316221","spectrum_index":49681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 228.1115 Da; putative annotation: Ile-Asp; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.24,"smiles":null,"spectrum_id":"CCMSLIB00017316222","spectrum_index":49682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 138.107 Da; putative annotation: (2-Hydroxymethylbicyclo[2.2.1]hept-2-yl)methanol; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.329,"smiles":null,"spectrum_id":"CCMSLIB00017316223","spectrum_index":49683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 176.0846 Da; putative annotation: Galiellalactone; putative formula: C11H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.14,"smiles":null,"spectrum_id":"CCMSLIB00017316224","spectrum_index":49684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 355.2497 Da; putative annotation: Ala-C20:5; putative formula: C23H33NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.362,"smiles":null,"spectrum_id":"CCMSLIB00017316225","spectrum_index":49685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 98.0732 Da; putative annotation: Diethylacetic acid; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.128,"smiles":null,"spectrum_id":"CCMSLIB00017316226","spectrum_index":49686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 166.1356 Da; putative annotation: 10-Hendecenoic acid; putative formula: C11H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.263,"smiles":null,"spectrum_id":"CCMSLIB00017316227","spectrum_index":49687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-3-pyridazinol (delta mass: 46.0532 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.109,"smiles":null,"spectrum_id":"CCMSLIB00017316228","spectrum_index":49688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indolmycin (delta mass: 426.2709 Da; putative annotation: N/A; putative formula: C34H34O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.395,"smiles":null,"spectrum_id":"CCMSLIB00017316229","spectrum_index":49689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 90.9676 Da; putative annotation: N/A; putative formula: CH2NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.083,"smiles":null,"spectrum_id":"CCMSLIB00017316230","spectrum_index":49690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 101.0302 Da; putative annotation: N/A; putative formula: C4H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.08,"smiles":null,"spectrum_id":"CCMSLIB00017316231","spectrum_index":49691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 184.1217 Da; putative annotation: N/A; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.396,"smiles":null,"spectrum_id":"CCMSLIB00017316232","spectrum_index":49692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 383.2533 Da; putative annotation: N/A; putative formula: C18H33N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.34,"smiles":null,"spectrum_id":"CCMSLIB00017316233","spectrum_index":49693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 208.0694 Da; putative annotation: N/A; putative formula: C6H12N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.16,"smiles":null,"spectrum_id":"CCMSLIB00017316234","spectrum_index":49694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 118.0259 Da; putative annotation: N/A; putative formula: C4H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.18,"smiles":null,"spectrum_id":"CCMSLIB00017316235","spectrum_index":49695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 167.0735 Da; putative annotation: N/A; putative formula: C12H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.134,"smiles":null,"spectrum_id":"CCMSLIB00017316236","spectrum_index":49696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 102.0316 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.201,"smiles":null,"spectrum_id":"CCMSLIB00017316237","spectrum_index":49697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephromopsic acid (delta mass: 413.2778 Da; putative annotation: N/A; putative formula: C22H39NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.531,"smiles":null,"spectrum_id":"CCMSLIB00017316238","spectrum_index":49698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 101.0365 Da; putative annotation: N/A; putative formula: C6H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.143,"smiles":null,"spectrum_id":"CCMSLIB00017316239","spectrum_index":49699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 814.1961 Da; putative annotation: N/A; putative formula: C52H34N2O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":961.261,"smiles":null,"spectrum_id":"CCMSLIB00017316240","spectrum_index":49700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 89.0189 Da; putative annotation: N/A; putative formula: CH3N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.11,"smiles":null,"spectrum_id":"CCMSLIB00017316241","spectrum_index":49701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017316242","spectrum_index":49702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 8.9958 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.098,"smiles":null,"spectrum_id":"CCMSLIB00017316243","spectrum_index":49703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 369.2401 Da; putative annotation: N/A; putative formula: C18H27N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.409,"smiles":null,"spectrum_id":"CCMSLIB00017316244","spectrum_index":49704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serricornin (delta mass: 182.0579 Da; putative annotation: N/A; putative formula: C9H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.227,"smiles":null,"spectrum_id":"CCMSLIB00017316245","spectrum_index":49705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 143.0583 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":648.235,"smiles":null,"spectrum_id":"CCMSLIB00017316246","spectrum_index":49706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 72.0432 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.086,"smiles":null,"spectrum_id":"CCMSLIB00017316247","spectrum_index":49707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Succinic semialdehyde (delta mass: 45.021 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.06,"smiles":null,"spectrum_id":"CCMSLIB00017316248","spectrum_index":49708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 410.1425 Da; putative annotation: N/A; putative formula: C21H24N4OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.203,"smiles":null,"spectrum_id":"CCMSLIB00017316249","spectrum_index":49709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 465.1426 Da; putative annotation: N/A; putative formula: C18H31N3O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.213,"smiles":null,"spectrum_id":"CCMSLIB00017316250","spectrum_index":49710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 17.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.103,"smiles":null,"spectrum_id":"CCMSLIB00017316251","spectrum_index":49711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 393.4335 Da; putative annotation: N/A; putative formula: C27H55N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.52,"smiles":null,"spectrum_id":"CCMSLIB00017316252","spectrum_index":49712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 52.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.143,"smiles":null,"spectrum_id":"CCMSLIB00017316253","spectrum_index":49713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 183.0898 Da; putative annotation: N/A; putative formula: C9H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.203,"smiles":null,"spectrum_id":"CCMSLIB00017316254","spectrum_index":49714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine (delta mass: 141.1518 Da; putative annotation: N/A; putative formula: C9H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.238,"smiles":null,"spectrum_id":"CCMSLIB00017316255","spectrum_index":49715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 96.0055 Da; putative annotation: N/A; putative formula: C2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.071,"smiles":null,"spectrum_id":"CCMSLIB00017316256","spectrum_index":49716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 71.0583 Da; putative annotation: N/A; putative formula: CH5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.144,"smiles":null,"spectrum_id":"CCMSLIB00017316257","spectrum_index":49717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 86.0155 Da; putative annotation: N/A; putative formula: C7H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.086,"smiles":null,"spectrum_id":"CCMSLIB00017316258","spectrum_index":49718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 148.1251 Da; putative annotation: N/A; putative formula: C11H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.55,"smiles":null,"spectrum_id":"CCMSLIB00017316259","spectrum_index":49719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 41.0304 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.216,"smiles":null,"spectrum_id":"CCMSLIB00017316260","spectrum_index":49720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzodioxole-5-propanamine, N,.beta.-dimethyl- (delta mass: 103.0629 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.196,"smiles":null,"spectrum_id":"CCMSLIB00017316261","spectrum_index":49721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one (delta mass: 15.0184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.126,"smiles":null,"spectrum_id":"CCMSLIB00017316262","spectrum_index":49722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 147.0662 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.137,"smiles":null,"spectrum_id":"CCMSLIB00017316263","spectrum_index":49723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 448.1591 Da; putative annotation: N/A; putative formula: C20H32O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.271,"smiles":null,"spectrum_id":"CCMSLIB00017316264","spectrum_index":49724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 153.0424 Da; putative annotation: N/A; putative formula: C7H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017316265","spectrum_index":49725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 117.0302 Da; putative annotation: N/A; putative formula: CH3N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.09,"smiles":null,"spectrum_id":"CCMSLIB00017316266","spectrum_index":49726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 30.0095 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.064,"smiles":null,"spectrum_id":"CCMSLIB00017316267","spectrum_index":49727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 193.6073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.71,"smiles":null,"spectrum_id":"CCMSLIB00017316268","spectrum_index":49728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 138.0748 Da; putative annotation: N/A; putative formula: C3H6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.123,"smiles":null,"spectrum_id":"CCMSLIB00017316269","spectrum_index":49729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 94.0423 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.102,"smiles":null,"spectrum_id":"CCMSLIB00017316270","spectrum_index":49730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 213.0849 Da; putative annotation: N/A; putative formula: C9H16N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.197,"smiles":null,"spectrum_id":"CCMSLIB00017316271","spectrum_index":49731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 280.0372 Da; putative annotation: N/A; putative formula: C16H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.108,"smiles":null,"spectrum_id":"CCMSLIB00017316272","spectrum_index":49732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 19.0339 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.146,"smiles":null,"spectrum_id":"CCMSLIB00017316273","spectrum_index":49733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311082 Dicoumaroyl Spermidine (delta mass: 176.0477 Da; putative annotation: N/A; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.286,"smiles":null,"spectrum_id":"CCMSLIB00017316274","spectrum_index":49734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 56.0348 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.158,"smiles":null,"spectrum_id":"CCMSLIB00017316275","spectrum_index":49735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 203.1801 Da; putative annotation: N/A; putative formula: C13H21N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.271,"smiles":null,"spectrum_id":"CCMSLIB00017316276","spectrum_index":49736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 63.1054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.28,"smiles":null,"spectrum_id":"CCMSLIB00017316277","spectrum_index":49737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 130.1207 Da; putative annotation: N/A; putative formula: C5H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.181,"smiles":null,"spectrum_id":"CCMSLIB00017316278","spectrum_index":49738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Glu (delta mass: 399.1568 Da; putative annotation: N/A; putative formula: C18H30N3OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.244,"smiles":null,"spectrum_id":"CCMSLIB00017316279","spectrum_index":49739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 738.3108 Da; putative annotation: N/A; putative formula: C50H38N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.371,"smiles":null,"spectrum_id":"CCMSLIB00017316280","spectrum_index":49740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 240.0993 Da; putative annotation: N/A; putative formula: C12H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.211,"smiles":null,"spectrum_id":"CCMSLIB00017316281","spectrum_index":49741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 56.0263 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.086,"smiles":null,"spectrum_id":"CCMSLIB00017316282","spectrum_index":49742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylphenol (delta mass: 28.0431 Da; putative annotation: N/A; putative formula: CH4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.119,"smiles":null,"spectrum_id":"CCMSLIB00017316283","spectrum_index":49743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 97.0502 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.204,"smiles":null,"spectrum_id":"CCMSLIB00017316284","spectrum_index":49744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 256.2039 Da; putative annotation: N/A; putative formula: C15H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.312,"smiles":null,"spectrum_id":"CCMSLIB00017316285","spectrum_index":49745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 44.0535 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.129,"smiles":null,"spectrum_id":"CCMSLIB00017316286","spectrum_index":49746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-indole-3-carbaldehyde (delta mass: 11.9992 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.075,"smiles":null,"spectrum_id":"CCMSLIB00017316287","spectrum_index":49747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 442.2361 Da; putative annotation: N/A; putative formula: C19H34N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.39,"smiles":null,"spectrum_id":"CCMSLIB00017316288","spectrum_index":49748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 29.0132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.131,"smiles":null,"spectrum_id":"CCMSLIB00017316289","spectrum_index":49749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 17.989 Da; putative annotation: N/A; putative formula: C3H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.107,"smiles":null,"spectrum_id":"CCMSLIB00017316290","spectrum_index":49750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 59.0159 Da; putative annotation: N/A; putative formula: C5HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017316291","spectrum_index":49751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 29.9928 Da; putative annotation: N/A; putative formula: CH2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.085,"smiles":null,"spectrum_id":"CCMSLIB00017316292","spectrum_index":49752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 47.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.122,"smiles":null,"spectrum_id":"CCMSLIB00017316293","spectrum_index":49753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 18.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.132,"smiles":null,"spectrum_id":"CCMSLIB00017316294","spectrum_index":49754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 47.0052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.091,"smiles":null,"spectrum_id":"CCMSLIB00017316295","spectrum_index":49755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ticarcillin (delta mass: 9.9808 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.033,"smiles":null,"spectrum_id":"CCMSLIB00017316296","spectrum_index":49756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxytyramine (delta mass: 356.1852 Da; putative annotation: N/A; putative formula: C19H24N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.272,"smiles":null,"spectrum_id":"CCMSLIB00017316297","spectrum_index":49757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 223.1684 Da; putative annotation: N/A; putative formula: C12H21N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.292,"smiles":null,"spectrum_id":"CCMSLIB00017316298","spectrum_index":49758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 97.0546 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.115,"smiles":null,"spectrum_id":"CCMSLIB00017316299","spectrum_index":49759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 109.0528 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.124,"smiles":null,"spectrum_id":"CCMSLIB00017316300","spectrum_index":49760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2'-deoxycytidine (delta mass: 116.0422 Da; putative annotation: N/A; putative formula: C4H8N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.156,"smiles":null,"spectrum_id":"CCMSLIB00017316301","spectrum_index":49761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of epinephrine CollisionEnergy:102040 (delta mass: 37.0566 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.153,"smiles":null,"spectrum_id":"CCMSLIB00017316302","spectrum_index":49762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 142.1153 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.358,"smiles":null,"spectrum_id":"CCMSLIB00017316303","spectrum_index":49763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 141.0788 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.15,"smiles":null,"spectrum_id":"CCMSLIB00017316304","spectrum_index":49764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 94.0527 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.187,"smiles":null,"spectrum_id":"CCMSLIB00017316305","spectrum_index":49765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-tetrahydro-6-methoxy-1-oxo-beta-carboline (delta mass: 161.0575 Da; putative annotation: N/A; putative formula: C4H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.155,"smiles":null,"spectrum_id":"CCMSLIB00017316306","spectrum_index":49766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 338.0417 Da; putative annotation: N/A; putative formula: C12H11N4O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.165,"smiles":null,"spectrum_id":"CCMSLIB00017316307","spectrum_index":49767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 972.4574 Da; putative annotation: N/A; putative formula: C61H60N6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1135.52,"smiles":null,"spectrum_id":"CCMSLIB00017316308","spectrum_index":49768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 313.1635 Da; putative annotation: N/A; putative formula: C14H23N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.25,"smiles":null,"spectrum_id":"CCMSLIB00017316309","spectrum_index":49769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-methionine - 30.0 eV (delta mass: 116.0935 Da; putative annotation: N/A; putative formula: CH8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.162,"smiles":null,"spectrum_id":"CCMSLIB00017316310","spectrum_index":49770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxycytidine\u00a05'-monophosphate (delta mass: 30.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.08,"smiles":null,"spectrum_id":"CCMSLIB00017316311","spectrum_index":49771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (delta mass: 133.0487 Da; putative annotation: N/A; putative formula: C3H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.153,"smiles":null,"spectrum_id":"CCMSLIB00017316312","spectrum_index":49772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 68.0262 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017316313","spectrum_index":49773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 44.0281 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.067,"smiles":null,"spectrum_id":"CCMSLIB00017316314","spectrum_index":49774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 472.3169 Da; putative annotation: N/A; putative formula: C33H44S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.377,"smiles":null,"spectrum_id":"CCMSLIB00017316315","spectrum_index":49775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 42.0214 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.071,"smiles":null,"spectrum_id":"CCMSLIB00017316316","spectrum_index":49776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 90.0236 Da; putative annotation: N/A; putative formula: C3H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.115,"smiles":null,"spectrum_id":"CCMSLIB00017316317","spectrum_index":49777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Pro (delta mass: 71.0364 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.175,"smiles":null,"spectrum_id":"CCMSLIB00017316318","spectrum_index":49778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 97.0475 Da; putative annotation: N/A; putative formula: CH3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.129,"smiles":null,"spectrum_id":"CCMSLIB00017316319","spectrum_index":49779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU089301 Volinanserin (delta mass: 254.2424 Da; putative annotation: N/A; putative formula: C17H34O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.455,"smiles":null,"spectrum_id":"CCMSLIB00017316320","spectrum_index":49780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 1037.777 Da; putative annotation: N/A; putative formula: C56H99N11O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1542.95,"smiles":null,"spectrum_id":"CCMSLIB00017316321","spectrum_index":49781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 151.0625 Da; putative annotation: N/A; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.149,"smiles":null,"spectrum_id":"CCMSLIB00017316322","spectrum_index":49782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-9H-pyrido[2,3-b]indole (AalphaC) (delta mass: 29.0152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.102,"smiles":null,"spectrum_id":"CCMSLIB00017316323","spectrum_index":49783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 242.0818 Da; putative annotation: N/A; putative formula: C10H15N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.142,"smiles":null,"spectrum_id":"CCMSLIB00017316324","spectrum_index":49784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(1H-Indol-3-yl)-1-butanone (delta mass: 44.9853 Da; putative annotation: N/A; putative formula: H-1NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.092,"smiles":null,"spectrum_id":"CCMSLIB00017316325","spectrum_index":49785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 44.1339 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.262,"smiles":null,"spectrum_id":"CCMSLIB00017316326","spectrum_index":49786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 72.0361 Da; putative annotation: N/A; putative formula: C7H4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.101,"smiles":null,"spectrum_id":"CCMSLIB00017316327","spectrum_index":49787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 186.1161 Da; putative annotation: N/A; putative formula: C12H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.218,"smiles":null,"spectrum_id":"CCMSLIB00017316328","spectrum_index":49788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 155.0454 Da; putative annotation: N/A; putative formula: C4H5N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.173,"smiles":null,"spectrum_id":"CCMSLIB00017316329","spectrum_index":49789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 12.9815 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.063,"smiles":null,"spectrum_id":"CCMSLIB00017316330","spectrum_index":49790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethylselegiline (delta mass: 18.994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017316331","spectrum_index":49791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 15.014 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.132,"smiles":null,"spectrum_id":"CCMSLIB00017316332","spectrum_index":49792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 277.0517 Da; putative annotation: N/A; putative formula: C12H11N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.228,"smiles":null,"spectrum_id":"CCMSLIB00017316333","spectrum_index":49793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 37.9523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.076,"smiles":null,"spectrum_id":"CCMSLIB00017316334","spectrum_index":49794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 227.1579 Da; putative annotation: N/A; putative formula: C10H21N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.317,"smiles":null,"spectrum_id":"CCMSLIB00017316335","spectrum_index":49795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 409.3318 Da; putative annotation: N/A; putative formula: C24H39N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.397,"smiles":null,"spectrum_id":"CCMSLIB00017316336","spectrum_index":49796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 110.0544 Da; putative annotation: N/A; putative formula: C7H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.183,"smiles":null,"spectrum_id":"CCMSLIB00017316337","spectrum_index":49797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 42.9717 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.058,"smiles":null,"spectrum_id":"CCMSLIB00017316338","spectrum_index":49798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glutamic acid gamma methyl ester (delta mass: 198.1624 Da; putative annotation: N/A; putative formula: C12H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.238,"smiles":null,"spectrum_id":"CCMSLIB00017316339","spectrum_index":49799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 348.0817 Da; putative annotation: N/A; putative formula: C23H13N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.194,"smiles":null,"spectrum_id":"CCMSLIB00017316340","spectrum_index":49800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 136.0139 Da; putative annotation: N/A; putative formula: C3N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.1,"smiles":null,"spectrum_id":"CCMSLIB00017316341","spectrum_index":49801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pergolide sulfoxide (delta mass: 46.0125 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017316342","spectrum_index":49802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 443.2406 Da; putative annotation: N/A; putative formula: C26H38NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.343,"smiles":null,"spectrum_id":"CCMSLIB00017316343","spectrum_index":49803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C10:0 (delta mass: 529.4127 Da; putative annotation: N/A; putative formula: C33H55NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":772.656,"smiles":null,"spectrum_id":"CCMSLIB00017316344","spectrum_index":49804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 60.042 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.306,"smiles":null,"spectrum_id":"CCMSLIB00017316345","spectrum_index":49805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 9.0157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.076,"smiles":null,"spectrum_id":"CCMSLIB00017316346","spectrum_index":49806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 200.1922 Da; putative annotation: N/A; putative formula: C16H24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.263,"smiles":null,"spectrum_id":"CCMSLIB00017316347","spectrum_index":49807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 99.0681 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017316348","spectrum_index":49808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 50.0269 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.176,"smiles":null,"spectrum_id":"CCMSLIB00017316349","spectrum_index":49809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 212.1533 Da; putative annotation: N/A; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.25,"smiles":null,"spectrum_id":"CCMSLIB00017316350","spectrum_index":49810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Thr (delta mass: 147.0677 Da; putative annotation: N/A; putative formula: C3H10N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.176,"smiles":null,"spectrum_id":"CCMSLIB00017316351","spectrum_index":49811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 111.0319 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.097,"smiles":null,"spectrum_id":"CCMSLIB00017316352","spectrum_index":49812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 94.0814 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.168,"smiles":null,"spectrum_id":"CCMSLIB00017316353","spectrum_index":49813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLATE (delta mass: 88.0606 Da; putative annotation: N/A; putative formula: C3H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.116,"smiles":null,"spectrum_id":"CCMSLIB00017316354","spectrum_index":49814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (delta mass: 208.148 Da; putative annotation: N/A; putative formula: C12H21N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.188,"smiles":null,"spectrum_id":"CCMSLIB00017316355","spectrum_index":49815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 26.0033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.09,"smiles":null,"spectrum_id":"CCMSLIB00017316356","spectrum_index":49816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 712.2683 Da; putative annotation: N/A; putative formula: C55H37O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":934.365,"smiles":null,"spectrum_id":"CCMSLIB00017316357","spectrum_index":49817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 23.9994 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.112,"smiles":null,"spectrum_id":"CCMSLIB00017316358","spectrum_index":49818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00178646-02!2,4-dihydroxyheptadecyl acetate [IIN-based: Match] (delta mass: 104.0992 Da; putative annotation: N/A; putative formula: C9H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.384,"smiles":null,"spectrum_id":"CCMSLIB00017316359","spectrum_index":49819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 98.027 Da; putative annotation: N/A; putative formula: C7H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.155,"smiles":null,"spectrum_id":"CCMSLIB00017316360","spectrum_index":49820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-corydalmine (delta mass: 18.0106 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.181,"smiles":null,"spectrum_id":"CCMSLIB00017316361","spectrum_index":49821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 58.074 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.139,"smiles":null,"spectrum_id":"CCMSLIB00017316362","spectrum_index":49822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 148.0526 Da; putative annotation: 4-(2-Hydroxyethoxy)benzaldehyde; putative formula: C9H8O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.118,"smiles":null,"spectrum_id":"CCMSLIB00017316363","spectrum_index":49823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 129.043 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.092,"smiles":null,"spectrum_id":"CCMSLIB00017316364","spectrum_index":49824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 115.064 Da; putative annotation: N-Methyl-L-threonine; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.193,"smiles":null,"spectrum_id":"CCMSLIB00017316365","spectrum_index":49825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine CollisionEnergy:102040 (delta mass: 113.0844 Da; putative annotation: 2-[(2-Methylpropyl)amino]acetic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.181,"smiles":null,"spectrum_id":"CCMSLIB00017316366","spectrum_index":49826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 266.1153 Da; putative annotation: NCGC00169593-02_C14H20O6_2-Phenylethyl beta-D-glucopyranoside; putative formula: C14H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.191,"smiles":null,"spectrum_id":"CCMSLIB00017316367","spectrum_index":49827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 144.0183 Da; putative annotation: 6-Hydroxycoumarin; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.12,"smiles":null,"spectrum_id":"CCMSLIB00017316368","spectrum_index":49828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 128.0681 Da; putative annotation: N/A; putative formula: H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.17,"smiles":null,"spectrum_id":"CCMSLIB00017316369","spectrum_index":49829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 301.1025 Da; putative annotation: N/A; putative formula: C10H15N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.256,"smiles":null,"spectrum_id":"CCMSLIB00017316370","spectrum_index":49830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lyngbyatoxin A  Me ether putative or related isomer (delta mass: 479.3113 Da; putative annotation: N/A; putative formula: C24H41N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":931.638,"smiles":null,"spectrum_id":"CCMSLIB00017316371","spectrum_index":49831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 14.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017316372","spectrum_index":49832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 168.115 Da; putative annotation: N/A; putative formula: C10H16O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.18,"smiles":null,"spectrum_id":"CCMSLIB00017316373","spectrum_index":49833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 293.0881 Da; putative annotation: N/A; putative formula: C11H15N7O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.175,"smiles":null,"spectrum_id":"CCMSLIB00017316374","spectrum_index":49834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 44.9937 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017316375","spectrum_index":49835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 159.0495 Da; putative annotation: N/A; putative formula: C2H5N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.12,"smiles":null,"spectrum_id":"CCMSLIB00017316376","spectrum_index":49836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 213.1724 Da; putative annotation: N/A; putative formula: C12H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.264,"smiles":null,"spectrum_id":"CCMSLIB00017316377","spectrum_index":49837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 784.3159 Da; putative annotation: N/A; putative formula: C44H56N4O-1S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":949.364,"smiles":null,"spectrum_id":"CCMSLIB00017316378","spectrum_index":49838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 1100.4857 Da; putative annotation: N/A; putative formula: C51H76N10O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1307.57,"smiles":null,"spectrum_id":"CCMSLIB00017316379","spectrum_index":49839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 178.0482 Da; putative annotation: N/A; putative formula: C7H14OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.129,"smiles":null,"spectrum_id":"CCMSLIB00017316380","spectrum_index":49840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 260.1524 Da; putative annotation: N/A; putative formula: C15H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.233,"smiles":null,"spectrum_id":"CCMSLIB00017316381","spectrum_index":49841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Formyltryptophan (delta mass: 84.0579 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.15,"smiles":null,"spectrum_id":"CCMSLIB00017316382","spectrum_index":49842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trifluperidol (delta mass: 134.0525 Da; putative annotation: N/A; putative formula: C4H12N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.226,"smiles":null,"spectrum_id":"CCMSLIB00017316383","spectrum_index":49843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 58.0631 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.149,"smiles":null,"spectrum_id":"CCMSLIB00017316384","spectrum_index":49844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 222.1989 Da; putative annotation: N/A; putative formula: C15H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.285,"smiles":null,"spectrum_id":"CCMSLIB00017316385","spectrum_index":49845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 87.0106 Da; putative annotation: N/A; putative formula: C6HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.139,"smiles":null,"spectrum_id":"CCMSLIB00017316386","spectrum_index":49846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 293.1931 Da; putative annotation: N/A; putative formula: C16H27N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.273,"smiles":null,"spectrum_id":"CCMSLIB00017316387","spectrum_index":49847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084604 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 144.043 Da; putative annotation: N/A; putative formula: C7H12O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.098,"smiles":null,"spectrum_id":"CCMSLIB00017316388","spectrum_index":49848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Untitled CollisionEnergy:102040 (delta mass: 121.0841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.249,"smiles":null,"spectrum_id":"CCMSLIB00017316389","spectrum_index":49849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 15.0236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.115,"smiles":null,"spectrum_id":"CCMSLIB00017316390","spectrum_index":49850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(4-methoxyphenyl)methanamine (delta mass: 6.0071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.145,"smiles":null,"spectrum_id":"CCMSLIB00017316391","spectrum_index":49851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 619.4081 Da; putative annotation: N/A; putative formula: C35H57NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.51,"smiles":null,"spectrum_id":"CCMSLIB00017316392","spectrum_index":49852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 32.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.124,"smiles":null,"spectrum_id":"CCMSLIB00017316393","spectrum_index":49853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 45.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.118,"smiles":null,"spectrum_id":"CCMSLIB00017316394","spectrum_index":49854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aflatoxin M1 (delta mass: 308.0868 Da; putative annotation: N/A; putative formula: C11H12N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.152,"smiles":null,"spectrum_id":"CCMSLIB00017316395","spectrum_index":49855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 143.0801 Da; putative annotation: N/A; putative formula: C4H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.188,"smiles":null,"spectrum_id":"CCMSLIB00017316396","spectrum_index":49856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzamide, N-1H-indol-5-yl- (delta mass: 160.1198 Da; putative annotation: N/A; putative formula: C7H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.222,"smiles":null,"spectrum_id":"CCMSLIB00017316397","spectrum_index":49857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 10.0053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.132,"smiles":null,"spectrum_id":"CCMSLIB00017316398","spectrum_index":49858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxydesipramine (delta mass: 193.1005 Da; putative annotation: N/A; putative formula: C13H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.281,"smiles":null,"spectrum_id":"CCMSLIB00017316399","spectrum_index":49859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 137.0806 Da; putative annotation: N/A; putative formula: C4H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.183,"smiles":null,"spectrum_id":"CCMSLIB00017316400","spectrum_index":49860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-nitro-1H-indole-2-carboxylate (delta mass: 57.0687 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.14,"smiles":null,"spectrum_id":"CCMSLIB00017316401","spectrum_index":49861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 48.0241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.11,"smiles":null,"spectrum_id":"CCMSLIB00017316402","spectrum_index":49862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 995.3329 Da; putative annotation: N/A; putative formula: C38H61NO29)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1158.39,"smiles":null,"spectrum_id":"CCMSLIB00017316403","spectrum_index":49863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 86.0009 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.16,"smiles":null,"spectrum_id":"CCMSLIB00017316404","spectrum_index":49864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 78.047 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.159,"smiles":null,"spectrum_id":"CCMSLIB00017316405","spectrum_index":49865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citromycetin (delta mass: 42.0103 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.06,"smiles":null,"spectrum_id":"CCMSLIB00017316406","spectrum_index":49866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 50.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.165,"smiles":null,"spectrum_id":"CCMSLIB00017316407","spectrum_index":49867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 325.0432 Da; putative annotation: N/A; putative formula: C13H11NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.108,"smiles":null,"spectrum_id":"CCMSLIB00017316408","spectrum_index":49868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 357.1946 Da; putative annotation: N/A; putative formula: C14H27N7O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":715.396,"smiles":null,"spectrum_id":"CCMSLIB00017316409","spectrum_index":49869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301136 L-Oxonoreleagnine (delta mass: 57.9905 Da; putative annotation: N/A; putative formula: C2H2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.077,"smiles":null,"spectrum_id":"CCMSLIB00017316410","spectrum_index":49870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Asp (delta mass: 53.0636 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.192,"smiles":null,"spectrum_id":"CCMSLIB00017316411","spectrum_index":49871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 56.0293 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.168,"smiles":null,"spectrum_id":"CCMSLIB00017316412","spectrum_index":49872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 91.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.217,"smiles":null,"spectrum_id":"CCMSLIB00017316413","spectrum_index":49873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 69.0582 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.113,"smiles":null,"spectrum_id":"CCMSLIB00017316414","spectrum_index":49874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 62.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.212,"smiles":null,"spectrum_id":"CCMSLIB00017316415","spectrum_index":49875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Phenyl-1,3-thiazol-2-yl)ethylamine (delta mass: 215.0495 Da; putative annotation: N/A; putative formula: C12H10NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.129,"smiles":null,"spectrum_id":"CCMSLIB00017316416","spectrum_index":49876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 187.0271 Da; putative annotation: N/A; putative formula: C10H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.113,"smiles":null,"spectrum_id":"CCMSLIB00017316417","spectrum_index":49877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 36.0371 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.081,"smiles":null,"spectrum_id":"CCMSLIB00017316418","spectrum_index":49878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 120.041 Da; putative annotation: N/A; putative formula: C8H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.101,"smiles":null,"spectrum_id":"CCMSLIB00017316419","spectrum_index":49879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole - 40.0 eV (delta mass: 59.0349 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.1,"smiles":null,"spectrum_id":"CCMSLIB00017316420","spectrum_index":49880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 9.0247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.116,"smiles":null,"spectrum_id":"CCMSLIB00017316421","spectrum_index":49881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 324.1025 Da; putative annotation: N/A; putative formula: C18H17N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":669.236,"smiles":null,"spectrum_id":"CCMSLIB00017316422","spectrum_index":49882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 99.0648 Da; putative annotation: N/A; putative formula: CH5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.203,"smiles":null,"spectrum_id":"CCMSLIB00017316423","spectrum_index":49883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Arabinose (delta mass: 121.0892 Da; putative annotation: N/A; putative formula: C8H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.149,"smiles":null,"spectrum_id":"CCMSLIB00017316424","spectrum_index":49884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 176.0683 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.238,"smiles":null,"spectrum_id":"CCMSLIB00017316425","spectrum_index":49885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 105.043 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.129,"smiles":null,"spectrum_id":"CCMSLIB00017316426","spectrum_index":49886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 12.9946 Da; putative annotation: N/A; putative formula: C22H32N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.07,"smiles":null,"spectrum_id":"CCMSLIB00017316427","spectrum_index":49887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 182.0556 Da; putative annotation: N/A; putative formula: C13H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.131,"smiles":null,"spectrum_id":"CCMSLIB00017316428","spectrum_index":49888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 514.315 Da; putative annotation: N/A; putative formula: C28H50O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.365,"smiles":null,"spectrum_id":"CCMSLIB00017316429","spectrum_index":49889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 73.0532 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.15,"smiles":null,"spectrum_id":"CCMSLIB00017316430","spectrum_index":49890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 138.5729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.722,"smiles":null,"spectrum_id":"CCMSLIB00017316431","spectrum_index":49891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 194.1422 Da; putative annotation: N/A; putative formula: C11H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.223,"smiles":null,"spectrum_id":"CCMSLIB00017316432","spectrum_index":49892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 441.257 Da; putative annotation: N/A; putative formula: C32H31N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.317,"smiles":null,"spectrum_id":"CCMSLIB00017316433","spectrum_index":49893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 84.0574 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.117,"smiles":null,"spectrum_id":"CCMSLIB00017316434","spectrum_index":49894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 133.0527 Da; putative annotation: N/A; putative formula: C8H7NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017316435","spectrum_index":49895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 495.1958 Da; putative annotation: N/A; putative formula: C23H34N3O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.293,"smiles":null,"spectrum_id":"CCMSLIB00017316436","spectrum_index":49896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geissolaevine (delta mass: 14.0256 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.154,"smiles":null,"spectrum_id":"CCMSLIB00017316437","spectrum_index":49897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 125.0461 Da; putative annotation: N/A; putative formula: C2H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.132,"smiles":null,"spectrum_id":"CCMSLIB00017316438","spectrum_index":49898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 208.0797 Da; putative annotation: N/A; putative formula: C7H17N2OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.233,"smiles":null,"spectrum_id":"CCMSLIB00017316439","spectrum_index":49899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 403.2219 Da; putative annotation: N/A; putative formula: C20H29N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.287,"smiles":null,"spectrum_id":"CCMSLIB00017316440","spectrum_index":49900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 269.1233 Da; putative annotation: N/A; putative formula: C9H15N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.183,"smiles":null,"spectrum_id":"CCMSLIB00017316441","spectrum_index":49901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 268.1573 Da; putative annotation: N/A; putative formula: C17H20N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.285,"smiles":null,"spectrum_id":"CCMSLIB00017316442","spectrum_index":49902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 444.2674 Da; putative annotation: N/A; putative formula: C23H36N6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.365,"smiles":null,"spectrum_id":"CCMSLIB00017316443","spectrum_index":49903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 345.1099 Da; putative annotation: N/A; putative formula: C14H16N7O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.196,"smiles":null,"spectrum_id":"CCMSLIB00017316444","spectrum_index":49904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 72.0213 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.081,"smiles":null,"spectrum_id":"CCMSLIB00017316445","spectrum_index":49905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.165,"smiles":null,"spectrum_id":"CCMSLIB00017316446","spectrum_index":49906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 51.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.144,"smiles":null,"spectrum_id":"CCMSLIB00017316447","spectrum_index":49907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 4.9136 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.984,"smiles":null,"spectrum_id":"CCMSLIB00017316448","spectrum_index":49908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ketogluconic acid methyl ester (delta mass: 187.136 Da; putative annotation: N/A; putative formula: C13H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.202,"smiles":null,"spectrum_id":"CCMSLIB00017316449","spectrum_index":49909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 87.0177 Da; putative annotation: N/A; putative formula: HN5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.193,"smiles":null,"spectrum_id":"CCMSLIB00017316450","spectrum_index":49910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ361907 Ecgonine-methyl-ester (EME)|Ecgonine methyl ester|Methyl 3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate (delta mass: 64.0311 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.159,"smiles":null,"spectrum_id":"CCMSLIB00017316451","spectrum_index":49911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 146.1453 Da; putative annotation: N/A; putative formula: C12H18O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.211,"smiles":null,"spectrum_id":"CCMSLIB00017316452","spectrum_index":49912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 204.101 Da; putative annotation: N/A; putative formula: C10H12N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.166,"smiles":null,"spectrum_id":"CCMSLIB00017316453","spectrum_index":49913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 482.8499 Da; putative annotation: N/A; putative formula: C9H13N3O2S9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.91,"smiles":null,"spectrum_id":"CCMSLIB00017316454","spectrum_index":49914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,3-DIAMINOPROPANE\"\" (delta mass: 13.0204 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":88.1121,"smiles":null,"spectrum_id":"CCMSLIB00017316455","spectrum_index":49915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vincosamide (delta mass: 180.0693 Da; putative annotation: N/A; putative formula: C4H14N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.277,"smiles":null,"spectrum_id":"CCMSLIB00017316456","spectrum_index":49916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 494.2487 Da; putative annotation: N/A; putative formula: C32H35N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":719.361,"smiles":null,"spectrum_id":"CCMSLIB00017316457","spectrum_index":49917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 175.0872 Da; putative annotation: N/A; putative formula: C6H14N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.133,"smiles":null,"spectrum_id":"CCMSLIB00017316458","spectrum_index":49918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 82.0054 Da; putative annotation: N/A; putative formula: C4H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.081,"smiles":null,"spectrum_id":"CCMSLIB00017316459","spectrum_index":49919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 64.9955 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.155,"smiles":null,"spectrum_id":"CCMSLIB00017316460","spectrum_index":49920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 63.0783 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.16,"smiles":null,"spectrum_id":"CCMSLIB00017316461","spectrum_index":49921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 278.167 Da; putative annotation: N/A; putative formula: C20H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.269,"smiles":null,"spectrum_id":"CCMSLIB00017316462","spectrum_index":49922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 831.5972 Da; putative annotation: N/A; putative formula: C47H81N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":997.72,"smiles":null,"spectrum_id":"CCMSLIB00017316463","spectrum_index":49923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 88.0168 Da; putative annotation: N/A; putative formula: C4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.071,"smiles":null,"spectrum_id":"CCMSLIB00017316464","spectrum_index":49924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 145.0415 Da; putative annotation: N/A; putative formula: C3H7N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.159,"smiles":null,"spectrum_id":"CCMSLIB00017316465","spectrum_index":49925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 218.2025 Da; putative annotation: N/A; putative formula: C16H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.299,"smiles":null,"spectrum_id":"CCMSLIB00017316466","spectrum_index":49926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 88.0167 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.166,"smiles":null,"spectrum_id":"CCMSLIB00017316467","spectrum_index":49927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 273.2668 Da; putative annotation: N/A; putative formula: C12H31N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.337,"smiles":null,"spectrum_id":"CCMSLIB00017316468","spectrum_index":49928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 599.3356 Da; putative annotation: N/A; putative formula: C36H45N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.5,"smiles":null,"spectrum_id":"CCMSLIB00017316469","spectrum_index":49929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 68.0266 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017316470","spectrum_index":49930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 36.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.164,"smiles":null,"spectrum_id":"CCMSLIB00017316471","spectrum_index":49931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 90.0105 Da; putative annotation: N/A; putative formula: C6H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.134,"smiles":null,"spectrum_id":"CCMSLIB00017316472","spectrum_index":49932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 69.0411 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.08,"smiles":null,"spectrum_id":"CCMSLIB00017316473","spectrum_index":49933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 359.1762 Da; putative annotation: N/A; putative formula: C19H26N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.313,"smiles":null,"spectrum_id":"CCMSLIB00017316474","spectrum_index":49934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LSD (delta mass: 369.2042 Da; putative annotation: N/A; putative formula: C21H27N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.411,"smiles":null,"spectrum_id":"CCMSLIB00017316475","spectrum_index":49935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 462.3904 Da; putative annotation: N/A; putative formula: C23H46N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":793.544,"smiles":null,"spectrum_id":"CCMSLIB00017316476","spectrum_index":49936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 91.0392 Da; putative annotation: N/A; putative formula: CH5N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.162,"smiles":null,"spectrum_id":"CCMSLIB00017316477","spectrum_index":49937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 154.0965 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.177,"smiles":null,"spectrum_id":"CCMSLIB00017316478","spectrum_index":49938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 43.09 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.187,"smiles":null,"spectrum_id":"CCMSLIB00017316479","spectrum_index":49939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 101.0302 Da; putative annotation: N/A; putative formula: C4H7NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.085,"smiles":null,"spectrum_id":"CCMSLIB00017316480","spectrum_index":49940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 44.0279 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.14,"smiles":null,"spectrum_id":"CCMSLIB00017316481","spectrum_index":49941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 28.9789 Da; putative annotation: N/A; putative formula: NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.081,"smiles":null,"spectrum_id":"CCMSLIB00017316482","spectrum_index":49942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 801.0122 Da; putative annotation: N/A; putative formula: C33H27N3O9S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1023.11,"smiles":null,"spectrum_id":"CCMSLIB00017316483","spectrum_index":49943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 148.161 Da; putative annotation: N/A; putative formula: C12H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.226,"smiles":null,"spectrum_id":"CCMSLIB00017316484","spectrum_index":49944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 132.0892 Da; putative annotation: N/A; putative formula: C5H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.154,"smiles":null,"spectrum_id":"CCMSLIB00017316485","spectrum_index":49945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 175.0483 Da; putative annotation: N/A; putative formula: C6H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.135,"smiles":null,"spectrum_id":"CCMSLIB00017316486","spectrum_index":49946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 237.1621 Da; putative annotation: N/A; putative formula: C16H19N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.331,"smiles":null,"spectrum_id":"CCMSLIB00017316487","spectrum_index":49947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 311.0773 Da; putative annotation: N/A; putative formula: C10H18NO8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.165,"smiles":null,"spectrum_id":"CCMSLIB00017316488","spectrum_index":49948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU203901 10,11-trans-Dihydroxy-10,11-dihydrocarbamazepine|(10s,11s)-10,11-dihydroxy-10,11-dihydro-5h-dibenzo[b,f]azepine-5-carboxamide|(5S,6S)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 197.1233 Da; putative annotation: N/A; putative formula: C11H19NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.231,"smiles":null,"spectrum_id":"CCMSLIB00017316489","spectrum_index":49949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 395.2768 Da; putative annotation: N/A; putative formula: C25H37N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.311,"smiles":null,"spectrum_id":"CCMSLIB00017316490","spectrum_index":49950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 58.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.144,"smiles":null,"spectrum_id":"CCMSLIB00017316491","spectrum_index":49951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Lys from NIST14 (delta mass: 228.1118 Da; putative annotation: N/A; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.309,"smiles":null,"spectrum_id":"CCMSLIB00017316492","spectrum_index":49952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-dihydrolysergol (delta mass: 57.9145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.079,"smiles":null,"spectrum_id":"CCMSLIB00017316493","spectrum_index":49953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 8.0112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.057,"smiles":null,"spectrum_id":"CCMSLIB00017316494","spectrum_index":49954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 26.9886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017316495","spectrum_index":49955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amorfrutin 2 (delta mass: 84.0896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.28,"smiles":null,"spectrum_id":"CCMSLIB00017316496","spectrum_index":49956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 258.1985 Da; putative annotation: N/A; putative formula: C18H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.28,"smiles":null,"spectrum_id":"CCMSLIB00017316497","spectrum_index":49957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 387.1736 Da; putative annotation: N/A; putative formula: C27H21N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.26,"smiles":null,"spectrum_id":"CCMSLIB00017316498","spectrum_index":49958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 1.9837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.059,"smiles":null,"spectrum_id":"CCMSLIB00017316499","spectrum_index":49959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 66.0468 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.284,"smiles":null,"spectrum_id":"CCMSLIB00017316500","spectrum_index":49960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal (delta mass: 41.9882 Da; putative annotation: N/A; putative formula: C5H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.038,"smiles":null,"spectrum_id":"CCMSLIB00017316501","spectrum_index":49961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.gamma.-Glutamyl-L-glutamic acid (delta mass: 68.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.134,"smiles":null,"spectrum_id":"CCMSLIB00017316502","spectrum_index":49962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,4-butanediol (delta mass: 45.988 Da; putative annotation: N/A; putative formula: CH2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.079,"smiles":null,"spectrum_id":"CCMSLIB00017316503","spectrum_index":49963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Pyrenecarboxylic acid (delta mass: 16.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.106,"smiles":null,"spectrum_id":"CCMSLIB00017316504","spectrum_index":49964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imazaquin (delta mass: 248.1036 Da; putative annotation: N/A; putative formula: C8H17N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.238,"smiles":null,"spectrum_id":"CCMSLIB00017316505","spectrum_index":49965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 131.0375 Da; putative annotation: N/A; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.119,"smiles":null,"spectrum_id":"CCMSLIB00017316506","spectrum_index":49966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005787 Indole-3-carboxylic acid|1H-indole-3-carboxylic acid (delta mass: 111.1048 Da; putative annotation: N/A; putative formula: C7H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.16,"smiles":null,"spectrum_id":"CCMSLIB00017316507","spectrum_index":49967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 28.9751 Da; putative annotation: N/A; putative formula: C13H18N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.102,"smiles":null,"spectrum_id":"CCMSLIB00017316508","spectrum_index":49968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 57.0675 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.185,"smiles":null,"spectrum_id":"CCMSLIB00017316509","spectrum_index":49969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 84.0582 Da; putative annotation: Tetrahydro-3-furanylmethanol; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.186,"smiles":null,"spectrum_id":"CCMSLIB00017316510","spectrum_index":49970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 268.0371 Da; putative annotation: Luteolin; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.166,"smiles":null,"spectrum_id":"CCMSLIB00017316511","spectrum_index":49971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Phe from NIST14 (delta mass: 113.0849 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.203,"smiles":null,"spectrum_id":"CCMSLIB00017316512","spectrum_index":49972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 92.0261 Da; putative annotation: HYDROQUINONE; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.097,"smiles":null,"spectrum_id":"CCMSLIB00017316513","spectrum_index":49973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 149.0822 Da; putative annotation: Methyldopamine; putative formula: C9H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.168,"smiles":null,"spectrum_id":"CCMSLIB00017316514","spectrum_index":49974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 129.0414 Da; putative annotation: L-Glutamic acid; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.165,"smiles":null,"spectrum_id":"CCMSLIB00017316515","spectrum_index":49975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 254.0939 Da; putative annotation: 3-(2-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-7-ol; putative formula: C16H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017316516","spectrum_index":49976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 99.0301 Da; putative annotation: N/A; putative formula: HN7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.153,"smiles":null,"spectrum_id":"CCMSLIB00017316517","spectrum_index":49977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoajmaline (delta mass: 74.044 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.251,"smiles":null,"spectrum_id":"CCMSLIB00017316518","spectrum_index":49978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 26.067 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.127,"smiles":null,"spectrum_id":"CCMSLIB00017316519","spectrum_index":49979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 11.0076 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.131,"smiles":null,"spectrum_id":"CCMSLIB00017316520","spectrum_index":49980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 196.2196 Da; putative annotation: N/A; putative formula: C14H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.369,"smiles":null,"spectrum_id":"CCMSLIB00017316521","spectrum_index":49981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 142.0785 Da; putative annotation: N/A; putative formula: C11H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.139,"smiles":null,"spectrum_id":"CCMSLIB00017316522","spectrum_index":49982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 109.1153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.238,"smiles":null,"spectrum_id":"CCMSLIB00017316523","spectrum_index":49983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine ethyl ester (delta mass: 82.0861 Da; putative annotation: N/A; putative formula: C5H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.23,"smiles":null,"spectrum_id":"CCMSLIB00017316524","spectrum_index":49984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 53.0269 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017316525","spectrum_index":49985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 364.1234 Da; putative annotation: N/A; putative formula: C14H27N2O3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.235,"smiles":null,"spectrum_id":"CCMSLIB00017316526","spectrum_index":49986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 244.1787 Da; putative annotation: N/A; putative formula: C12H24N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.301,"smiles":null,"spectrum_id":"CCMSLIB00017316527","spectrum_index":49987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 277.216 Da; putative annotation: N/A; putative formula: C16H27N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.328,"smiles":null,"spectrum_id":"CCMSLIB00017316528","spectrum_index":49988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 242.0217 Da; putative annotation: N/A; putative formula: C13H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.071,"smiles":null,"spectrum_id":"CCMSLIB00017316529","spectrum_index":49989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 257.1017 Da; putative annotation: N/A; putative formula: C12H22NO-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.188,"smiles":null,"spectrum_id":"CCMSLIB00017316530","spectrum_index":49990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 107.0256 Da; putative annotation: N/A; putative formula: CH6N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.128,"smiles":null,"spectrum_id":"CCMSLIB00017316531","spectrum_index":49991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 50.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.17,"smiles":null,"spectrum_id":"CCMSLIB00017316532","spectrum_index":49992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy-5-pentyl-2-prenylphenol (delta mass: 50.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017316533","spectrum_index":49993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 146.0729 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.123,"smiles":null,"spectrum_id":"CCMSLIB00017316534","spectrum_index":49994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 381.2526 Da; putative annotation: N/A; putative formula: C22H31N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.323,"smiles":null,"spectrum_id":"CCMSLIB00017316535","spectrum_index":49995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 298.0474 Da; putative annotation: N/A; putative formula: C11H15N4PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.171,"smiles":null,"spectrum_id":"CCMSLIB00017316536","spectrum_index":49996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 240.1878 Da; putative annotation: N/A; putative formula: C18H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.311,"smiles":null,"spectrum_id":"CCMSLIB00017316537","spectrum_index":49997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 42.0582 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.139,"smiles":null,"spectrum_id":"CCMSLIB00017316538","spectrum_index":49998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 249.2879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.4,"smiles":null,"spectrum_id":"CCMSLIB00017316539","spectrum_index":49999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 74.0728 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.133,"smiles":null,"spectrum_id":"CCMSLIB00017316540","spectrum_index":50000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 25.9922 Da; putative annotation: N/A; putative formula: H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.094,"smiles":null,"spectrum_id":"CCMSLIB00017316541","spectrum_index":50001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 222.089 Da; putative annotation: N/A; putative formula: C12H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.169,"smiles":null,"spectrum_id":"CCMSLIB00017316542","spectrum_index":50002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 350.1591 Da; putative annotation: N/A; putative formula: C16H22N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.24,"smiles":null,"spectrum_id":"CCMSLIB00017316543","spectrum_index":50003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 959.3061 Da; putative annotation: N/A; putative formula: C60H52NO5P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1163.37,"smiles":null,"spectrum_id":"CCMSLIB00017316544","spectrum_index":50004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 45.0125 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.114,"smiles":null,"spectrum_id":"CCMSLIB00017316545","spectrum_index":50005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of E-N-Deoxyfructosyllysine (delta mass: 95.0733 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.239,"smiles":null,"spectrum_id":"CCMSLIB00017316546","spectrum_index":50006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptamine (delta mass: 227.0951 Da; putative annotation: N/A; putative formula: C7H13N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.213,"smiles":null,"spectrum_id":"CCMSLIB00017316547","spectrum_index":50007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 179.1514 Da; putative annotation: N/A; putative formula: C9H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.217,"smiles":null,"spectrum_id":"CCMSLIB00017316548","spectrum_index":50008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Difluoromethoxy)-1H-indole-2-carboxylic acid (delta mass: 35.9712 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.018,"smiles":null,"spectrum_id":"CCMSLIB00017316549","spectrum_index":50009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 139.0463 Da; putative annotation: N/A; putative formula: HN11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.195,"smiles":null,"spectrum_id":"CCMSLIB00017316550","spectrum_index":50010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 246.2331 Da; putative annotation: N/A; putative formula: C18H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.304,"smiles":null,"spectrum_id":"CCMSLIB00017316551","spectrum_index":50011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000479 Dopamine|4-(2-aminoethyl)benzene-1,2-diol (delta mass: 96.0576 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017316552","spectrum_index":50012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 54.0472 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.139,"smiles":null,"spectrum_id":"CCMSLIB00017316553","spectrum_index":50013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(5-Chloro-2-methyl-1H-indol-3-yl)ethanamine (delta mass: 56.06 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.144,"smiles":null,"spectrum_id":"CCMSLIB00017316554","spectrum_index":50014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-5-hydroxytryptamine (delta mass: 186.1361 Da; putative annotation: N/A; putative formula: C9H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.254,"smiles":null,"spectrum_id":"CCMSLIB00017316555","spectrum_index":50015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pycnarrhine (delta mass: 25.0064 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.108,"smiles":null,"spectrum_id":"CCMSLIB00017316556","spectrum_index":50016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 244.5056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.665,"smiles":null,"spectrum_id":"CCMSLIB00017316557","spectrum_index":50017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 127.9191 Da; putative annotation: N/A; putative formula: C4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.005,"smiles":null,"spectrum_id":"CCMSLIB00017316558","spectrum_index":50018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 369.2078 Da; putative annotation: N/A; putative formula: C20H28N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.284,"smiles":null,"spectrum_id":"CCMSLIB00017316559","spectrum_index":50019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PT200730 D(+)-Galacturonic acid monohydrate|D-galacturonate|(2S,3R,4S,5R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid (delta mass: 147.0682 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.118,"smiles":null,"spectrum_id":"CCMSLIB00017316560","spectrum_index":50020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 66.9882 Da; putative annotation: N/A; putative formula: C3HNO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.069,"smiles":null,"spectrum_id":"CCMSLIB00017316561","spectrum_index":50021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 516.3299 Da; putative annotation: N/A; putative formula: C27H48O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.379,"smiles":null,"spectrum_id":"CCMSLIB00017316562","spectrum_index":50022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lys-Ile from NIST14 (delta mass: 113.0592 Da; putative annotation: N/A; putative formula: C4H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.256,"smiles":null,"spectrum_id":"CCMSLIB00017316563","spectrum_index":50023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine (delta mass: 16.1988 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.348,"smiles":null,"spectrum_id":"CCMSLIB00017316564","spectrum_index":50024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 238.0835 Da; putative annotation: N/A; putative formula: C12H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.196,"smiles":null,"spectrum_id":"CCMSLIB00017316565","spectrum_index":50025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00512 Isatin (delta mass: 64.0161 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.055,"smiles":null,"spectrum_id":"CCMSLIB00017316566","spectrum_index":50026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 258.1694 Da; putative annotation: N/A; putative formula: C11H22N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.272,"smiles":null,"spectrum_id":"CCMSLIB00017316567","spectrum_index":50027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 164.0927 Da; putative annotation: N/A; putative formula: C5H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.2,"smiles":null,"spectrum_id":"CCMSLIB00017316568","spectrum_index":50028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 229.1408 Da; putative annotation: N/A; putative formula: C6H15N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.296,"smiles":null,"spectrum_id":"CCMSLIB00017316569","spectrum_index":50029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Trifluoromethyl)-1H-indole-2-carboxylic acid (delta mass: 168.1941 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.236,"smiles":null,"spectrum_id":"CCMSLIB00017316570","spectrum_index":50030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[8-(2-Hydroxypropan-2-yl)-3-methoxycarbonyl-3,4a,7,10a-tetramethyl-5-methylidene-1,4-dioxo-6,6a,8,9,10,10b-hexahydrobenzo[h]isochromen-7-yl]propanoic acid (delta mass: 36.036 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.3,"smiles":null,"spectrum_id":"CCMSLIB00017316571","spectrum_index":50031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 323.1736 Da; putative annotation: N/A; putative formula: C17H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.254,"smiles":null,"spectrum_id":"CCMSLIB00017316572","spectrum_index":50032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 846.2825 Da; putative annotation: N/A; putative formula: C55H42O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1189.41,"smiles":null,"spectrum_id":"CCMSLIB00017316573","spectrum_index":50033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-5-thiazoleethanol (delta mass: 57.0622 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.11,"smiles":null,"spectrum_id":"CCMSLIB00017316574","spectrum_index":50034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 97.0544 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.13,"smiles":null,"spectrum_id":"CCMSLIB00017316575","spectrum_index":50035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 73.0052 Da; putative annotation: N/A; putative formula: C4H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017316576","spectrum_index":50036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 703.5236 Da; putative annotation: N/A; putative formula: C43H71N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.584,"smiles":null,"spectrum_id":"CCMSLIB00017316577","spectrum_index":50037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin///(-)-citrinin CollisionEnergy:205060 (delta mass: 465.1866 Da; putative annotation: N/A; putative formula: C20H37NO5P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":716.278,"smiles":null,"spectrum_id":"CCMSLIB00017316578","spectrum_index":50038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-[4-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triaz ol-3-ylthio]acetamide CollisionEnergy:102040\"\" (delta mass: 105.1185 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.236,"smiles":null,"spectrum_id":"CCMSLIB00017316579","spectrum_index":50039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 45.9779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.033,"smiles":null,"spectrum_id":"CCMSLIB00017316580","spectrum_index":50040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 174.1242 Da; putative annotation: N/A; putative formula: C5H14N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.257,"smiles":null,"spectrum_id":"CCMSLIB00017316581","spectrum_index":50041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 118.0059 Da; putative annotation: N/A; putative formula: H2N6S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.071,"smiles":null,"spectrum_id":"CCMSLIB00017316582","spectrum_index":50042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 176.0838 Da; putative annotation: N/A; putative formula: C11H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.222,"smiles":null,"spectrum_id":"CCMSLIB00017316583","spectrum_index":50043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 34.02 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.179,"smiles":null,"spectrum_id":"CCMSLIB00017316584","spectrum_index":50044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carbonitrile (delta mass: 190.0988 Da; putative annotation: N/A; putative formula: C6H15N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.159,"smiles":null,"spectrum_id":"CCMSLIB00017316585","spectrum_index":50045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 160.0882 Da; putative annotation: N/A; putative formula: C5H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017316586","spectrum_index":50046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paprotrain (delta mass: 16.9999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.103,"smiles":null,"spectrum_id":"CCMSLIB00017316587","spectrum_index":50047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 42.8651 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.951,"smiles":null,"spectrum_id":"CCMSLIB00017316588","spectrum_index":50048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 305.0782 Da; putative annotation: N/A; putative formula: C11H20N3OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.19,"smiles":null,"spectrum_id":"CCMSLIB00017316589","spectrum_index":50049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 120.9925 Da; putative annotation: N/A; putative formula: C2H4NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.246,"smiles":null,"spectrum_id":"CCMSLIB00017316590","spectrum_index":50050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 46.0052 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.086,"smiles":null,"spectrum_id":"CCMSLIB00017316591","spectrum_index":50051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 18.0405 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.164,"smiles":null,"spectrum_id":"CCMSLIB00017316592","spectrum_index":50052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 218.0568 Da; putative annotation: N/A; putative formula: C6H11N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.221,"smiles":null,"spectrum_id":"CCMSLIB00017316593","spectrum_index":50053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 106.0527 Da; putative annotation: N/A; putative formula: C6H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.228,"smiles":null,"spectrum_id":"CCMSLIB00017316594","spectrum_index":50054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 198.0739 Da; putative annotation: N/A; putative formula: C9H15N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.181,"smiles":null,"spectrum_id":"CCMSLIB00017316595","spectrum_index":50055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 305.148 Da; putative annotation: N/A; putative formula: C16H24N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.302,"smiles":null,"spectrum_id":"CCMSLIB00017316596","spectrum_index":50056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmaline (delta mass: 213.0432 Da; putative annotation: N/A; putative formula: C5H7N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.161,"smiles":null,"spectrum_id":"CCMSLIB00017316597","spectrum_index":50057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 74.0208 Da; putative annotation: N/A; putative formula: C3H6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.075,"smiles":null,"spectrum_id":"CCMSLIB00017316598","spectrum_index":50058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 123.1144 Da; putative annotation: N/A; putative formula: C7H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.154,"smiles":null,"spectrum_id":"CCMSLIB00017316599","spectrum_index":50059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 104.0702 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.219,"smiles":null,"spectrum_id":"CCMSLIB00017316600","spectrum_index":50060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 75.0561 Da; putative annotation: N/A; putative formula: H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.147,"smiles":null,"spectrum_id":"CCMSLIB00017316601","spectrum_index":50061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 13.029 Da; putative annotation: N/A; putative formula: CH3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.178,"smiles":null,"spectrum_id":"CCMSLIB00017316602","spectrum_index":50062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 117.0768 Da; putative annotation: N/A; putative formula: CH7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.216,"smiles":null,"spectrum_id":"CCMSLIB00017316603","spectrum_index":50063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 140.0471 Da; putative annotation: N/A; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017316604","spectrum_index":50064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 257.185 Da; putative annotation: N/A; putative formula: C11H23N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.276,"smiles":null,"spectrum_id":"CCMSLIB00017316605","spectrum_index":50065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 414.2091 Da; putative annotation: N/A; putative formula: C22H30N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.327,"smiles":null,"spectrum_id":"CCMSLIB00017316606","spectrum_index":50066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hexanoylhomoserine (delta mass: 45.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.196,"smiles":null,"spectrum_id":"CCMSLIB00017316607","spectrum_index":50067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine (delta mass: 23.0049 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.117,"smiles":null,"spectrum_id":"CCMSLIB00017316608","spectrum_index":50068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 170.0943 Da; putative annotation: N/A; putative formula: C9H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.264,"smiles":null,"spectrum_id":"CCMSLIB00017316609","spectrum_index":50069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 688.6436 Da; putative annotation: N/A; putative formula: C49H85O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":874.715,"smiles":null,"spectrum_id":"CCMSLIB00017316610","spectrum_index":50070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 550.2822 Da; putative annotation: N/A; putative formula: C17H26N24O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.447,"smiles":null,"spectrum_id":"CCMSLIB00017316611","spectrum_index":50071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 210.1312 Da; putative annotation: N/A; putative formula: C10H18N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.249,"smiles":null,"spectrum_id":"CCMSLIB00017316612","spectrum_index":50072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 34.0305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.138,"smiles":null,"spectrum_id":"CCMSLIB00017316613","spectrum_index":50073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 98.0369 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.117,"smiles":null,"spectrum_id":"CCMSLIB00017316614","spectrum_index":50074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 224.1778 Da; putative annotation: N/A; putative formula: C14H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.254,"smiles":null,"spectrum_id":"CCMSLIB00017316615","spectrum_index":50075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 46.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.123,"smiles":null,"spectrum_id":"CCMSLIB00017316616","spectrum_index":50076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-MANNOSAMINE (delta mass: 64.0118 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.098,"smiles":null,"spectrum_id":"CCMSLIB00017316617","spectrum_index":50077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Arg-Arg (delta mass: 312.1789 Da; putative annotation: N/A; putative formula: C14H24N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.5,"smiles":null,"spectrum_id":"CCMSLIB00017316618","spectrum_index":50078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cephradine (delta mass: 18.1052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.222,"smiles":null,"spectrum_id":"CCMSLIB00017316619","spectrum_index":50079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1,N1-dimethyl-N2-phenyl-1,2-ethanediamine (delta mass: 37.9538 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.092,"smiles":null,"spectrum_id":"CCMSLIB00017316620","spectrum_index":50080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 126.1087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.191,"smiles":null,"spectrum_id":"CCMSLIB00017316621","spectrum_index":50081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 83.0731 Da; putative annotation: N/A; putative formula: C5H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.206,"smiles":null,"spectrum_id":"CCMSLIB00017316622","spectrum_index":50082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 101.0109 Da; putative annotation: N/A; putative formula: C3H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.093,"smiles":null,"spectrum_id":"CCMSLIB00017316623","spectrum_index":50083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 51.0211 Da; putative annotation: N/A; putative formula: C2HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.123,"smiles":null,"spectrum_id":"CCMSLIB00017316624","spectrum_index":50084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of emetine (delta mass: 35.0291 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.335,"smiles":null,"spectrum_id":"CCMSLIB00017316625","spectrum_index":50085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 113.0523 Da; putative annotation: N/A; putative formula: C4H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.106,"smiles":null,"spectrum_id":"CCMSLIB00017316626","spectrum_index":50086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 41.0838 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.259,"smiles":null,"spectrum_id":"CCMSLIB00017316627","spectrum_index":50087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 146.0728 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.148,"smiles":null,"spectrum_id":"CCMSLIB00017316628","spectrum_index":50088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 186.0315 Da; putative annotation: N/A; putative formula: C11H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.092,"smiles":null,"spectrum_id":"CCMSLIB00017316629","spectrum_index":50089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 72.0364 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.096,"smiles":null,"spectrum_id":"CCMSLIB00017316630","spectrum_index":50090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 31.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.097,"smiles":null,"spectrum_id":"CCMSLIB00017316631","spectrum_index":50091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-5-carboxylic acid (delta mass: 27.0725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.128,"smiles":null,"spectrum_id":"CCMSLIB00017316632","spectrum_index":50092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 30.0107 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.118,"smiles":null,"spectrum_id":"CCMSLIB00017316633","spectrum_index":50093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 86.059 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.234,"smiles":null,"spectrum_id":"CCMSLIB00017316634","spectrum_index":50094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 268.1293 Da; putative annotation: N/A; putative formula: C11H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.283,"smiles":null,"spectrum_id":"CCMSLIB00017316635","spectrum_index":50095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 358.0715 Da; putative annotation: N/A; putative formula: C20H14N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.158,"smiles":null,"spectrum_id":"CCMSLIB00017316636","spectrum_index":50096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 124.0732 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017316637","spectrum_index":50097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 76.0308 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017316638","spectrum_index":50098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ332502 Epinephrine|4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol (delta mass: 282.1118 Da; putative annotation: N/A; putative formula: C15H14N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.209,"smiles":null,"spectrum_id":"CCMSLIB00017316639","spectrum_index":50099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380791-01!methyl 3,7,8-trihydroxy-3-methyl-10-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylate (delta mass: 42.0056 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.082,"smiles":null,"spectrum_id":"CCMSLIB00017316640","spectrum_index":50100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 130.0915 Da; putative annotation: N/A; putative formula: C7H15P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.199,"smiles":null,"spectrum_id":"CCMSLIB00017316641","spectrum_index":50101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 193.0741 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.129,"smiles":null,"spectrum_id":"CCMSLIB00017316642","spectrum_index":50102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 111.0683 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017316643","spectrum_index":50103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 341.2301 Da; putative annotation: N/A; putative formula: C21H31N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.327,"smiles":null,"spectrum_id":"CCMSLIB00017316644","spectrum_index":50104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PAR_146.0966_8.3 (delta mass: 99.1036 Da; putative annotation: N/A; putative formula: C6H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017316645","spectrum_index":50105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 126.083 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.31,"smiles":null,"spectrum_id":"CCMSLIB00017316646","spectrum_index":50106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 232.1424 Da; putative annotation: 5a-Hydroxy-1,7,7-trimethyl-1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene-4-carboxylic acid; putative formula: C15H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.292,"smiles":null,"spectrum_id":"CCMSLIB00017316647","spectrum_index":50107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 154.0994 Da; putative annotation: (2E)-4-Hydroxynon-2-enoic acid; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.206,"smiles":null,"spectrum_id":"CCMSLIB00017316648","spectrum_index":50108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 248.1414 Da; putative annotation: 2-((1S,3aR,4S,6S,7R,8aR)-1-Hydroxy-4,8a-dimethyloctahydro-1H-3a,6-epoxyazulen-7-yl)prop-2-enoic acid; putative formula: C15H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.202,"smiles":null,"spectrum_id":"CCMSLIB00017316649","spectrum_index":50109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 142.1094 Da; putative annotation: L-.beta.-Homolysine; putative formula: C7H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.211,"smiles":null,"spectrum_id":"CCMSLIB00017316650","spectrum_index":50110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 148.089 Da; putative annotation: 5-Hydroxyadamantan-2-one; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.201,"smiles":null,"spectrum_id":"CCMSLIB00017316651","spectrum_index":50111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 308.1114 Da; putative annotation: (2S)-3-phenyl-2-[2-(phenylcarbonylamino)acetylamino]propanoic acid CollisionEnergy:102040; putative formula: C18H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.198,"smiles":null,"spectrum_id":"CCMSLIB00017316652","spectrum_index":50112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indolmycin (delta mass: 439.266 Da; putative annotation: N/A; putative formula: C26H37N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.39,"smiles":null,"spectrum_id":"CCMSLIB00017316653","spectrum_index":50113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 315.1312 Da; putative annotation: N/A; putative formula: C18H23NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.217,"smiles":null,"spectrum_id":"CCMSLIB00017316654","spectrum_index":50114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 212.0687 Da; putative annotation: N/A; putative formula: C10H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.181,"smiles":null,"spectrum_id":"CCMSLIB00017316655","spectrum_index":50115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 72.0406 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.111,"smiles":null,"spectrum_id":"CCMSLIB00017316656","spectrum_index":50116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 157.0358 Da; putative annotation: N/A; putative formula: C10H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.122,"smiles":null,"spectrum_id":"CCMSLIB00017316657","spectrum_index":50117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tabernanthalog (delta mass: 104.0113 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.16,"smiles":null,"spectrum_id":"CCMSLIB00017316658","spectrum_index":50118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 270.0521 Da; putative annotation: N/A; putative formula: C15H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.181,"smiles":null,"spectrum_id":"CCMSLIB00017316659","spectrum_index":50119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 110.0688 Da; putative annotation: N/A; putative formula: C3H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.228,"smiles":null,"spectrum_id":"CCMSLIB00017316660","spectrum_index":50120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 84.0281 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.12,"smiles":null,"spectrum_id":"CCMSLIB00017316661","spectrum_index":50121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 40.0533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.119,"smiles":null,"spectrum_id":"CCMSLIB00017316662","spectrum_index":50122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 285.1401 Da; putative annotation: N/A; putative formula: C14H23NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.305,"smiles":null,"spectrum_id":"CCMSLIB00017316663","spectrum_index":50123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 185.2058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.332,"smiles":null,"spectrum_id":"CCMSLIB00017316664","spectrum_index":50124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 20.0 eV (delta mass: 437.4599 Da; putative annotation: N/A; putative formula: C29H59NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.536,"smiles":null,"spectrum_id":"CCMSLIB00017316665","spectrum_index":50125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 218.1228 Da; putative annotation: N/A; putative formula: C14H19P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.292,"smiles":null,"spectrum_id":"CCMSLIB00017316666","spectrum_index":50126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00938 Curcumin (delta mass: 330.3667 Da; putative annotation: N/A; putative formula: C25H46O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.5,"smiles":null,"spectrum_id":"CCMSLIB00017316667","spectrum_index":50127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 102.0533 Da; putative annotation: N/A; putative formula: C2H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.155,"smiles":null,"spectrum_id":"CCMSLIB00017316668","spectrum_index":50128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 877.394 Da; putative annotation: N/A; putative formula: C53H55N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1040.45,"smiles":null,"spectrum_id":"CCMSLIB00017316669","spectrum_index":50129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 198.0488 Da; putative annotation: N/A; putative formula: C4H10N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.14,"smiles":null,"spectrum_id":"CCMSLIB00017316670","spectrum_index":50130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 29.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.154,"smiles":null,"spectrum_id":"CCMSLIB00017316671","spectrum_index":50131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 10.9032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017316672","spectrum_index":50132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 126.046 Da; putative annotation: N/A; putative formula: C4H7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.2,"smiles":null,"spectrum_id":"CCMSLIB00017316673","spectrum_index":50133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 2.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.153,"smiles":null,"spectrum_id":"CCMSLIB00017316674","spectrum_index":50134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 194.1156 Da; putative annotation: N/A; putative formula: C9H14N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.239,"smiles":null,"spectrum_id":"CCMSLIB00017316675","spectrum_index":50135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dichlorokynurenic acid (delta mass: 19.2432 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.215,"smiles":null,"spectrum_id":"CCMSLIB00017316676","spectrum_index":50136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 250.2283 Da; putative annotation: N/A; putative formula: C13H26N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.281,"smiles":null,"spectrum_id":"CCMSLIB00017316677","spectrum_index":50137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 953.3221 Da; putative annotation: N/A; putative formula: C51H58NO11P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1116.38,"smiles":null,"spectrum_id":"CCMSLIB00017316678","spectrum_index":50138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 16.0622 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.138,"smiles":null,"spectrum_id":"CCMSLIB00017316679","spectrum_index":50139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 401.1686 Da; putative annotation: N/A; putative formula: C16H15N15O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.244,"smiles":null,"spectrum_id":"CCMSLIB00017316680","spectrum_index":50140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 113.0841 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.217,"smiles":null,"spectrum_id":"CCMSLIB00017316681","spectrum_index":50141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 413.2359 Da; putative annotation: N/A; putative formula: C21H39N3O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.312,"smiles":null,"spectrum_id":"CCMSLIB00017316682","spectrum_index":50142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 385.1813 Da; putative annotation: N/A; putative formula: C22H28NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":666.335,"smiles":null,"spectrum_id":"CCMSLIB00017316683","spectrum_index":50143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 255.09 Da; putative annotation: N/A; putative formula: C15H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.214,"smiles":null,"spectrum_id":"CCMSLIB00017316684","spectrum_index":50144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 26.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.149,"smiles":null,"spectrum_id":"CCMSLIB00017316685","spectrum_index":50145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 111.1403 Da; putative annotation: N/A; putative formula: C8H17NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.237,"smiles":null,"spectrum_id":"CCMSLIB00017316686","spectrum_index":50146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 226.1697 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.293,"smiles":null,"spectrum_id":"CCMSLIB00017316687","spectrum_index":50147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 25.0195 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.08,"smiles":null,"spectrum_id":"CCMSLIB00017316688","spectrum_index":50148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 122.0836 Da; putative annotation: N/A; putative formula: C7H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.175,"smiles":null,"spectrum_id":"CCMSLIB00017316689","spectrum_index":50149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.06,"smiles":null,"spectrum_id":"CCMSLIB00017316690","spectrum_index":50150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 33.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.149,"smiles":null,"spectrum_id":"CCMSLIB00017316691","spectrum_index":50151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 108.0222 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.14,"smiles":null,"spectrum_id":"CCMSLIB00017316692","spectrum_index":50152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00160283-01!1-(8-Quinolinyl)-beta-carboline (delta mass: 259.1283 Da; putative annotation: N/A; putative formula: C9H17N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.247,"smiles":null,"spectrum_id":"CCMSLIB00017316693","spectrum_index":50153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 428.3525 Da; putative annotation: N/A; putative formula: C24H49N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.434,"smiles":null,"spectrum_id":"CCMSLIB00017316694","spectrum_index":50154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 126.1407 Da; putative annotation: N/A; putative formula: C9H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.221,"smiles":null,"spectrum_id":"CCMSLIB00017316695","spectrum_index":50155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 676.4653 Da; putative annotation: N/A; putative formula: C43H60N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.547,"smiles":null,"spectrum_id":"CCMSLIB00017316696","spectrum_index":50156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 253.1888 Da; putative annotation: N/A; putative formula: C8H19N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.301,"smiles":null,"spectrum_id":"CCMSLIB00017316697","spectrum_index":50157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 162.0607 Da; putative annotation: N/A; putative formula: C9H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.158,"smiles":null,"spectrum_id":"CCMSLIB00017316698","spectrum_index":50158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 146.0586 Da; putative annotation: N/A; putative formula: C7H14O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.182,"smiles":null,"spectrum_id":"CCMSLIB00017316699","spectrum_index":50159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid (delta mass: 17.0275 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.145,"smiles":null,"spectrum_id":"CCMSLIB00017316700","spectrum_index":50160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 241.0082 Da; putative annotation: N/A; putative formula: C6H3N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.147,"smiles":null,"spectrum_id":"CCMSLIB00017316701","spectrum_index":50161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 128.0831 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.159,"smiles":null,"spectrum_id":"CCMSLIB00017316702","spectrum_index":50162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 113.084 Da; putative annotation: N/A; putative formula: C6H11NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.165,"smiles":null,"spectrum_id":"CCMSLIB00017316703","spectrum_index":50163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 166.9584 Da; putative annotation: N/A; putative formula: C6H2NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.045,"smiles":null,"spectrum_id":"CCMSLIB00017316704","spectrum_index":50164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 296.0535 Da; putative annotation: N/A; putative formula: C8H9N8O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.151,"smiles":null,"spectrum_id":"CCMSLIB00017316705","spectrum_index":50165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl 4-(1H-indol-4-yl)piperazine-1-carboxylate (delta mass: 18.0125 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.199,"smiles":null,"spectrum_id":"CCMSLIB00017316706","spectrum_index":50166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Leu from NIST14 (delta mass: 69.0578 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.207,"smiles":null,"spectrum_id":"CCMSLIB00017316707","spectrum_index":50167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 77.0728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.175,"smiles":null,"spectrum_id":"CCMSLIB00017316708","spectrum_index":50168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 56.071 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.158,"smiles":null,"spectrum_id":"CCMSLIB00017316709","spectrum_index":50169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine - 30.0 eV (delta mass: 158.0577 Da; putative annotation: N/A; putative formula: C7H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.144,"smiles":null,"spectrum_id":"CCMSLIB00017316710","spectrum_index":50170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 276.8045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.902,"smiles":null,"spectrum_id":"CCMSLIB00017316711","spectrum_index":50171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 167.126 Da; putative annotation: N/A; putative formula: C6H13N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.249,"smiles":null,"spectrum_id":"CCMSLIB00017316712","spectrum_index":50172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 21.8943 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.981,"smiles":null,"spectrum_id":"CCMSLIB00017316713","spectrum_index":50173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 329.195 Da; putative annotation: N/A; putative formula: C15H27N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.339,"smiles":null,"spectrum_id":"CCMSLIB00017316714","spectrum_index":50174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100215 alpha-Methyl-DL-serine|DL-2-Methylserine|2-Amino-3-hydroxy-2-methylpropanoic Acid|DL-2-Amino-3-hydroxy-2-methylpropionic Acid|DL-alpha-(Hydroxymethyl)alanine|alpha-Methylserine (delta mass: 282.2571 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.323,"smiles":null,"spectrum_id":"CCMSLIB00017316715","spectrum_index":50175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 904.4731 Da; putative annotation: N/A; putative formula: C43H68N8O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1058.56,"smiles":null,"spectrum_id":"CCMSLIB00017316716","spectrum_index":50176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 59.0772 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.195,"smiles":null,"spectrum_id":"CCMSLIB00017316717","spectrum_index":50177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 50.0404 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.174,"smiles":null,"spectrum_id":"CCMSLIB00017316718","spectrum_index":50178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 67.078 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.164,"smiles":null,"spectrum_id":"CCMSLIB00017316719","spectrum_index":50179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 226.1686 Da; putative annotation: N/A; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.292,"smiles":null,"spectrum_id":"CCMSLIB00017316720","spectrum_index":50180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 327.973 Da; putative annotation: N/A; putative formula: C12H10O5P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.033,"smiles":null,"spectrum_id":"CCMSLIB00017316721","spectrum_index":50181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,2,3,4-Tetrahydro-9H-carbazol-9-yl)propanohydrazide (delta mass: 128.1129 Da; putative annotation: N/A; putative formula: C8H17O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.273,"smiles":null,"spectrum_id":"CCMSLIB00017316722","spectrum_index":50182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 74.0394 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.094,"smiles":null,"spectrum_id":"CCMSLIB00017316723","spectrum_index":50183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 86.0324 Da; putative annotation: N/A; putative formula: H2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.155,"smiles":null,"spectrum_id":"CCMSLIB00017316724","spectrum_index":50184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 337.1375 Da; putative annotation: N/A; putative formula: C16H24N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.271,"smiles":null,"spectrum_id":"CCMSLIB00017316725","spectrum_index":50185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ajmalicine (delta mass: 350.0657 Da; putative annotation: N/A; putative formula: C10H10N10O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.252,"smiles":null,"spectrum_id":"CCMSLIB00017316726","spectrum_index":50186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 406.1467 Da; putative annotation: N/A; putative formula: C30H18N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.233,"smiles":null,"spectrum_id":"CCMSLIB00017316727","spectrum_index":50187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 718.3828 Da; putative annotation: N/A; putative formula: C39H42N16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":898.469,"smiles":null,"spectrum_id":"CCMSLIB00017316728","spectrum_index":50188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4.alpha.-Mannobiose (delta mass: 635.2317 Da; putative annotation: N/A; putative formula: C42H37NOS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":978.355,"smiles":null,"spectrum_id":"CCMSLIB00017316729","spectrum_index":50189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 56.0627 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.232,"smiles":null,"spectrum_id":"CCMSLIB00017316730","spectrum_index":50190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 324.1092 Da; putative annotation: N/A; putative formula: C12H25N2O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1297.43,"smiles":null,"spectrum_id":"CCMSLIB00017316731","spectrum_index":50191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 45.0216 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.092,"smiles":null,"spectrum_id":"CCMSLIB00017316732","spectrum_index":50192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 255.1687 Da; putative annotation: N/A; putative formula: C11H21N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.234,"smiles":null,"spectrum_id":"CCMSLIB00017316733","spectrum_index":50193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 127.1096 Da; putative annotation: N/A; putative formula: C6H13N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.19,"smiles":null,"spectrum_id":"CCMSLIB00017316734","spectrum_index":50194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-1,3-thiazol-2-ylamine (delta mass: 77.0541 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.113,"smiles":null,"spectrum_id":"CCMSLIB00017316735","spectrum_index":50195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Aminopropyl)-4-methyl-2-nitroaniline (delta mass: 13.0092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017316736","spectrum_index":50196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 975.7258 Da; putative annotation: N/A; putative formula: C55H93N9O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1359.88,"smiles":null,"spectrum_id":"CCMSLIB00017316737","spectrum_index":50197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 737.4877 Da; putative annotation: N/A; putative formula: C45H71NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":870.564,"smiles":null,"spectrum_id":"CCMSLIB00017316738","spectrum_index":50198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 67.0419 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.107,"smiles":null,"spectrum_id":"CCMSLIB00017316739","spectrum_index":50199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 193.1107 Da; putative annotation: N/A; putative formula: C11H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.191,"smiles":null,"spectrum_id":"CCMSLIB00017316740","spectrum_index":50200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 9.0429 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.197,"smiles":null,"spectrum_id":"CCMSLIB00017316741","spectrum_index":50201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 307.0816 Da; putative annotation: N/A; putative formula: C14H9N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.21,"smiles":null,"spectrum_id":"CCMSLIB00017316742","spectrum_index":50202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 546.309 Da; putative annotation: N/A; putative formula: C25H46N4O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.395,"smiles":null,"spectrum_id":"CCMSLIB00017316743","spectrum_index":50203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 142.2191 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.311,"smiles":null,"spectrum_id":"CCMSLIB00017316744","spectrum_index":50204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 163.0719 Da; putative annotation: N/A; putative formula: C4H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.173,"smiles":null,"spectrum_id":"CCMSLIB00017316745","spectrum_index":50205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 64.0677 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.222,"smiles":null,"spectrum_id":"CCMSLIB00017316746","spectrum_index":50206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 422.1948 Da; putative annotation: N/A; putative formula: C15H30N6O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.292,"smiles":null,"spectrum_id":"CCMSLIB00017316747","spectrum_index":50207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1166.1886 Da; putative annotation: N/A; putative formula: C54H46N12O7S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1388.29,"smiles":null,"spectrum_id":"CCMSLIB00017316748","spectrum_index":50208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 262.1554 Da; putative annotation: N/A; putative formula: C10H23N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.216,"smiles":null,"spectrum_id":"CCMSLIB00017316749","spectrum_index":50209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 82.9928 Da; putative annotation: N/A; putative formula: C3H2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.147,"smiles":null,"spectrum_id":"CCMSLIB00017316750","spectrum_index":50210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 137.0477 Da; putative annotation: N/A; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017316751","spectrum_index":50211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose - 30.0 eV (delta mass: 521.1872 Da; putative annotation: N/A; putative formula: C29H31NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1026.36,"smiles":null,"spectrum_id":"CCMSLIB00017316752","spectrum_index":50212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 59.0248 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.148,"smiles":null,"spectrum_id":"CCMSLIB00017316753","spectrum_index":50213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 789.6646 Da; putative annotation: N/A; putative formula: C53H83N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1011.76,"smiles":null,"spectrum_id":"CCMSLIB00017316754","spectrum_index":50214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 252.1526 Da; putative annotation: N/A; putative formula: C11H20N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":757.329,"smiles":null,"spectrum_id":"CCMSLIB00017316755","spectrum_index":50215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 1130.5356 Da; putative annotation: N/A; putative formula: C49H74N14O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1311.61,"smiles":null,"spectrum_id":"CCMSLIB00017316756","spectrum_index":50216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 161.0688 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.155,"smiles":null,"spectrum_id":"CCMSLIB00017316757","spectrum_index":50217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 538.5047 Da; putative annotation: N/A; putative formula: C29H62N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":698.58,"smiles":null,"spectrum_id":"CCMSLIB00017316758","spectrum_index":50218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381050-01!7-(5,7-dimethoxy-4-oxochromen-2-yl)-6-hydroxyheptanoic acid [IIN-based: Match] (delta mass: 14.0192 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.163,"smiles":null,"spectrum_id":"CCMSLIB00017316759","spectrum_index":50219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpyridin-4-ylamine (delta mass: 15.0092 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.085,"smiles":null,"spectrum_id":"CCMSLIB00017316760","spectrum_index":50220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Feruloylputrescine (delta mass: 205.1108 Da; putative annotation: N/A; putative formula: C12H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.266,"smiles":null,"spectrum_id":"CCMSLIB00017316761","spectrum_index":50221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 244.0708 Da; putative annotation: N/A; putative formula: C10H8N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.142,"smiles":null,"spectrum_id":"CCMSLIB00017316762","spectrum_index":50222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 60.026 Da; putative annotation: N/A; putative formula: CH5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.08,"smiles":null,"spectrum_id":"CCMSLIB00017316763","spectrum_index":50223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 320.3073 Da; putative annotation: N/A; putative formula: C22H40O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.425,"smiles":null,"spectrum_id":"CCMSLIB00017316764","spectrum_index":50224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (R)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol (delta mass: 324.1069 Da; putative annotation: N/A; putative formula: C13H16N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.24,"smiles":null,"spectrum_id":"CCMSLIB00017316765","spectrum_index":50225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 331.1984 Da; putative annotation: N/A; putative formula: C20H31NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":660.373,"smiles":null,"spectrum_id":"CCMSLIB00017316766","spectrum_index":50226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diphenyl(4-piperidinyl)methanol (delta mass: 109.0404 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.21,"smiles":null,"spectrum_id":"CCMSLIB00017316767","spectrum_index":50227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 195.1283 Da; putative annotation: N/A; putative formula: C10H18N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.22,"smiles":null,"spectrum_id":"CCMSLIB00017316768","spectrum_index":50228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 145.0527 Da; putative annotation: N/A; putative formula: C9H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.139,"smiles":null,"spectrum_id":"CCMSLIB00017316769","spectrum_index":50229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyltyramine (delta mass: 32.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.133,"smiles":null,"spectrum_id":"CCMSLIB00017316770","spectrum_index":50230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 50.016 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.139,"smiles":null,"spectrum_id":"CCMSLIB00017316771","spectrum_index":50231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 229.0951 Da; putative annotation: N/A; putative formula: C10H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.134,"smiles":null,"spectrum_id":"CCMSLIB00017316772","spectrum_index":50232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 162.051 Da; putative annotation: N/A; putative formula: C3H2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.143,"smiles":null,"spectrum_id":"CCMSLIB00017316773","spectrum_index":50233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 98.0329 Da; putative annotation: N/A; putative formula: CH2N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.156,"smiles":null,"spectrum_id":"CCMSLIB00017316774","spectrum_index":50234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 69.0651 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.161,"smiles":null,"spectrum_id":"CCMSLIB00017316775","spectrum_index":50235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 18.9948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.196,"smiles":null,"spectrum_id":"CCMSLIB00017316776","spectrum_index":50236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381050-01!7-(5,7-dimethoxy-4-oxochromen-2-yl)-6-hydroxyheptanoic acid [IIN-based: Match] (delta mass: 35.0356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.179,"smiles":null,"spectrum_id":"CCMSLIB00017316777","spectrum_index":50237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 247.1042 Da; putative annotation: N/A; putative formula: C14H19NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.228,"smiles":null,"spectrum_id":"CCMSLIB00017316778","spectrum_index":50238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 97.0517 Da; putative annotation: Massbank:CE000635 Proline; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.122,"smiles":null,"spectrum_id":"CCMSLIB00017316779","spectrum_index":50239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 161.0847 Da; putative annotation: .beta.-Phenyl-.gamma.-aminobutyric acid; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.155,"smiles":null,"spectrum_id":"CCMSLIB00017316780","spectrum_index":50240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 260.2135 Da; putative annotation: gamma-linolenic acid; putative formula: C18H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.279,"smiles":null,"spectrum_id":"CCMSLIB00017316781","spectrum_index":50241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 924.5091 Da; putative annotation: (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8aR,9R,12aS,14bR)-9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid; putative formula: C48H76O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1077.58,"smiles":null,"spectrum_id":"CCMSLIB00017316782","spectrum_index":50242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 127.0436 Da; putative annotation: 1H-Indole-4-carboxaldehyde; putative formula: C9H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.119,"smiles":null,"spectrum_id":"CCMSLIB00017316783","spectrum_index":50243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of D-Gluconic acid (delta mass: 56.0737 Da; putative annotation: \"\"1,3-DIAMINOPROPANE\"\"; putative formula: C3H8N2O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.139,"smiles":null,"spectrum_id":"CCMSLIB00017316784","spectrum_index":50244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 312.2662 Da; putative annotation: 2-Palmitoyl-rac-glycerol; putative formula: C19H36O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.326,"smiles":null,"spectrum_id":"CCMSLIB00017316785","spectrum_index":50245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 144.0424 Da; putative annotation: 3-Hydroxy-3-methylglutaric acid; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.113,"smiles":null,"spectrum_id":"CCMSLIB00017316786","spectrum_index":50246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 145.0732 Da; putative annotation: Deoxygalactonojirimycin; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.149,"smiles":null,"spectrum_id":"CCMSLIB00017316787","spectrum_index":50247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 180.0782 Da; putative annotation: Modiolide A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.227,"smiles":null,"spectrum_id":"CCMSLIB00017316788","spectrum_index":50248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 258.2307 Da; putative annotation: 5.alpha.-Androstan-3.beta.-ol; putative formula: C19H30)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.364,"smiles":null,"spectrum_id":"CCMSLIB00017316789","spectrum_index":50249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 182.0614 Da; putative annotation: N/A; putative formula: C8H11N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.121,"smiles":null,"spectrum_id":"CCMSLIB00017316790","spectrum_index":50250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 90.0334 Da; putative annotation: N/A; putative formula: C4H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.12,"smiles":null,"spectrum_id":"CCMSLIB00017316791","spectrum_index":50251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 148.0529 Da; putative annotation: N/A; putative formula: C2H8N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.15,"smiles":null,"spectrum_id":"CCMSLIB00017316792","spectrum_index":50252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy Mirtazapine (delta mass: 60.0404 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.201,"smiles":null,"spectrum_id":"CCMSLIB00017316793","spectrum_index":50253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 180.129 Da; putative annotation: N/A; putative formula: C15H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.403,"smiles":null,"spectrum_id":"CCMSLIB00017316794","spectrum_index":50254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin D (delta mass: 101.0684 Da; putative annotation: N/A; putative formula: C2H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.332,"smiles":null,"spectrum_id":"CCMSLIB00017316795","spectrum_index":50255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dereplicator+ Identification - Serratiochelin (delta mass: 141.0797 Da; putative annotation: N/A; putative formula: C7H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.241,"smiles":null,"spectrum_id":"CCMSLIB00017316796","spectrum_index":50256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 80.0628 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.305,"smiles":null,"spectrum_id":"CCMSLIB00017316797","spectrum_index":50257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 270.0744 Da; putative annotation: N/A; putative formula: C15H15N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.15,"smiles":null,"spectrum_id":"CCMSLIB00017316798","spectrum_index":50258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 220.1826 Da; putative annotation: N/A; putative formula: C15H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.279,"smiles":null,"spectrum_id":"CCMSLIB00017316799","spectrum_index":50259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 100.9325 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.035,"smiles":null,"spectrum_id":"CCMSLIB00017316800","spectrum_index":50260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-1-(4-phenoxyphenyl)methanamine (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.185,"smiles":null,"spectrum_id":"CCMSLIB00017316801","spectrum_index":50261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 40.0308 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.112,"smiles":null,"spectrum_id":"CCMSLIB00017316802","spectrum_index":50262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 195.0519 Da; putative annotation: N/A; putative formula: C13H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.133,"smiles":null,"spectrum_id":"CCMSLIB00017316803","spectrum_index":50263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 247.2303 Da; putative annotation: N/A; putative formula: C17H29N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.343,"smiles":null,"spectrum_id":"CCMSLIB00017316804","spectrum_index":50264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 320.2349 Da; putative annotation: N/A; putative formula: C20H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.331,"smiles":null,"spectrum_id":"CCMSLIB00017316805","spectrum_index":50265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 380.2784 Da; putative annotation: N/A; putative formula: C20H36N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.344,"smiles":null,"spectrum_id":"CCMSLIB00017316806","spectrum_index":50266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 407.2048 Da; putative annotation: N/A; putative formula: C22H34NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.27,"smiles":null,"spectrum_id":"CCMSLIB00017316807","spectrum_index":50267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyltapentadol (delta mass: 88.0243 Da; putative annotation: N/A; putative formula: C2H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.194,"smiles":null,"spectrum_id":"CCMSLIB00017316808","spectrum_index":50268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 26.9739 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.102,"smiles":null,"spectrum_id":"CCMSLIB00017316809","spectrum_index":50269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 96.0785 Da; putative annotation: N/A; putative formula: C4H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.159,"smiles":null,"spectrum_id":"CCMSLIB00017316810","spectrum_index":50270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Methyl-1-piperazinyl)butanoic acid (delta mass: 79.0504 Da; putative annotation: N/A; putative formula: C4H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.194,"smiles":null,"spectrum_id":"CCMSLIB00017316811","spectrum_index":50271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-3-pyridazinol (delta mass: 161.0563 Da; putative annotation: N/A; putative formula: C4H3N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.112,"smiles":null,"spectrum_id":"CCMSLIB00017316812","spectrum_index":50272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"Benzo[a]phenanthridine-10,11-diol, 5,6,6a,7,8,12b-hexahydro-, trans- [CAS]\"\" (delta mass: 34.0521 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.185,"smiles":null,"spectrum_id":"CCMSLIB00017316813","spectrum_index":50273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 737.3609 Da; putative annotation: N/A; putative formula: C34H47N11O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":875.452,"smiles":null,"spectrum_id":"CCMSLIB00017316814","spectrum_index":50274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 127.0537 Da; putative annotation: N/A; putative formula: C8H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.14,"smiles":null,"spectrum_id":"CCMSLIB00017316815","spectrum_index":50275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 162.104 Da; putative annotation: N/A; putative formula: C11H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.263,"smiles":null,"spectrum_id":"CCMSLIB00017316816","spectrum_index":50276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-.alpha.-Acetyl-L-ornithine (delta mass: 154.1351 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.243,"smiles":null,"spectrum_id":"CCMSLIB00017316817","spectrum_index":50277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 371.1702 Da; putative annotation: N/A; putative formula: C17H29N3O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":673.234,"smiles":null,"spectrum_id":"CCMSLIB00017316818","spectrum_index":50278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 148.0717 Da; putative annotation: N/A; putative formula: C10H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.21,"smiles":null,"spectrum_id":"CCMSLIB00017316819","spectrum_index":50279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 40.0315 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.154,"smiles":null,"spectrum_id":"CCMSLIB00017316820","spectrum_index":50280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA256107 Gabapentin|1-(Aminomethyl)cyclohexaneacetic acid| 2-[1-(aminomethyl)cyclohexyl]acetic acid (delta mass: 66.0568 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.19,"smiles":null,"spectrum_id":"CCMSLIB00017316821","spectrum_index":50281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 265.0581 Da; putative annotation: N/A; putative formula: C6H12N5O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.149,"smiles":null,"spectrum_id":"CCMSLIB00017316822","spectrum_index":50282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 217.0851 Da; putative annotation: N/A; putative formula: C11H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.124,"smiles":null,"spectrum_id":"CCMSLIB00017316823","spectrum_index":50283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)- (delta mass: 144.0857 Da; putative annotation: N/A; putative formula: C5H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.155,"smiles":null,"spectrum_id":"CCMSLIB00017316824","spectrum_index":50284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 16.0272 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":153.062,"smiles":null,"spectrum_id":"CCMSLIB00017316825","spectrum_index":50285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 148.0627 Da; putative annotation: N/A; putative formula: C8H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.145,"smiles":null,"spectrum_id":"CCMSLIB00017316826","spectrum_index":50286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 266.2598 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.341,"smiles":null,"spectrum_id":"CCMSLIB00017316827","spectrum_index":50287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 60.0567 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.226,"smiles":null,"spectrum_id":"CCMSLIB00017316828","spectrum_index":50288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380746-01!1,7-bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 42.0053 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.18,"smiles":null,"spectrum_id":"CCMSLIB00017316829","spectrum_index":50289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 699.2575 Da; putative annotation: N/A; putative formula: C33H41N5O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":862.318,"smiles":null,"spectrum_id":"CCMSLIB00017316830","spectrum_index":50290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 115.0196 Da; putative annotation: N/A; putative formula: C3H5N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.09,"smiles":null,"spectrum_id":"CCMSLIB00017316831","spectrum_index":50291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 455.2827 Da; putative annotation: N/A; putative formula: C24H45N3O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.447,"smiles":null,"spectrum_id":"CCMSLIB00017316832","spectrum_index":50292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 80.0628 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.139,"smiles":null,"spectrum_id":"CCMSLIB00017316833","spectrum_index":50293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olaquindox (delta mass: 180.0736 Da; putative annotation: N/A; putative formula: C2H4N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.172,"smiles":null,"spectrum_id":"CCMSLIB00017316834","spectrum_index":50294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Heptyl-4-hydroxyquinoline N-oxide (delta mass: 61.9647 Da; putative annotation: N/A; putative formula: CH2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.129,"smiles":null,"spectrum_id":"CCMSLIB00017316835","spectrum_index":50295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 88.0521 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.18,"smiles":null,"spectrum_id":"CCMSLIB00017316836","spectrum_index":50296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 31.9905 Da; putative annotation: N/A; putative formula: O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.051,"smiles":null,"spectrum_id":"CCMSLIB00017316837","spectrum_index":50297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Aminobutyl)hydroxylamine (delta mass: 179.0698 Da; putative annotation: N/A; putative formula: C8H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.172,"smiles":null,"spectrum_id":"CCMSLIB00017316838","spectrum_index":50298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 58.0055 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017316839","spectrum_index":50299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 503.3418 Da; putative annotation: N/A; putative formula: C34H41N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.418,"smiles":null,"spectrum_id":"CCMSLIB00017316840","spectrum_index":50300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 40.9818 Da; putative annotation: N/A; putative formula: CNO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.089,"smiles":null,"spectrum_id":"CCMSLIB00017316841","spectrum_index":50301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000514 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 55.0447 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.115,"smiles":null,"spectrum_id":"CCMSLIB00017316842","spectrum_index":50302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 56.0656 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.162,"smiles":null,"spectrum_id":"CCMSLIB00017316843","spectrum_index":50303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 34.065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.141,"smiles":null,"spectrum_id":"CCMSLIB00017316844","spectrum_index":50304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 267.1779 Da; putative annotation: N/A; putative formula: C14H25N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.306,"smiles":null,"spectrum_id":"CCMSLIB00017316845","spectrum_index":50305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 122.0733 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.16,"smiles":null,"spectrum_id":"CCMSLIB00017316846","spectrum_index":50306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of E-N-Deoxyfructosyllysine (delta mass: 146.0999 Da; putative annotation: N/A; putative formula: C5H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.266,"smiles":null,"spectrum_id":"CCMSLIB00017316847","spectrum_index":50307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 106.065 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.203,"smiles":null,"spectrum_id":"CCMSLIB00017316848","spectrum_index":50308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 15.9396 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.015,"smiles":null,"spectrum_id":"CCMSLIB00017316849","spectrum_index":50309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 668.3473 Da; putative annotation: N/A; putative formula: C30H57N2O10PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":970.486,"smiles":null,"spectrum_id":"CCMSLIB00017316850","spectrum_index":50310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 64.0145 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.168,"smiles":null,"spectrum_id":"CCMSLIB00017316851","spectrum_index":50311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 301.6932 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.817,"smiles":null,"spectrum_id":"CCMSLIB00017316852","spectrum_index":50312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 1178.4777 Da; putative annotation: N/A; putative formula: C55H74N10O15S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1316.57,"smiles":null,"spectrum_id":"CCMSLIB00017316853","spectrum_index":50313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 106.0408 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.153,"smiles":null,"spectrum_id":"CCMSLIB00017316854","spectrum_index":50314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 278.2253 Da; putative annotation: N/A; putative formula: C18H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.29,"smiles":null,"spectrum_id":"CCMSLIB00017316855","spectrum_index":50315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100335 D-Mannose-6-phosphate|Man-6P|6-phosphono-D-mannopyranose (delta mass: 383.3406 Da; putative annotation: N/A; putative formula: C23H45NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.378,"smiles":null,"spectrum_id":"CCMSLIB00017316856","spectrum_index":50316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 651.415 Da; putative annotation: N/A; putative formula: C40H53N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.491,"smiles":null,"spectrum_id":"CCMSLIB00017316857","spectrum_index":50317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Peucenin (delta mass: 188.1231 Da; putative annotation: N/A; putative formula: C10H20OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.235,"smiles":null,"spectrum_id":"CCMSLIB00017316858","spectrum_index":50318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 312.2295 Da; putative annotation: N/A; putative formula: C18H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.279,"smiles":null,"spectrum_id":"CCMSLIB00017316859","spectrum_index":50319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 210.1096 Da; putative annotation: N/A; putative formula: C12H20O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.191,"smiles":null,"spectrum_id":"CCMSLIB00017316860","spectrum_index":50320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 64.0055 Da; putative annotation: N/A; putative formula: C3N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.121,"smiles":null,"spectrum_id":"CCMSLIB00017316861","spectrum_index":50321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paprotrain (delta mass: 78.0565 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.159,"smiles":null,"spectrum_id":"CCMSLIB00017316862","spectrum_index":50322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 142.1137 Da; putative annotation: N/A; putative formula: C12H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.341,"smiles":null,"spectrum_id":"CCMSLIB00017316863","spectrum_index":50323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380084-01_C21H30O4_Benzo[b]cyclopenta[e]pyran-8(3H)-one, 3a,5,6,7,9,9a-hexahydro-7-hydroxy-1-[(4E)-6-hydroxy-1,5-dimethyl-4-hexen-1-yl]-3a-methyl- (delta mass: 62.0522 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.274,"smiles":null,"spectrum_id":"CCMSLIB00017316864","spectrum_index":50324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 41.0264 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.081,"smiles":null,"spectrum_id":"CCMSLIB00017316865","spectrum_index":50325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 144.0395 Da; putative annotation: N/A; putative formula: C2H4N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.204,"smiles":null,"spectrum_id":"CCMSLIB00017316866","spectrum_index":50326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 309.9601 Da; putative annotation: N/A; putative formula: C11H2O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.02,"smiles":null,"spectrum_id":"CCMSLIB00017316867","spectrum_index":50327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tryptophol (delta mass: 225.0895 Da; putative annotation: N/A; putative formula: C13H11N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.181,"smiles":null,"spectrum_id":"CCMSLIB00017316868","spectrum_index":50328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10-Hydroxycarbazepine (delta mass: 174.1354 Da; putative annotation: N/A; putative formula: C8H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.248,"smiles":null,"spectrum_id":"CCMSLIB00017316869","spectrum_index":50329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 64.0383 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.125,"smiles":null,"spectrum_id":"CCMSLIB00017316870","spectrum_index":50330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 521.2258 Da; putative annotation: N/A; putative formula: C39H27N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.312,"smiles":null,"spectrum_id":"CCMSLIB00017316871","spectrum_index":50331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 152.0579 Da; putative annotation: N/A; putative formula: C7H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.118,"smiles":null,"spectrum_id":"CCMSLIB00017316872","spectrum_index":50332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 126.0316 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.15,"smiles":null,"spectrum_id":"CCMSLIB00017316873","spectrum_index":50333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 195.128 Da; putative annotation: N/A; putative formula: C10H18N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.225,"smiles":null,"spectrum_id":"CCMSLIB00017316874","spectrum_index":50334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 145.0733 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.165,"smiles":null,"spectrum_id":"CCMSLIB00017316875","spectrum_index":50335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of aloesin (delta mass: 17.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.16,"smiles":null,"spectrum_id":"CCMSLIB00017316876","spectrum_index":50336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 894.3215 Da; putative annotation: N/A; putative formula: C62H46N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1116.42,"smiles":null,"spectrum_id":"CCMSLIB00017316877","spectrum_index":50337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 146.0576 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.144,"smiles":null,"spectrum_id":"CCMSLIB00017316878","spectrum_index":50338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 66.0069 Da; putative annotation: N/A; putative formula: H-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.119,"smiles":null,"spectrum_id":"CCMSLIB00017316879","spectrum_index":50339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 145.0688 Da; putative annotation: N/A; putative formula: C5H11N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.129,"smiles":null,"spectrum_id":"CCMSLIB00017316880","spectrum_index":50340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 88.0523 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.164,"smiles":null,"spectrum_id":"CCMSLIB00017316881","spectrum_index":50341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 345.1587 Da; putative annotation: N/A; putative formula: C20H19N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.297,"smiles":null,"spectrum_id":"CCMSLIB00017316882","spectrum_index":50342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 77.0265 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.097,"smiles":null,"spectrum_id":"CCMSLIB00017316883","spectrum_index":50343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 50.0673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017316884","spectrum_index":50344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 31.4243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017316885","spectrum_index":50345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 43.9904 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.134,"smiles":null,"spectrum_id":"CCMSLIB00017316886","spectrum_index":50346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 184.0788 Da; putative annotation: N/A; putative formula: C7H12N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.16,"smiles":null,"spectrum_id":"CCMSLIB00017316887","spectrum_index":50347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Azacyclonol (delta mass: 94.0265 Da; putative annotation: N/A; putative formula: C3H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.196,"smiles":null,"spectrum_id":"CCMSLIB00017316888","spectrum_index":50348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 260.0733 Da; putative annotation: N/A; putative formula: C12H12N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.25,"smiles":null,"spectrum_id":"CCMSLIB00017316889","spectrum_index":50349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 142.2264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.269,"smiles":null,"spectrum_id":"CCMSLIB00017316890","spectrum_index":50350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 82.161 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.253,"smiles":null,"spectrum_id":"CCMSLIB00017316891","spectrum_index":50351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carboxylic acid (delta mass: 30.9954 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.05,"smiles":null,"spectrum_id":"CCMSLIB00017316892","spectrum_index":50352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of quinine (delta mass: 14.0229 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.214,"smiles":null,"spectrum_id":"CCMSLIB00017316893","spectrum_index":50353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 172.085 Da; putative annotation: N/A; putative formula: C7H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.24,"smiles":null,"spectrum_id":"CCMSLIB00017316894","spectrum_index":50354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 102.0823 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017316895","spectrum_index":50355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 133.1098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.227,"smiles":null,"spectrum_id":"CCMSLIB00017316896","spectrum_index":50356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol CollisionEnergy:102040\"\" (delta mass: 10.0206 Da; putative annotation: N/A; putative formula: C2H2O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.217,"smiles":null,"spectrum_id":"CCMSLIB00017316897","spectrum_index":50357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 78.047 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017316898","spectrum_index":50358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 470.1635 Da; putative annotation: N/A; putative formula: C18H30O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":692.261,"smiles":null,"spectrum_id":"CCMSLIB00017316899","spectrum_index":50359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 275.0387 Da; putative annotation: N/A; putative formula: C8H9N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.099,"smiles":null,"spectrum_id":"CCMSLIB00017316900","spectrum_index":50360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 558.3186 Da; putative annotation: N/A; putative formula: C37H42N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.405,"smiles":null,"spectrum_id":"CCMSLIB00017316901","spectrum_index":50361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-(6,7-Dimethoxyquinazolin-4-yl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]amine (delta mass: 32.0289 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.165,"smiles":null,"spectrum_id":"CCMSLIB00017316902","spectrum_index":50362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoetharine (delta mass: 49.0277 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.187,"smiles":null,"spectrum_id":"CCMSLIB00017316903","spectrum_index":50363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 92.0237 Da; putative annotation: N/A; putative formula: C2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.2,"smiles":null,"spectrum_id":"CCMSLIB00017316904","spectrum_index":50364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 607.3882 Da; putative annotation: N/A; putative formula: C30H53N7O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.464,"smiles":null,"spectrum_id":"CCMSLIB00017316905","spectrum_index":50365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 190.0987 Da; putative annotation: N/A; putative formula: C12H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.18,"smiles":null,"spectrum_id":"CCMSLIB00017316906","spectrum_index":50366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Keto-L-gulonic acid (delta mass: 137.9953 Da; putative annotation: N/A; putative formula: C6H2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.045,"smiles":null,"spectrum_id":"CCMSLIB00017316907","spectrum_index":50367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 130.0743 Da; putative annotation: N/A; putative formula: C5H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.134,"smiles":null,"spectrum_id":"CCMSLIB00017316908","spectrum_index":50368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 172.013 Da; putative annotation: N/A; putative formula: C6H8N2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.078,"smiles":null,"spectrum_id":"CCMSLIB00017316909","spectrum_index":50369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 10.0405 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.088,"smiles":null,"spectrum_id":"CCMSLIB00017316910","spectrum_index":50370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 268.2556 Da; putative annotation: N/A; putative formula: C21H32O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.316,"smiles":null,"spectrum_id":"CCMSLIB00017316911","spectrum_index":50371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 22.987 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.073,"smiles":null,"spectrum_id":"CCMSLIB00017316912","spectrum_index":50372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 91.0486 Da; putative annotation: N/A; putative formula: H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.076,"smiles":null,"spectrum_id":"CCMSLIB00017316913","spectrum_index":50373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 104.0952 Da; putative annotation: N/A; putative formula: H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.52,"smiles":null,"spectrum_id":"CCMSLIB00017316914","spectrum_index":50374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 244.327 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.387,"smiles":null,"spectrum_id":"CCMSLIB00017316915","spectrum_index":50375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 10.9976 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.099,"smiles":null,"spectrum_id":"CCMSLIB00017316916","spectrum_index":50376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 94.0632 Da; putative annotation: N/A; putative formula: C4H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.165,"smiles":null,"spectrum_id":"CCMSLIB00017316917","spectrum_index":50377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthioamphetamine (delta mass: 112.0355 Da; putative annotation: N/A; putative formula: C6H8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.172,"smiles":null,"spectrum_id":"CCMSLIB00017316918","spectrum_index":50378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 340.1744 Da; putative annotation: N/A; putative formula: C15H24N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.25,"smiles":null,"spectrum_id":"CCMSLIB00017316919","spectrum_index":50379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 216.1515 Da; putative annotation: Zizanoic acid; putative formula: C15H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.212,"smiles":null,"spectrum_id":"CCMSLIB00017316920","spectrum_index":50380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 174.0163 Da; putative annotation: Citric acid; putative formula: C6H6O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.076,"smiles":null,"spectrum_id":"CCMSLIB00017316921","spectrum_index":50381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 212.1425 Da; putative annotation: Dodecanedioic acid; putative formula: C12H20O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.208,"smiles":null,"spectrum_id":"CCMSLIB00017316922","spectrum_index":50382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 748.4389 Da; putative annotation: NCGC00347737-02_C41H66O13_Olean-12-en-28-oic acid, 3-[(2-O-beta-D-glucopyranosyl-alpha-L-arabinopyranosyl)oxy]-23-hydroxy-, (5xi,9xi)-; putative formula: C41H64O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.515,"smiles":null,"spectrum_id":"CCMSLIB00017316923","spectrum_index":50383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 294.1104 Da; putative annotation: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[(E)-3-hydroxyprop-1-enyl]phenoxy]oxane-3,4,5-triol; putative formula: C15H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.17,"smiles":null,"spectrum_id":"CCMSLIB00017316924","spectrum_index":50384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 114.0738 Da; putative annotation: N/A; putative formula: CH6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.212,"smiles":null,"spectrum_id":"CCMSLIB00017316925","spectrum_index":50385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 109.0412 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.164,"smiles":null,"spectrum_id":"CCMSLIB00017316926","spectrum_index":50386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 57.3742 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.476,"smiles":null,"spectrum_id":"CCMSLIB00017316927","spectrum_index":50387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eglumegad (delta mass: 9.9848 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.061,"smiles":null,"spectrum_id":"CCMSLIB00017316928","spectrum_index":50388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Gln (delta mass: 128.0585 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.194,"smiles":null,"spectrum_id":"CCMSLIB00017316929","spectrum_index":50389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ACETALDEHYDE (delta mass: 72.079 Da; putative annotation: N/A; putative formula: C2H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.155,"smiles":null,"spectrum_id":"CCMSLIB00017316930","spectrum_index":50390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 157.0741 Da; putative annotation: N/A; putative formula: C7H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.16,"smiles":null,"spectrum_id":"CCMSLIB00017316931","spectrum_index":50391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzylpenicillin_20eV (delta mass: 268.0176 Da; putative annotation: N/A; putative formula: C9H17OPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.124,"smiles":null,"spectrum_id":"CCMSLIB00017316932","spectrum_index":50392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 106.086 Da; putative annotation: N/A; putative formula: C7H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.167,"smiles":null,"spectrum_id":"CCMSLIB00017316933","spectrum_index":50393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha,alpha-Trehalose - 40.0 eV (delta mass: 229.1099 Da; putative annotation: N/A; putative formula: C14H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.233,"smiles":null,"spectrum_id":"CCMSLIB00017316934","spectrum_index":50394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380224-01!1,7-bis(3,4-dihydroxyphenyl)-6-methoxyheptan-3-one (delta mass: 164.0766 Da; putative annotation: N/A; putative formula: CH8N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.241,"smiles":null,"spectrum_id":"CCMSLIB00017316935","spectrum_index":50395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 256.2948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.36,"smiles":null,"spectrum_id":"CCMSLIB00017316936","spectrum_index":50396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Dobutamine (delta mass: 86.0579 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.233,"smiles":null,"spectrum_id":"CCMSLIB00017316937","spectrum_index":50397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 103.0092 Da; putative annotation: N/A; putative formula: C3H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.101,"smiles":null,"spectrum_id":"CCMSLIB00017316938","spectrum_index":50398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 353.2825 Da; putative annotation: N/A; putative formula: C17H36N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.354,"smiles":null,"spectrum_id":"CCMSLIB00017316939","spectrum_index":50399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sulfurol (delta mass: 106.0264 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.074,"smiles":null,"spectrum_id":"CCMSLIB00017316940","spectrum_index":50400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Quinolinecarboxylic acid (delta mass: 175.1318 Da; putative annotation: N/A; putative formula: C7H17N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.187,"smiles":null,"spectrum_id":"CCMSLIB00017316941","spectrum_index":50401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 169.9986 Da; putative annotation: N/A; putative formula: C3H7O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.069,"smiles":null,"spectrum_id":"CCMSLIB00017316942","spectrum_index":50402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 96.0936 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.362,"smiles":null,"spectrum_id":"CCMSLIB00017316943","spectrum_index":50403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Statine (delta mass: 36.0361 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.164,"smiles":null,"spectrum_id":"CCMSLIB00017316944","spectrum_index":50404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Diamino-2-methylpropane (delta mass: 24.9836 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":114.091,"smiles":null,"spectrum_id":"CCMSLIB00017316945","spectrum_index":50405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 86.0518 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.294,"smiles":null,"spectrum_id":"CCMSLIB00017316946","spectrum_index":50406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 468.3137 Da; putative annotation: N/A; putative formula: C24H44N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.442,"smiles":null,"spectrum_id":"CCMSLIB00017316947","spectrum_index":50407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 72.0417 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.18,"smiles":null,"spectrum_id":"CCMSLIB00017316948","spectrum_index":50408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C10:0 (delta mass: 154.1352 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.378,"smiles":null,"spectrum_id":"CCMSLIB00017316949","spectrum_index":50409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 255.2181 Da; putative annotation: N/A; putative formula: C11H25N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.304,"smiles":null,"spectrum_id":"CCMSLIB00017316950","spectrum_index":50410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180705-02!(E)-5-hydroxy-1,7-diphenylhept-1-en-3-one [IIN-based on: CCMSLIB00000845889] (delta mass: 283.2056 Da; putative annotation: N/A; putative formula: C18H25N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.359,"smiles":null,"spectrum_id":"CCMSLIB00017316951","spectrum_index":50411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 77.0485 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.15,"smiles":null,"spectrum_id":"CCMSLIB00017316952","spectrum_index":50412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 127.0505 Da; putative annotation: N/A; putative formula: C3H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.137,"smiles":null,"spectrum_id":"CCMSLIB00017316953","spectrum_index":50413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 168.1516 Da; putative annotation: N/A; putative formula: C11H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.238,"smiles":null,"spectrum_id":"CCMSLIB00017316954","spectrum_index":50414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 200.2138 Da; putative annotation: N/A; putative formula: C9H24N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.3,"smiles":null,"spectrum_id":"CCMSLIB00017316955","spectrum_index":50415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 21.9432 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017316956","spectrum_index":50416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 240.1878 Da; putative annotation: N/A; putative formula: C18H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.311,"smiles":null,"spectrum_id":"CCMSLIB00017316957","spectrum_index":50417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indole-3-carboxamide (delta mass: 104.0373 Da; putative annotation: N/A; putative formula: C6H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.124,"smiles":null,"spectrum_id":"CCMSLIB00017316958","spectrum_index":50418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 41.0381 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.187,"smiles":null,"spectrum_id":"CCMSLIB00017316959","spectrum_index":50419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 211.1511 Da; putative annotation: N/A; putative formula: C11H21N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.274,"smiles":null,"spectrum_id":"CCMSLIB00017316960","spectrum_index":50420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 8.9724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017316961","spectrum_index":50421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 262.0685 Da; putative annotation: N/A; putative formula: C10H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.159,"smiles":null,"spectrum_id":"CCMSLIB00017316962","spectrum_index":50422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 162.0434 Da; putative annotation: N/A; putative formula: C8H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.13,"smiles":null,"spectrum_id":"CCMSLIB00017316963","spectrum_index":50423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 66.047 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.196,"smiles":null,"spectrum_id":"CCMSLIB00017316964","spectrum_index":50424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 95.0584 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.15,"smiles":null,"spectrum_id":"CCMSLIB00017316965","spectrum_index":50425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 242.1265 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.213,"smiles":null,"spectrum_id":"CCMSLIB00017316966","spectrum_index":50426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 316.2143 Da; putative annotation: N/A; putative formula: C19H28N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.29,"smiles":null,"spectrum_id":"CCMSLIB00017316967","spectrum_index":50427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 180.0782 Da; putative annotation: N/A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.143,"smiles":null,"spectrum_id":"CCMSLIB00017316968","spectrum_index":50428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 3-amino-4-methoxyindole-2-carboxylate CollisionEnergy:102040 (delta mass: 29.9985 Da; putative annotation: N/A; putative formula: CH3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.091,"smiles":null,"spectrum_id":"CCMSLIB00017316969","spectrum_index":50429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 102.0472 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.102,"smiles":null,"spectrum_id":"CCMSLIB00017316970","spectrum_index":50430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 228.2088 Da; putative annotation: N/A; putative formula: C14H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.295,"smiles":null,"spectrum_id":"CCMSLIB00017316971","spectrum_index":50431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 388.1222 Da; putative annotation: N/A; putative formula: C16H25N2O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.208,"smiles":null,"spectrum_id":"CCMSLIB00017316972","spectrum_index":50432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Naphthyl)-1H-indole (delta mass: 3.3879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.5,"smiles":null,"spectrum_id":"CCMSLIB00017316973","spectrum_index":50433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 36.9239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.042,"smiles":null,"spectrum_id":"CCMSLIB00017316974","spectrum_index":50434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 23.9982 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.267,"smiles":null,"spectrum_id":"CCMSLIB00017316975","spectrum_index":50435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 16.9879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.131,"smiles":null,"spectrum_id":"CCMSLIB00017316976","spectrum_index":50436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 40.9898 Da; putative annotation: N/A; putative formula: CH-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.159,"smiles":null,"spectrum_id":"CCMSLIB00017316977","spectrum_index":50437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 300.2675 Da; putative annotation: N/A; putative formula: C19H32N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.406,"smiles":null,"spectrum_id":"CCMSLIB00017316978","spectrum_index":50438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 288.2677 Da; putative annotation: N/A; putative formula: C18H32N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.406,"smiles":null,"spectrum_id":"CCMSLIB00017316979","spectrum_index":50439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 619.5008 Da; putative annotation: N/A; putative formula: C39H65N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":782.561,"smiles":null,"spectrum_id":"CCMSLIB00017316980","spectrum_index":50440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 741.415 Da; putative annotation: N/A; putative formula: C40H55N9O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":922.486,"smiles":null,"spectrum_id":"CCMSLIB00017316981","spectrum_index":50441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 95.0718 Da; putative annotation: N/A; putative formula: C6H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.257,"smiles":null,"spectrum_id":"CCMSLIB00017316982","spectrum_index":50442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norbuprenorphine (delta mass: 58.0058 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.27,"smiles":null,"spectrum_id":"CCMSLIB00017316983","spectrum_index":50443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 125.1989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.353,"smiles":null,"spectrum_id":"CCMSLIB00017316984","spectrum_index":50444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alsterpaullone (delta mass: 16.0403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.128,"smiles":null,"spectrum_id":"CCMSLIB00017316985","spectrum_index":50445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 550.2999 Da; putative annotation: N/A; putative formula: C37H43O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.386,"smiles":null,"spectrum_id":"CCMSLIB00017316986","spectrum_index":50446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 132.1758 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.247,"smiles":null,"spectrum_id":"CCMSLIB00017316987","spectrum_index":50447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 161.0456 Da; putative annotation: N/A; putative formula: C5H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.137,"smiles":null,"spectrum_id":"CCMSLIB00017316988","spectrum_index":50448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 27.9229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.092,"smiles":null,"spectrum_id":"CCMSLIB00017316989","spectrum_index":50449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline CollisionEnergy:102040\"\" (delta mass: 42.0155 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.164,"smiles":null,"spectrum_id":"CCMSLIB00017316990","spectrum_index":50450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5,7,8-Tetramethyl-2-(.beta.-carboxyethyl)-6-hydroxychroman (delta mass: 50.0517 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.211,"smiles":null,"spectrum_id":"CCMSLIB00017316991","spectrum_index":50451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 256.0945 Da; putative annotation: N/A; putative formula: C12H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.207,"smiles":null,"spectrum_id":"CCMSLIB00017316992","spectrum_index":50452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 143.0575 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.123,"smiles":null,"spectrum_id":"CCMSLIB00017316993","spectrum_index":50453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(6,7-diethoxy(1,2,3,4-tetrahydroisoquinolyl))-2,4-dimethoxybenzene CollisionEnergy:102040\"\" (delta mass: 343.1302 Da; putative annotation: N/A; putative formula: C16H29NO-1P4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.331,"smiles":null,"spectrum_id":"CCMSLIB00017316994","spectrum_index":50454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 141.0428 Da; putative annotation: N/A; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.103,"smiles":null,"spectrum_id":"CCMSLIB00017316995","spectrum_index":50455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 70.0764 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.183,"smiles":null,"spectrum_id":"CCMSLIB00017316996","spectrum_index":50456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 898.4716 Da; putative annotation: N/A; putative formula: C55H62N8O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1229.63,"smiles":null,"spectrum_id":"CCMSLIB00017316997","spectrum_index":50457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 72.0313 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.128,"smiles":null,"spectrum_id":"CCMSLIB00017316998","spectrum_index":50458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 113.0028 Da; putative annotation: N/A; putative formula: C4H4NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.125,"smiles":null,"spectrum_id":"CCMSLIB00017316999","spectrum_index":50459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 97.0349 Da; putative annotation: N/A; putative formula: C5H7NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.115,"smiles":null,"spectrum_id":"CCMSLIB00017317000","spectrum_index":50460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 389.2421 Da; putative annotation: N/A; putative formula: C20H39NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.354,"smiles":null,"spectrum_id":"CCMSLIB00017317001","spectrum_index":50461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 106.0469 Da; putative annotation: N/A; putative formula: CH6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.211,"smiles":null,"spectrum_id":"CCMSLIB00017317002","spectrum_index":50462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 1164.858 Da; putative annotation: N/A; putative formula: C75H112N4O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1774.13,"smiles":null,"spectrum_id":"CCMSLIB00017317003","spectrum_index":50463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 172.0743 Da; putative annotation: N/A; putative formula: C9H16O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.119,"smiles":null,"spectrum_id":"CCMSLIB00017317004","spectrum_index":50464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 69.94 Da; putative annotation: N/A; putative formula: C2H-1O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.0,"smiles":null,"spectrum_id":"CCMSLIB00017317005","spectrum_index":50465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 112.0886 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.201,"smiles":null,"spectrum_id":"CCMSLIB00017317006","spectrum_index":50466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP022902 D-Sorbitol|Sorbo|(3S,4S,5R)-hexane-1,2,3,4,5,6-hexol (delta mass: 140.0105 Da; putative annotation: N/A; putative formula: C6H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.097,"smiles":null,"spectrum_id":"CCMSLIB00017317007","spectrum_index":50467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 159.0897 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.192,"smiles":null,"spectrum_id":"CCMSLIB00017317008","spectrum_index":50468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 289.1072 Da; putative annotation: N/A; putative formula: C15H19N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.204,"smiles":null,"spectrum_id":"CCMSLIB00017317009","spectrum_index":50469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 37.002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.051,"smiles":null,"spectrum_id":"CCMSLIB00017317010","spectrum_index":50470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-7-hydroxy-8-(2-hydroxyethyl)-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 55.0999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.207,"smiles":null,"spectrum_id":"CCMSLIB00017317011","spectrum_index":50471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 678.5759 Da; putative annotation: N/A; putative formula: C38H74N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":864.647,"smiles":null,"spectrum_id":"CCMSLIB00017317012","spectrum_index":50472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-((7S)-10-(((2S)-1-(2-(benzo[d]thiazol-2-yl)pyrrolidin-1-yl)-4-(methylthio)-1-oxobutan-2-yl)amino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide (delta mass: 87.2033 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":790.465,"smiles":null,"spectrum_id":"CCMSLIB00017317013","spectrum_index":50473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250803 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 12.0018 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":146.062,"smiles":null,"spectrum_id":"CCMSLIB00017317014","spectrum_index":50474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ala-Lys (delta mass: 170.1061 Da; putative annotation: N/A; putative formula: C8H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.324,"smiles":null,"spectrum_id":"CCMSLIB00017317015","spectrum_index":50475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 277.1515 Da; putative annotation: N/A; putative formula: C16H25NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.227,"smiles":null,"spectrum_id":"CCMSLIB00017317016","spectrum_index":50476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 24.0011 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.077,"smiles":null,"spectrum_id":"CCMSLIB00017317017","spectrum_index":50477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 240.2451 Da; putative annotation: N/A; putative formula: C16H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.332,"smiles":null,"spectrum_id":"CCMSLIB00017317018","spectrum_index":50478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olodaterol (delta mass: 35.9661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.158,"smiles":null,"spectrum_id":"CCMSLIB00017317019","spectrum_index":50479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 384.1205 Da; putative annotation: N/A; putative formula: C13H24N2O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.207,"smiles":null,"spectrum_id":"CCMSLIB00017317020","spectrum_index":50480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Gly-Arg (delta mass: 147.0683 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.293,"smiles":null,"spectrum_id":"CCMSLIB00017317021","spectrum_index":50481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 164.0474 Da; putative annotation: N/A; putative formula: C9H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.134,"smiles":null,"spectrum_id":"CCMSLIB00017317022","spectrum_index":50482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 134.0366 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.107,"smiles":null,"spectrum_id":"CCMSLIB00017317023","spectrum_index":50483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 323.1861 Da; putative annotation: N/A; putative formula: C14H30NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.341,"smiles":null,"spectrum_id":"CCMSLIB00017317024","spectrum_index":50484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 269.1269 Da; putative annotation: N/A; putative formula: C14H23NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.203,"smiles":null,"spectrum_id":"CCMSLIB00017317025","spectrum_index":50485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 10.069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.182,"smiles":null,"spectrum_id":"CCMSLIB00017317026","spectrum_index":50486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 184.1251 Da; putative annotation: N/A; putative formula: C14H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017317027","spectrum_index":50487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 234.125 Da; putative annotation: N/A; putative formula: C8H19N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.279,"smiles":null,"spectrum_id":"CCMSLIB00017317028","spectrum_index":50488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 36.1682 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.247,"smiles":null,"spectrum_id":"CCMSLIB00017317029","spectrum_index":50489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (delta mass: 45.0217 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.155,"smiles":null,"spectrum_id":"CCMSLIB00017317030","spectrum_index":50490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 128.1307 Da; putative annotation: N/A; putative formula: C7H16N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.217,"smiles":null,"spectrum_id":"CCMSLIB00017317031","spectrum_index":50491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ALPHA-D-GALACTOSE 1-PHOSPHATE - 30.0 eV (delta mass: 244.0036 Da; putative annotation: N/A; putative formula: C9H8O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.041,"smiles":null,"spectrum_id":"CCMSLIB00017317032","spectrum_index":50492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 157.0419 Da; putative annotation: N/A; putative formula: C4H7N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.145,"smiles":null,"spectrum_id":"CCMSLIB00017317033","spectrum_index":50493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 736.402 Da; putative annotation: N/A; putative formula: C36H52N10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":917.473,"smiles":null,"spectrum_id":"CCMSLIB00017317034","spectrum_index":50494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipivefrine (delta mass: 24.0469 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.259,"smiles":null,"spectrum_id":"CCMSLIB00017317035","spectrum_index":50495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,5-tetrahydro-1H-azepin[4,5-b]indole (delta mass: 26.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.18,"smiles":null,"spectrum_id":"CCMSLIB00017317036","spectrum_index":50496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 58.0045 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.127,"smiles":null,"spectrum_id":"CCMSLIB00017317037","spectrum_index":50497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 152.1139 Da; putative annotation: N/A; putative formula: C10H17O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.241,"smiles":null,"spectrum_id":"CCMSLIB00017317038","spectrum_index":50498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alline (delta mass: 254.1381 Da; putative annotation: N/A; putative formula: C11H18N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.256,"smiles":null,"spectrum_id":"CCMSLIB00017317039","spectrum_index":50499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM836003 Indoline|Indoline|2,3-dihydro-1H-indole (delta mass: 28.0192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.1,"smiles":null,"spectrum_id":"CCMSLIB00017317040","spectrum_index":50500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 505.232 Da; putative annotation: N/A; putative formula: C27H39NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.292,"smiles":null,"spectrum_id":"CCMSLIB00017317041","spectrum_index":50501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084606 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 34.0199 Da; putative annotation: N/A; putative formula: C4H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.074,"smiles":null,"spectrum_id":"CCMSLIB00017317042","spectrum_index":50502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hydroquinidine (delta mass: 157.176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.383,"smiles":null,"spectrum_id":"CCMSLIB00017317043","spectrum_index":50503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 114.0134 Da; putative annotation: N/A; putative formula: C5H6OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.1,"smiles":null,"spectrum_id":"CCMSLIB00017317044","spectrum_index":50504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 70.0397 Da; putative annotation: N/A; putative formula: H2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.267,"smiles":null,"spectrum_id":"CCMSLIB00017317045","spectrum_index":50505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 72.0365 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.086,"smiles":null,"spectrum_id":"CCMSLIB00017317046","spectrum_index":50506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 134.0587 Da; putative annotation: N/A; putative formula: C6H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.134,"smiles":null,"spectrum_id":"CCMSLIB00017317047","spectrum_index":50507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 146.0569 Da; putative annotation: N/A; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.148,"smiles":null,"spectrum_id":"CCMSLIB00017317048","spectrum_index":50508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 146.0554 Da; putative annotation: N/A; putative formula: C10H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.142,"smiles":null,"spectrum_id":"CCMSLIB00017317049","spectrum_index":50509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 505.2614 Da; putative annotation: N/A; putative formula: C34H35NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.426,"smiles":null,"spectrum_id":"CCMSLIB00017317050","spectrum_index":50510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 493.5905 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":836.714,"smiles":null,"spectrum_id":"CCMSLIB00017317051","spectrum_index":50511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 93.964 Da; putative annotation: N/A; putative formula: CH3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.999,"smiles":null,"spectrum_id":"CCMSLIB00017317052","spectrum_index":50512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 315.1456 Da; putative annotation: N/A; putative formula: C12H22N5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.289,"smiles":null,"spectrum_id":"CCMSLIB00017317053","spectrum_index":50513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine CollisionEnergy:205060 (delta mass: 208.0809 Da; putative annotation: N/A; putative formula: C5H12N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.194,"smiles":null,"spectrum_id":"CCMSLIB00017317054","spectrum_index":50514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 259.0998 Da; putative annotation: N/A; putative formula: C18H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.233,"smiles":null,"spectrum_id":"CCMSLIB00017317055","spectrum_index":50515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 442.2593 Da; putative annotation: N/A; putative formula: C25H30N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.33,"smiles":null,"spectrum_id":"CCMSLIB00017317056","spectrum_index":50516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 157.1468 Da; putative annotation: N/A; putative formula: C9H19NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.233,"smiles":null,"spectrum_id":"CCMSLIB00017317057","spectrum_index":50517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 41.0629 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.149,"smiles":null,"spectrum_id":"CCMSLIB00017317058","spectrum_index":50518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 68.0639 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.228,"smiles":null,"spectrum_id":"CCMSLIB00017317059","spectrum_index":50519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 115.0748 Da; putative annotation: N/A; putative formula: C4H9N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.114,"smiles":null,"spectrum_id":"CCMSLIB00017317060","spectrum_index":50520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 286.1495 Da; putative annotation: N/A; putative formula: C11H23N6O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.303,"smiles":null,"spectrum_id":"CCMSLIB00017317061","spectrum_index":50521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 255.1193 Da; putative annotation: N/A; putative formula: C7H13N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.273,"smiles":null,"spectrum_id":"CCMSLIB00017317062","spectrum_index":50522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 132.0563 Da; putative annotation: N/A; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.143,"smiles":null,"spectrum_id":"CCMSLIB00017317063","spectrum_index":50523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 554.13 Da; putative annotation: N/A; putative formula: C34H22N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.227,"smiles":null,"spectrum_id":"CCMSLIB00017317064","spectrum_index":50524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyl-1,2,3,4-tetrahydroquinazolin-2-one (delta mass: 30.9944 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.081,"smiles":null,"spectrum_id":"CCMSLIB00017317065","spectrum_index":50525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin F (delta mass: 120.0939 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.373,"smiles":null,"spectrum_id":"CCMSLIB00017317066","spectrum_index":50526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 140.1281 Da; putative annotation: N/A; putative formula: C8H16N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.144,"smiles":null,"spectrum_id":"CCMSLIB00017317067","spectrum_index":50527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 124.1199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.235,"smiles":null,"spectrum_id":"CCMSLIB00017317068","spectrum_index":50528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 50.0304 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.154,"smiles":null,"spectrum_id":"CCMSLIB00017317069","spectrum_index":50529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 19.0277 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.092,"smiles":null,"spectrum_id":"CCMSLIB00017317070","spectrum_index":50530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 101.094 Da; putative annotation: N/A; putative formula: C4H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.176,"smiles":null,"spectrum_id":"CCMSLIB00017317071","spectrum_index":50531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 294.2551 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.379,"smiles":null,"spectrum_id":"CCMSLIB00017317072","spectrum_index":50532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 281.2711 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.347,"smiles":null,"spectrum_id":"CCMSLIB00017317073","spectrum_index":50533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 149.0481 Da; putative annotation: N/A; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.14,"smiles":null,"spectrum_id":"CCMSLIB00017317074","spectrum_index":50534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 164.0481 Da; putative annotation: N/A; putative formula: C10H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.098,"smiles":null,"spectrum_id":"CCMSLIB00017317075","spectrum_index":50535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Fenoterol (delta mass: 130.0488 Da; putative annotation: N/A; putative formula: C3H6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.203,"smiles":null,"spectrum_id":"CCMSLIB00017317076","spectrum_index":50536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 248.09 Da; putative annotation: N/A; putative formula: C13H17N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.124,"smiles":null,"spectrum_id":"CCMSLIB00017317077","spectrum_index":50537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 200.1676 Da; putative annotation: N/A; putative formula: C14H20N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.256,"smiles":null,"spectrum_id":"CCMSLIB00017317078","spectrum_index":50538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 86.0514 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.096,"smiles":null,"spectrum_id":"CCMSLIB00017317079","spectrum_index":50539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,4R,6R)-4-Amino-2-oxabicyclo[3.1.0]hexane-4,6-dicarboxylic acid (delta mass: 84.0578 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.113,"smiles":null,"spectrum_id":"CCMSLIB00017317080","spectrum_index":50540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 60.0 eV (delta mass: 98.0522 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017317081","spectrum_index":50541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 170.1304 Da; putative annotation: N/A; putative formula: C10H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.212,"smiles":null,"spectrum_id":"CCMSLIB00017317082","spectrum_index":50542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 367.1784 Da; putative annotation: N/A; putative formula: C22H25NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.364,"smiles":null,"spectrum_id":"CCMSLIB00017317083","spectrum_index":50543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ISONICOTINIC ACID (delta mass: 400.9607 Da; putative annotation: N/A; putative formula: C16H7N3O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017317084","spectrum_index":50544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nitro-2,4-quinolinediol (delta mass: 69.0152 Da; putative annotation: N/A; putative formula: C3H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.055,"smiles":null,"spectrum_id":"CCMSLIB00017317085","spectrum_index":50545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 142.0744 Da; putative annotation: N/A; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.224,"smiles":null,"spectrum_id":"CCMSLIB00017317086","spectrum_index":50546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380084-01_C21H30O4_Benzo[b]cyclopenta[e]pyran-8(3H)-one, 3a,5,6,7,9,9a-hexahydro-7-hydroxy-1-[(4E)-6-hydroxy-1,5-dimethyl-4-hexen-1-yl]-3a-methyl- (delta mass: 128.0994 Da; putative annotation: N/A; putative formula: C11H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.321,"smiles":null,"spectrum_id":"CCMSLIB00017317087","spectrum_index":50547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 406.1824 Da; putative annotation: N/A; putative formula: C15H22N10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1015.45,"smiles":null,"spectrum_id":"CCMSLIB00017317088","spectrum_index":50548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 225.0845 Da; putative annotation: N/A; putative formula: C7H15NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.15,"smiles":null,"spectrum_id":"CCMSLIB00017317089","spectrum_index":50549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 450.5295 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.627,"smiles":null,"spectrum_id":"CCMSLIB00017317090","spectrum_index":50550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 214.1574 Da; putative annotation: N/A; putative formula: C12H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.272,"smiles":null,"spectrum_id":"CCMSLIB00017317091","spectrum_index":50551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 222.1121 Da; putative annotation: N/A; putative formula: C10H14N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.239,"smiles":null,"spectrum_id":"CCMSLIB00017317092","spectrum_index":50552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 104.2252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.264,"smiles":null,"spectrum_id":"CCMSLIB00017317093","spectrum_index":50553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 132.0382 Da; putative annotation: N/A; putative formula: C4H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.117,"smiles":null,"spectrum_id":"CCMSLIB00017317094","spectrum_index":50554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 248.1982 Da; putative annotation: N/A; putative formula: C17H28O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.289,"smiles":null,"spectrum_id":"CCMSLIB00017317095","spectrum_index":50555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 60.0203 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017317096","spectrum_index":50556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 137.0536 Da; putative annotation: L-Histidine; putative formula: C6H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.135,"smiles":null,"spectrum_id":"CCMSLIB00017317097","spectrum_index":50557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 133.039 Da; putative annotation: 2-Hydroxy-6-aminopurine; putative formula: C5H3N5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.099,"smiles":null,"spectrum_id":"CCMSLIB00017317098","spectrum_index":50558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 170.0484 Da; putative annotation: 2,2'-Bipyridine-3,3'-diol; putative formula: C10H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.119,"smiles":null,"spectrum_id":"CCMSLIB00017317099","spectrum_index":50559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylbutanoic acid (delta mass: 99.067 Da; putative annotation: 5-AVA - 30.0 eV; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.153,"smiles":null,"spectrum_id":"CCMSLIB00017317100","spectrum_index":50560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 143.0584 Da; putative annotation: 2-Aminoadipic acid; AIF; CE0; CorrDec; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.145,"smiles":null,"spectrum_id":"CCMSLIB00017317101","spectrum_index":50561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 164.0282 Da; putative annotation: 3-(Methylthio)phenyl acetic acid; putative formula: C9H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.11,"smiles":null,"spectrum_id":"CCMSLIB00017317102","spectrum_index":50562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 611.2938 Da; putative annotation: N/A; putative formula: C43H37N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":795.391,"smiles":null,"spectrum_id":"CCMSLIB00017317103","spectrum_index":50563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 136.1614 Da; putative annotation: N/A; putative formula: C11H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.268,"smiles":null,"spectrum_id":"CCMSLIB00017317104","spectrum_index":50564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 359.1734 Da; putative annotation: N/A; putative formula: C15H22N9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":704.343,"smiles":null,"spectrum_id":"CCMSLIB00017317105","spectrum_index":50565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine ethyl ester (delta mass: 68.1069 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.251,"smiles":null,"spectrum_id":"CCMSLIB00017317106","spectrum_index":50566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385157-01_C21H26N2O2_Ibogamine-18-carboxylic acid, methyl ester (delta mass: 17.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.222,"smiles":null,"spectrum_id":"CCMSLIB00017317107","spectrum_index":50567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 138.083 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.207,"smiles":null,"spectrum_id":"CCMSLIB00017317108","spectrum_index":50568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Aminobutyl)hydroxylamine (delta mass: 346.178 Da; putative annotation: N/A; putative formula: C20H26O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.28,"smiles":null,"spectrum_id":"CCMSLIB00017317109","spectrum_index":50569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 59.1276 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.176,"smiles":null,"spectrum_id":"CCMSLIB00017317110","spectrum_index":50570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 126.0634 Da; putative annotation: N/A; putative formula: C6H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.15,"smiles":null,"spectrum_id":"CCMSLIB00017317111","spectrum_index":50571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cordycepin (delta mass: 136.0384 Da; putative annotation: N/A; putative formula: C5H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.147,"smiles":null,"spectrum_id":"CCMSLIB00017317112","spectrum_index":50572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chanoclavine-I (delta mass: 4.3352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.5,"smiles":null,"spectrum_id":"CCMSLIB00017317113","spectrum_index":50573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,7,8-trimethylhydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 84.093 Da; putative annotation: N/A; putative formula: C6H12)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.2,"smiles":null,"spectrum_id":"CCMSLIB00017317114","spectrum_index":50574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 102.0834 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.326,"smiles":null,"spectrum_id":"CCMSLIB00017317115","spectrum_index":50575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 170.1873 Da; putative annotation: N/A; putative formula: C9H22N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.23,"smiles":null,"spectrum_id":"CCMSLIB00017317116","spectrum_index":50576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 317.2199 Da; putative annotation: N/A; putative formula: C16H31NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.28,"smiles":null,"spectrum_id":"CCMSLIB00017317117","spectrum_index":50577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01040 Hexahydrocurcumin (delta mass: 658.3182 Da; putative annotation: N/A; putative formula: C29H50N6O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1033.5,"smiles":null,"spectrum_id":"CCMSLIB00017317118","spectrum_index":50578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 899.4874 Da; putative annotation: N/A; putative formula: C43H61N15O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1106.57,"smiles":null,"spectrum_id":"CCMSLIB00017317119","spectrum_index":50579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 782.2067 Da; putative annotation: N/A; putative formula: C52H26N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":929.272,"smiles":null,"spectrum_id":"CCMSLIB00017317120","spectrum_index":50580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 7-fluoro-3-methyl-1H-indole-2-carboxylate (delta mass: 32.0251 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.102,"smiles":null,"spectrum_id":"CCMSLIB00017317121","spectrum_index":50581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 78.0245 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.13,"smiles":null,"spectrum_id":"CCMSLIB00017317122","spectrum_index":50582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 147.0684 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.202,"smiles":null,"spectrum_id":"CCMSLIB00017317123","spectrum_index":50583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 86.0315 Da; putative annotation: N/A; putative formula: C3H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.081,"smiles":null,"spectrum_id":"CCMSLIB00017317124","spectrum_index":50584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 40.0 eV (delta mass: 117.0663 Da; putative annotation: N/A; putative formula: C2H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.142,"smiles":null,"spectrum_id":"CCMSLIB00017317125","spectrum_index":50585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380158-01!2-[2-[2-[[2-[2-(2-hydroxypropanoylamino)-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoyl]oxypropanoylamino]-3-methylbutanoic acid [IIN-based on: CCMSLIB00000845729] (delta mass: 370.2098 Da; putative annotation: N/A; putative formula: C20H35O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":930.528,"smiles":null,"spectrum_id":"CCMSLIB00017317126","spectrum_index":50586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 1-methyl-9H-beta-carbolin-7-yl ether (delta mass: 43.9897 Da; putative annotation: N/A; putative formula: CO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.092,"smiles":null,"spectrum_id":"CCMSLIB00017317127","spectrum_index":50587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.112,"smiles":null,"spectrum_id":"CCMSLIB00017317128","spectrum_index":50588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 92.0125 Da; putative annotation: N/A; putative formula: C3N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.12,"smiles":null,"spectrum_id":"CCMSLIB00017317129","spectrum_index":50589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 62.0527 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.29,"smiles":null,"spectrum_id":"CCMSLIB00017317130","spectrum_index":50590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-(piperidin-4-yl)-1H-indole (delta mass: 117.0624 Da; putative annotation: N/A; putative formula: C5H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.192,"smiles":null,"spectrum_id":"CCMSLIB00017317131","spectrum_index":50591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 266.1192 Da; putative annotation: N/A; putative formula: C11H22O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.207,"smiles":null,"spectrum_id":"CCMSLIB00017317132","spectrum_index":50592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of RAFFINOSE (delta mass: 163.0637 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.24,"smiles":null,"spectrum_id":"CCMSLIB00017317133","spectrum_index":50593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 361.1861 Da; putative annotation: N/A; putative formula: C16H23N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.356,"smiles":null,"spectrum_id":"CCMSLIB00017317134","spectrum_index":50594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00348 Vincamine (delta mass: 36.0129 Da; putative annotation: N/A; putative formula: C2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.215,"smiles":null,"spectrum_id":"CCMSLIB00017317135","spectrum_index":50595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 642.3442 Da; putative annotation: N/A; putative formula: C33H54O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":823.415,"smiles":null,"spectrum_id":"CCMSLIB00017317136","spectrum_index":50596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 135.0685 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.16,"smiles":null,"spectrum_id":"CCMSLIB00017317137","spectrum_index":50597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 98.0522 Da; putative annotation: N/A; putative formula: C9H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.118,"smiles":null,"spectrum_id":"CCMSLIB00017317138","spectrum_index":50598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 185.256 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.405,"smiles":null,"spectrum_id":"CCMSLIB00017317139","spectrum_index":50599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 115.1362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.265,"smiles":null,"spectrum_id":"CCMSLIB00017317140","spectrum_index":50600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 348.1295 Da; putative annotation: N/A; putative formula: C13H16N8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.191,"smiles":null,"spectrum_id":"CCMSLIB00017317141","spectrum_index":50601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 94.036 Da; putative annotation: N/A; putative formula: C6H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.212,"smiles":null,"spectrum_id":"CCMSLIB00017317142","spectrum_index":50602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin D (delta mass: 116.061 Da; putative annotation: N/A; putative formula: C3H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.325,"smiles":null,"spectrum_id":"CCMSLIB00017317143","spectrum_index":50603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 48.0118 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.151,"smiles":null,"spectrum_id":"CCMSLIB00017317144","spectrum_index":50604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 79.0636 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.155,"smiles":null,"spectrum_id":"CCMSLIB00017317145","spectrum_index":50605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 439.2046 Da; putative annotation: N/A; putative formula: C31H25N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.341,"smiles":null,"spectrum_id":"CCMSLIB00017317146","spectrum_index":50606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 129.0195 Da; putative annotation: N/A; putative formula: C8H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.137,"smiles":null,"spectrum_id":"CCMSLIB00017317147","spectrum_index":50607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 162.1441 Da; putative annotation: N/A; putative formula: C2H14N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.371,"smiles":null,"spectrum_id":"CCMSLIB00017317148","spectrum_index":50608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 35.0586 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.15,"smiles":null,"spectrum_id":"CCMSLIB00017317149","spectrum_index":50609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-Isopropoxy-5-(trifluoromethyl)phenyl]amine (delta mass: 46.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.121,"smiles":null,"spectrum_id":"CCMSLIB00017317150","spectrum_index":50610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 157.0412 Da; putative annotation: N/A; putative formula: C5H8N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.216,"smiles":null,"spectrum_id":"CCMSLIB00017317151","spectrum_index":50611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 45.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.09,"smiles":null,"spectrum_id":"CCMSLIB00017317152","spectrum_index":50612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 258.192 Da; putative annotation: N/A; putative formula: C9H22N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.233,"smiles":null,"spectrum_id":"CCMSLIB00017317153","spectrum_index":50613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 203.0738 Da; putative annotation: N/A; putative formula: C15H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.228,"smiles":null,"spectrum_id":"CCMSLIB00017317154","spectrum_index":50614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 112.0677 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.118,"smiles":null,"spectrum_id":"CCMSLIB00017317155","spectrum_index":50615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 59.0369 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.144,"smiles":null,"spectrum_id":"CCMSLIB00017317156","spectrum_index":50616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 328.1296 Da; putative annotation: N/A; putative formula: C16H12N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.263,"smiles":null,"spectrum_id":"CCMSLIB00017317157","spectrum_index":50617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 57.0112 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.097,"smiles":null,"spectrum_id":"CCMSLIB00017317158","spectrum_index":50618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 186.0759 Da; putative annotation: N/A; putative formula: C6H10N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.23,"smiles":null,"spectrum_id":"CCMSLIB00017317159","spectrum_index":50619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 304.0187 Da; putative annotation: N/A; putative formula: C10H12N2O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.079,"smiles":null,"spectrum_id":"CCMSLIB00017317160","spectrum_index":50620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 145.0883 Da; putative annotation: N/A; putative formula: C10H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.18,"smiles":null,"spectrum_id":"CCMSLIB00017317161","spectrum_index":50621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 26.0191 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.065,"smiles":null,"spectrum_id":"CCMSLIB00017317162","spectrum_index":50622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 114.0425 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.213,"smiles":null,"spectrum_id":"CCMSLIB00017317163","spectrum_index":50623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 1.9982 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017317164","spectrum_index":50624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinidine 1'-oxide (delta mass: 78.0132 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.199,"smiles":null,"spectrum_id":"CCMSLIB00017317165","spectrum_index":50625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norhydrocodone (delta mass: 452.1979 Da; putative annotation: N/A; putative formula: C22H32N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":738.342,"smiles":null,"spectrum_id":"CCMSLIB00017317166","spectrum_index":50626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 146.0367 Da; putative annotation: N/A; putative formula: C9H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.123,"smiles":null,"spectrum_id":"CCMSLIB00017317167","spectrum_index":50627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dipivefrine (delta mass: 79.9668 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.179,"smiles":null,"spectrum_id":"CCMSLIB00017317168","spectrum_index":50628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 17.9742 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.227,"smiles":null,"spectrum_id":"CCMSLIB00017317169","spectrum_index":50629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 143.1116 Da; putative annotation: N/A; putative formula: C8H17NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.224,"smiles":null,"spectrum_id":"CCMSLIB00017317170","spectrum_index":50630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid (delta mass: 42.0139 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.079,"smiles":null,"spectrum_id":"CCMSLIB00017317171","spectrum_index":50631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 148.0518 Da; putative annotation: N/A; putative formula: C3H9N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.174,"smiles":null,"spectrum_id":"CCMSLIB00017317172","spectrum_index":50632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole (delta mass: 200.0623 Da; putative annotation: N/A; putative formula: C16H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.185,"smiles":null,"spectrum_id":"CCMSLIB00017317173","spectrum_index":50633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 286.2178 Da; putative annotation: N/A; putative formula: C15H31N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.341,"smiles":null,"spectrum_id":"CCMSLIB00017317174","spectrum_index":50634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 534.3858 Da; putative annotation: N/A; putative formula: C31H54N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.477,"smiles":null,"spectrum_id":"CCMSLIB00017317175","spectrum_index":50635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 98.9225 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.019,"smiles":null,"spectrum_id":"CCMSLIB00017317176","spectrum_index":50636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000511 Indoleacetic acid|2-(1H-indol-3-yl)acetic acid (delta mass: 89.0475 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.118,"smiles":null,"spectrum_id":"CCMSLIB00017317177","spectrum_index":50637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 382.272 Da; putative annotation: N/A; putative formula: C22H38O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.343,"smiles":null,"spectrum_id":"CCMSLIB00017317178","spectrum_index":50638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1220.4718 Da; putative annotation: N/A; putative formula: C62H73N6O18P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1563.6,"smiles":null,"spectrum_id":"CCMSLIB00017317179","spectrum_index":50639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.138,"smiles":null,"spectrum_id":"CCMSLIB00017317180","spectrum_index":50640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 82.0532 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.14,"smiles":null,"spectrum_id":"CCMSLIB00017317181","spectrum_index":50641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 59.1685 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.266,"smiles":null,"spectrum_id":"CCMSLIB00017317182","spectrum_index":50642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 76.0309 Da; putative annotation: N/A; putative formula: C6H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.097,"smiles":null,"spectrum_id":"CCMSLIB00017317183","spectrum_index":50643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 74.9127 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.972,"smiles":null,"spectrum_id":"CCMSLIB00017317184","spectrum_index":50644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 451.1706 Da; putative annotation: N/A; putative formula: C19H25N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":676.283,"smiles":null,"spectrum_id":"CCMSLIB00017317185","spectrum_index":50645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 224.1163 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.218,"smiles":null,"spectrum_id":"CCMSLIB00017317186","spectrum_index":50646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 269.2139 Da; putative annotation: N/A; putative formula: C19H27N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.301,"smiles":null,"spectrum_id":"CCMSLIB00017317187","spectrum_index":50647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 340.1788 Da; putative annotation: N/A; putative formula: C20H24N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.301,"smiles":null,"spectrum_id":"CCMSLIB00017317188","spectrum_index":50648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 364.1379 Da; putative annotation: N/A; putative formula: C16H28O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.23,"smiles":null,"spectrum_id":"CCMSLIB00017317189","spectrum_index":50649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 294.2551 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":637.379,"smiles":null,"spectrum_id":"CCMSLIB00017317190","spectrum_index":50650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 1027.7461 Da; putative annotation: N/A; putative formula: C61H93N11O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1532.92,"smiles":null,"spectrum_id":"CCMSLIB00017317191","spectrum_index":50651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 102.1698 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.192,"smiles":null,"spectrum_id":"CCMSLIB00017317192","spectrum_index":50652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 65.0559 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.196,"smiles":null,"spectrum_id":"CCMSLIB00017317193","spectrum_index":50653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 635.3936 Da; putative annotation: N/A; putative formula: C37H53N3O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":936.573,"smiles":null,"spectrum_id":"CCMSLIB00017317194","spectrum_index":50654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 132.0506 Da; putative annotation: N/A; putative formula: C9H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.153,"smiles":null,"spectrum_id":"CCMSLIB00017317195","spectrum_index":50655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 69.0413 Da; putative annotation: N/A; putative formula: CH3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.128,"smiles":null,"spectrum_id":"CCMSLIB00017317196","spectrum_index":50656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 700.3836 Da; putative annotation: N/A; putative formula: C40H52N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1061.55,"smiles":null,"spectrum_id":"CCMSLIB00017317197","spectrum_index":50657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 483.9675 Da; putative annotation: N/A; putative formula: C20H8N2O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":778.086,"smiles":null,"spectrum_id":"CCMSLIB00017317198","spectrum_index":50658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 32.4196 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017317199","spectrum_index":50659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 246.0854 Da; putative annotation: N/A; putative formula: C11H21P3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.172,"smiles":null,"spectrum_id":"CCMSLIB00017317200","spectrum_index":50660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 85.1144 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017317201","spectrum_index":50661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 30.0069 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.161,"smiles":null,"spectrum_id":"CCMSLIB00017317202","spectrum_index":50662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 14.0158 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.098,"smiles":null,"spectrum_id":"CCMSLIB00017317203","spectrum_index":50663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 249.2095 Da; putative annotation: N/A; putative formula: C16H27NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.296,"smiles":null,"spectrum_id":"CCMSLIB00017317204","spectrum_index":50664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 71.9177 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.972,"smiles":null,"spectrum_id":"CCMSLIB00017317205","spectrum_index":50665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 14.0545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.123,"smiles":null,"spectrum_id":"CCMSLIB00017317206","spectrum_index":50666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 256.256 Da; putative annotation: N/A; putative formula: C20H32O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.343,"smiles":null,"spectrum_id":"CCMSLIB00017317207","spectrum_index":50667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 88.0161 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.155,"smiles":null,"spectrum_id":"CCMSLIB00017317208","spectrum_index":50668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 100.0625 Da; putative annotation: N/A; putative formula: C4H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.144,"smiles":null,"spectrum_id":"CCMSLIB00017317209","spectrum_index":50669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anomuricine (delta mass: 120.0627 Da; putative annotation: N/A; putative formula: C2H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.233,"smiles":null,"spectrum_id":"CCMSLIB00017317210","spectrum_index":50670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 140.1241 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.21,"smiles":null,"spectrum_id":"CCMSLIB00017317211","spectrum_index":50671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 74.0475 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.15,"smiles":null,"spectrum_id":"CCMSLIB00017317212","spectrum_index":50672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzyl homoveratrylamine (delta mass: 128.1389 Da; putative annotation: N/A; putative formula: C6H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.303,"smiles":null,"spectrum_id":"CCMSLIB00017317213","spectrum_index":50673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 38.9479 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.034,"smiles":null,"spectrum_id":"CCMSLIB00017317214","spectrum_index":50674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 56.051 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017317215","spectrum_index":50675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 23.0164 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017317216","spectrum_index":50676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 292.2758 Da; putative annotation: N/A; putative formula: C20H36O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.329,"smiles":null,"spectrum_id":"CCMSLIB00017317217","spectrum_index":50677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 71.0191 Da; putative annotation: N/A; putative formula: C3H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.041,"smiles":null,"spectrum_id":"CCMSLIB00017317218","spectrum_index":50678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 273.0201 Da; putative annotation: N/A; putative formula: C4H11N5O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.07,"smiles":null,"spectrum_id":"CCMSLIB00017317219","spectrum_index":50679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminochrysene (delta mass: 121.049 Da; putative annotation: N/A; putative formula: C2H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.161,"smiles":null,"spectrum_id":"CCMSLIB00017317220","spectrum_index":50680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 239.0944 Da; putative annotation: N/A; putative formula: C15H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.217,"smiles":null,"spectrum_id":"CCMSLIB00017317221","spectrum_index":50681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 74.0499 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.142,"smiles":null,"spectrum_id":"CCMSLIB00017317222","spectrum_index":50682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Geissolaevine (delta mass: 51.0594 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.188,"smiles":null,"spectrum_id":"CCMSLIB00017317223","spectrum_index":50683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 38.0159 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.175,"smiles":null,"spectrum_id":"CCMSLIB00017317224","spectrum_index":50684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 26.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.109,"smiles":null,"spectrum_id":"CCMSLIB00017317225","spectrum_index":50685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 30.011 Da; putative annotation: N/A; putative formula: CH2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":152.107,"smiles":null,"spectrum_id":"CCMSLIB00017317226","spectrum_index":50686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169735-02!(5S)-5-hydroxy-1,7-diphenylheptan-3-one (delta mass: 8.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.18,"smiles":null,"spectrum_id":"CCMSLIB00017317227","spectrum_index":50687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 325.1479 Da; putative annotation: N/A; putative formula: C13H28NO4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.26,"smiles":null,"spectrum_id":"CCMSLIB00017317228","spectrum_index":50688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 126.1034 Da; putative annotation: N/A; putative formula: C8H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.163,"smiles":null,"spectrum_id":"CCMSLIB00017317229","spectrum_index":50689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 94.0514 Da; putative annotation: (5-Methyl-3-isoxazolyl)methanamine; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.127,"smiles":null,"spectrum_id":"CCMSLIB00017317230","spectrum_index":50690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 176.0689 Da; putative annotation: Methyl .alpha.-D-mannopyranoside; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.192,"smiles":null,"spectrum_id":"CCMSLIB00017317231","spectrum_index":50691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 184.1211 Da; putative annotation: Leu-Ala; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.223,"smiles":null,"spectrum_id":"CCMSLIB00017317232","spectrum_index":50692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 163.0991 Da; putative annotation: 4-Hydroxy-3-methoxyamphetamine; putative formula: C10H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.195,"smiles":null,"spectrum_id":"CCMSLIB00017317233","spectrum_index":50693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 144.0422 Da; putative annotation: 3-Hydroxy-3-methylglutaric acid; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.092,"smiles":null,"spectrum_id":"CCMSLIB00017317234","spectrum_index":50694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 132.0592 Da; putative annotation: (2S,3S)-(-)-3-Phenylglycidol; putative formula: C9H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.218,"smiles":null,"spectrum_id":"CCMSLIB00017317235","spectrum_index":50695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 219.1046 Da; putative annotation: N/A; putative formula: C16H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.291,"smiles":null,"spectrum_id":"CCMSLIB00017317236","spectrum_index":50696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 387.2767 Da; putative annotation: N/A; putative formula: C24H37NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.347,"smiles":null,"spectrum_id":"CCMSLIB00017317237","spectrum_index":50697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 192.0429 Da; putative annotation: N/A; putative formula: C3H8N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.166,"smiles":null,"spectrum_id":"CCMSLIB00017317238","spectrum_index":50698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 152.0622 Da; putative annotation: N/A; putative formula: C12H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.186,"smiles":null,"spectrum_id":"CCMSLIB00017317239","spectrum_index":50699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine - 40.0 eV (delta mass: 22.8002 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.902,"smiles":null,"spectrum_id":"CCMSLIB00017317240","spectrum_index":50700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 114.0695 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.209,"smiles":null,"spectrum_id":"CCMSLIB00017317241","spectrum_index":50701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 463.2442 Da; putative annotation: N/A; putative formula: C23H37N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":751.404,"smiles":null,"spectrum_id":"CCMSLIB00017317242","spectrum_index":50702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 92.7613 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.82,"smiles":null,"spectrum_id":"CCMSLIB00017317243","spectrum_index":50703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Bromo-5-chloropyridin-2-ol (delta mass: 604.6166 Da; putative annotation: N/A; putative formula: C41H80O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.532,"smiles":null,"spectrum_id":"CCMSLIB00017317244","spectrum_index":50704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 320.2026 Da; putative annotation: N/A; putative formula: C19H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.273,"smiles":null,"spectrum_id":"CCMSLIB00017317245","spectrum_index":50705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 130.1534 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.201,"smiles":null,"spectrum_id":"CCMSLIB00017317246","spectrum_index":50706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 128.0255 Da; putative annotation: N/A; putative formula: C3H5N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.174,"smiles":null,"spectrum_id":"CCMSLIB00017317247","spectrum_index":50707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 49.0321 Da; putative annotation: N/A; putative formula: C4H3NO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.087,"smiles":null,"spectrum_id":"CCMSLIB00017317248","spectrum_index":50708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 73.0427 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.129,"smiles":null,"spectrum_id":"CCMSLIB00017317249","spectrum_index":50709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-proline (delta mass: 56.0456 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.132,"smiles":null,"spectrum_id":"CCMSLIB00017317250","spectrum_index":50710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 133.929 Da; putative annotation: N/A; putative formula: C2H-2O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.994,"smiles":null,"spectrum_id":"CCMSLIB00017317251","spectrum_index":50711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 349.236 Da; putative annotation: N/A; putative formula: C21H36NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.302,"smiles":null,"spectrum_id":"CCMSLIB00017317252","spectrum_index":50712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 376.3698 Da; putative annotation: N/A; putative formula: C26H48O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.461,"smiles":null,"spectrum_id":"CCMSLIB00017317253","spectrum_index":50713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 926.3356 Da; putative annotation: N/A; putative formula: C48H50N10O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1148.43,"smiles":null,"spectrum_id":"CCMSLIB00017317254","spectrum_index":50714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 124.0591 Da; putative annotation: N/A; putative formula: C2H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.118,"smiles":null,"spectrum_id":"CCMSLIB00017317255","spectrum_index":50715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 68.028 Da; putative annotation: N/A; putative formula: C4H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.187,"smiles":null,"spectrum_id":"CCMSLIB00017317256","spectrum_index":50716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 298.0216 Da; putative annotation: N/A; putative formula: C16H11O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.108,"smiles":null,"spectrum_id":"CCMSLIB00017317257","spectrum_index":50717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 198.0677 Da; putative annotation: N/A; putative formula: C13H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.128,"smiles":null,"spectrum_id":"CCMSLIB00017317258","spectrum_index":50718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 484.205 Da; putative annotation: N/A; putative formula: C24H37O6PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.317,"smiles":null,"spectrum_id":"CCMSLIB00017317259","spectrum_index":50719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 116.0299 Da; putative annotation: N/A; putative formula: C5H8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.101,"smiles":null,"spectrum_id":"CCMSLIB00017317260","spectrum_index":50720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 200.0211 Da; putative annotation: N/A; putative formula: C4H5N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.18,"smiles":null,"spectrum_id":"CCMSLIB00017317261","spectrum_index":50721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 145.0793 Da; putative annotation: N/A; putative formula: C4H11N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.249,"smiles":null,"spectrum_id":"CCMSLIB00017317262","spectrum_index":50722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 126.0421 Da; putative annotation: N/A; putative formula: C5H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.134,"smiles":null,"spectrum_id":"CCMSLIB00017317263","spectrum_index":50723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 7.9952 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.108,"smiles":null,"spectrum_id":"CCMSLIB00017317264","spectrum_index":50724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 70.1128 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.118,"smiles":null,"spectrum_id":"CCMSLIB00017317265","spectrum_index":50725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 105.0402 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.168,"smiles":null,"spectrum_id":"CCMSLIB00017317266","spectrum_index":50726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-2,3-dihydro-1H-benzimidazole-5-carboxylic acid (delta mass: 84.097 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.142,"smiles":null,"spectrum_id":"CCMSLIB00017317267","spectrum_index":50727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 254.0939 Da; putative annotation: N/A; putative formula: C16H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.18,"smiles":null,"spectrum_id":"CCMSLIB00017317268","spectrum_index":50728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 130.0266 Da; putative annotation: N/A; putative formula: C5H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017317269","spectrum_index":50729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dulcitol (delta mass: 72.0512 Da; putative annotation: N/A; putative formula: C4H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.137,"smiles":null,"spectrum_id":"CCMSLIB00017317270","spectrum_index":50730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 438.2196 Da; putative annotation: N/A; putative formula: C23H38N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":799.384,"smiles":null,"spectrum_id":"CCMSLIB00017317271","spectrum_index":50731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 98.0599 Da; putative annotation: N/A; putative formula: C3H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.136,"smiles":null,"spectrum_id":"CCMSLIB00017317272","spectrum_index":50732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 40.0324 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.108,"smiles":null,"spectrum_id":"CCMSLIB00017317273","spectrum_index":50733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 23.077 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.163,"smiles":null,"spectrum_id":"CCMSLIB00017317274","spectrum_index":50734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HMHQ-N-oxide:db (delta mass: 271.1574 Da; putative annotation: N/A; putative formula: C17H21NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.322,"smiles":null,"spectrum_id":"CCMSLIB00017317275","spectrum_index":50735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 40.0292 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.1,"smiles":null,"spectrum_id":"CCMSLIB00017317276","spectrum_index":50736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 156.152 Da; putative annotation: N/A; putative formula: C10H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.442,"smiles":null,"spectrum_id":"CCMSLIB00017317277","spectrum_index":50737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 172.0281 Da; putative annotation: N/A; putative formula: C2H4N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.119,"smiles":null,"spectrum_id":"CCMSLIB00017317278","spectrum_index":50738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 164.2137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.274,"smiles":null,"spectrum_id":"CCMSLIB00017317279","spectrum_index":50739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(5-Nitro-1H-indol-3-yl)ethan-1-one (delta mass: 18.0351 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.096,"smiles":null,"spectrum_id":"CCMSLIB00017317280","spectrum_index":50740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 292.2414 Da; putative annotation: N/A; putative formula: C19H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.417,"smiles":null,"spectrum_id":"CCMSLIB00017317281","spectrum_index":50741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 108.0208 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.107,"smiles":null,"spectrum_id":"CCMSLIB00017317282","spectrum_index":50742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 39.0899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017317283","spectrum_index":50743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 72.018 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.105,"smiles":null,"spectrum_id":"CCMSLIB00017317284","spectrum_index":50744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 158.0218 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.134,"smiles":null,"spectrum_id":"CCMSLIB00017317285","spectrum_index":50745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 31.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.227,"smiles":null,"spectrum_id":"CCMSLIB00017317286","spectrum_index":50746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 148.0893 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.171,"smiles":null,"spectrum_id":"CCMSLIB00017317287","spectrum_index":50747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 52.9938 Da; putative annotation: N/A; putative formula: C2H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.07,"smiles":null,"spectrum_id":"CCMSLIB00017317288","spectrum_index":50748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 89.0477 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.139,"smiles":null,"spectrum_id":"CCMSLIB00017317289","spectrum_index":50749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 109.0389 Da; putative annotation: N/A; putative formula: C3H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.177,"smiles":null,"spectrum_id":"CCMSLIB00017317290","spectrum_index":50750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 188.059 Da; putative annotation: N/A; putative formula: C10H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.14,"smiles":null,"spectrum_id":"CCMSLIB00017317291","spectrum_index":50751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 28.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.153,"smiles":null,"spectrum_id":"CCMSLIB00017317292","spectrum_index":50752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 53.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.113,"smiles":null,"spectrum_id":"CCMSLIB00017317293","spectrum_index":50753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Thr (delta mass: 113.0844 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.177,"smiles":null,"spectrum_id":"CCMSLIB00017317294","spectrum_index":50754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 241.1613 Da; putative annotation: N/A; putative formula: C12H23N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.24,"smiles":null,"spectrum_id":"CCMSLIB00017317295","spectrum_index":50755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 504.169 Da; putative annotation: N/A; putative formula: C18H32O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":847.292,"smiles":null,"spectrum_id":"CCMSLIB00017317296","spectrum_index":50756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 426.0982 Da; putative annotation: N/A; putative formula: C21H19N2O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.216,"smiles":null,"spectrum_id":"CCMSLIB00017317297","spectrum_index":50757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 408.1253 Da; putative annotation: N/A; putative formula: C23H17N6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":735.254,"smiles":null,"spectrum_id":"CCMSLIB00017317298","spectrum_index":50758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1,N1-dimethyl-N2-phenyl-1,2-ethanediamine (delta mass: 135.1103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.249,"smiles":null,"spectrum_id":"CCMSLIB00017317299","spectrum_index":50759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 115.1009 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.228,"smiles":null,"spectrum_id":"CCMSLIB00017317300","spectrum_index":50760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 72.4403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.5,"smiles":null,"spectrum_id":"CCMSLIB00017317301","spectrum_index":50761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 43.0841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.254,"smiles":null,"spectrum_id":"CCMSLIB00017317302","spectrum_index":50762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 148.0888 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017317303","spectrum_index":50763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 99.0668 Da; putative annotation: N/A; putative formula: CH5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.109,"smiles":null,"spectrum_id":"CCMSLIB00017317304","spectrum_index":50764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 227.1599 Da; putative annotation: N/A; putative formula: C10H21N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.34,"smiles":null,"spectrum_id":"CCMSLIB00017317305","spectrum_index":50765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 12.0003 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.134,"smiles":null,"spectrum_id":"CCMSLIB00017317306","spectrum_index":50766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 153.0096 Da; putative annotation: N/A; putative formula: C3H7NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.101,"smiles":null,"spectrum_id":"CCMSLIB00017317307","spectrum_index":50767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 560.2282 Da; putative annotation: N/A; putative formula: C31H28N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.315,"smiles":null,"spectrum_id":"CCMSLIB00017317308","spectrum_index":50768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 254.1244 Da; putative annotation: N/A; putative formula: C16H18N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.203,"smiles":null,"spectrum_id":"CCMSLIB00017317309","spectrum_index":50769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 291.0271 Da; putative annotation: N/A; putative formula: C17H10NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.191,"smiles":null,"spectrum_id":"CCMSLIB00017317310","spectrum_index":50770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinidine (delta mass: 232.1359 Da; putative annotation: N/A; putative formula: C9H20N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.327,"smiles":null,"spectrum_id":"CCMSLIB00017317311","spectrum_index":50771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 113.0112 Da; putative annotation: N/A; putative formula: C4H3NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.124,"smiles":null,"spectrum_id":"CCMSLIB00017317312","spectrum_index":50772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 23.0153 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.127,"smiles":null,"spectrum_id":"CCMSLIB00017317313","spectrum_index":50773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl N-[2-amino-4-(trifluoromethyl)phenyl]carbamate (delta mass: 45.9971 Da; putative annotation: N/A; putative formula: CH3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.113,"smiles":null,"spectrum_id":"CCMSLIB00017317314","spectrum_index":50774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 207.915 Da; putative annotation: N/A; putative formula: C5H4OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.074,"smiles":null,"spectrum_id":"CCMSLIB00017317315","spectrum_index":50775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 9.9512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.027,"smiles":null,"spectrum_id":"CCMSLIB00017317316","spectrum_index":50776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 206.2398 Da; putative annotation: N/A; putative formula: C16H30O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.3,"smiles":null,"spectrum_id":"CCMSLIB00017317317","spectrum_index":50777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 28.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.139,"smiles":null,"spectrum_id":"CCMSLIB00017317318","spectrum_index":50778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Trehalose (delta mass: 176.0687 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.192,"smiles":null,"spectrum_id":"CCMSLIB00017317319","spectrum_index":50779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 234.9504 Da; putative annotation: N/A; putative formula: C8HN3O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.026,"smiles":null,"spectrum_id":"CCMSLIB00017317320","spectrum_index":50780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 71.0376 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.14,"smiles":null,"spectrum_id":"CCMSLIB00017317321","spectrum_index":50781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine, 6-sulfate (delta mass: 28.0409 Da; putative annotation: N/A; putative formula: CH4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.084,"smiles":null,"spectrum_id":"CCMSLIB00017317322","spectrum_index":50782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 76.0411 Da; putative annotation: N/A; putative formula: C5H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.128,"smiles":null,"spectrum_id":"CCMSLIB00017317323","spectrum_index":50783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 42.0621 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017317324","spectrum_index":50784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 540.346 Da; putative annotation: N/A; putative formula: C34H52OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.422,"smiles":null,"spectrum_id":"CCMSLIB00017317325","spectrum_index":50785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 46.0673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.154,"smiles":null,"spectrum_id":"CCMSLIB00017317326","spectrum_index":50786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 48.0011 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.093,"smiles":null,"spectrum_id":"CCMSLIB00017317327","spectrum_index":50787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 244.2178 Da; putative annotation: N/A; putative formula: C12H29N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.309,"smiles":null,"spectrum_id":"CCMSLIB00017317328","spectrum_index":50788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 326.0429 Da; putative annotation: N/A; putative formula: C10H18N2O4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.103,"smiles":null,"spectrum_id":"CCMSLIB00017317329","spectrum_index":50789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 432.2776 Da; putative annotation: N/A; putative formula: C28H36N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.463,"smiles":null,"spectrum_id":"CCMSLIB00017317330","spectrum_index":50790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 92.0986 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.341,"smiles":null,"spectrum_id":"CCMSLIB00017317331","spectrum_index":50791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cyclo(L-Val-L-Pro) (delta mass: 273.1686 Da; putative annotation: N/A; putative formula: C17H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.297,"smiles":null,"spectrum_id":"CCMSLIB00017317332","spectrum_index":50792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 154.1443 Da; putative annotation: N/A; putative formula: C9H18N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017317333","spectrum_index":50793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 160.0784 Da; putative annotation: N/A; putative formula: C5H12N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.181,"smiles":null,"spectrum_id":"CCMSLIB00017317334","spectrum_index":50794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 176.1067 Da; putative annotation: N/A; putative formula: C9H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.212,"smiles":null,"spectrum_id":"CCMSLIB00017317335","spectrum_index":50795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4,5,7-trimethyl-6-(piperidylsulfonyl)hydroquinolin-2-one CollisionEnergy:205060\"\" (delta mass: 32.0228 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.165,"smiles":null,"spectrum_id":"CCMSLIB00017317336","spectrum_index":50796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 108.0205 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.101,"smiles":null,"spectrum_id":"CCMSLIB00017317337","spectrum_index":50797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Laetanine (delta mass: 42.0088 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.147,"smiles":null,"spectrum_id":"CCMSLIB00017317338","spectrum_index":50798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 680.7394 Da; putative annotation: N/A; putative formula: C48H92N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":834.826,"smiles":null,"spectrum_id":"CCMSLIB00017317339","spectrum_index":50799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 61.0059 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.086,"smiles":null,"spectrum_id":"CCMSLIB00017317340","spectrum_index":50800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 422.0802 Da; putative annotation: N/A; putative formula: C16H23O9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.177,"smiles":null,"spectrum_id":"CCMSLIB00017317341","spectrum_index":50801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 389.2996 Da; putative annotation: N/A; putative formula: C18H39N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.365,"smiles":null,"spectrum_id":"CCMSLIB00017317342","spectrum_index":50802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 317.2443 Da; putative annotation: N/A; putative formula: C15H27N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.424,"smiles":null,"spectrum_id":"CCMSLIB00017317343","spectrum_index":50803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 351.177 Da; putative annotation: N/A; putative formula: C21H25N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":623.305,"smiles":null,"spectrum_id":"CCMSLIB00017317344","spectrum_index":50804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 56.0517 Da; putative annotation: N/A; putative formula: CH4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.057,"smiles":null,"spectrum_id":"CCMSLIB00017317345","spectrum_index":50805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 35.0369 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.108,"smiles":null,"spectrum_id":"CCMSLIB00017317346","spectrum_index":50806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 73.0447 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.189,"smiles":null,"spectrum_id":"CCMSLIB00017317347","spectrum_index":50807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 561.2204 Da; putative annotation: N/A; putative formula: C41H27N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":768.307,"smiles":null,"spectrum_id":"CCMSLIB00017317348","spectrum_index":50808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00178646-02!2,4-dihydroxyheptadecyl acetate (delta mass: 82.0787 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.363,"smiles":null,"spectrum_id":"CCMSLIB00017317349","spectrum_index":50809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)-N-propyl-2-thiophenecarboxamide (delta mass: 36.0387 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.176,"smiles":null,"spectrum_id":"CCMSLIB00017317350","spectrum_index":50810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 165.0742 Da; putative annotation: N/A; putative formula: C4H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.155,"smiles":null,"spectrum_id":"CCMSLIB00017317351","spectrum_index":50811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Guanidinopropionic acid (delta mass: 1.968 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.045,"smiles":null,"spectrum_id":"CCMSLIB00017317352","spectrum_index":50812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 352.3348 Da; putative annotation: N/A; putative formula: C23H44O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.452,"smiles":null,"spectrum_id":"CCMSLIB00017317353","spectrum_index":50813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 27.0544 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.151,"smiles":null,"spectrum_id":"CCMSLIB00017317354","spectrum_index":50814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00341 Oxamniquine (delta mass: 129.0704 Da; putative annotation: N/A; putative formula: C6H12NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.236,"smiles":null,"spectrum_id":"CCMSLIB00017317355","spectrum_index":50815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 748.4397 Da; putative annotation: N/A; putative formula: C41H64O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":913.515,"smiles":null,"spectrum_id":"CCMSLIB00017317356","spectrum_index":50816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 9.984 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.149,"smiles":null,"spectrum_id":"CCMSLIB00017317357","spectrum_index":50817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 224.1691 Da; putative annotation: N/A; putative formula: C14H25P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.276,"smiles":null,"spectrum_id":"CCMSLIB00017317358","spectrum_index":50818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corynoline (delta mass: 60.0941 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.243,"smiles":null,"spectrum_id":"CCMSLIB00017317359","spectrum_index":50819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 86.0601 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.141,"smiles":null,"spectrum_id":"CCMSLIB00017317360","spectrum_index":50820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 128.0585 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.187,"smiles":null,"spectrum_id":"CCMSLIB00017317361","spectrum_index":50821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]-, ethyl ester (delta mass: 80.0635 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.287,"smiles":null,"spectrum_id":"CCMSLIB00017317362","spectrum_index":50822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 131.1524 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.212,"smiles":null,"spectrum_id":"CCMSLIB00017317363","spectrum_index":50823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 45.078 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.16,"smiles":null,"spectrum_id":"CCMSLIB00017317364","spectrum_index":50824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 156.1282 Da; putative annotation: N/A; putative formula: C8H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.303,"smiles":null,"spectrum_id":"CCMSLIB00017317365","spectrum_index":50825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 111.0327 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.114,"smiles":null,"spectrum_id":"CCMSLIB00017317366","spectrum_index":50826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homoveratrylamine (delta mass: 136.0162 Da; putative annotation: N/A; putative formula: C7H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.134,"smiles":null,"spectrum_id":"CCMSLIB00017317367","spectrum_index":50827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eseroline (delta mass: 48.0459 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.195,"smiles":null,"spectrum_id":"CCMSLIB00017317368","spectrum_index":50828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 712.5043 Da; putative annotation: N/A; putative formula: C40H73O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":902.573,"smiles":null,"spectrum_id":"CCMSLIB00017317369","spectrum_index":50829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 30.0 eV (delta mass: 78.0443 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.12,"smiles":null,"spectrum_id":"CCMSLIB00017317370","spectrum_index":50830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 119.0374 Da; putative annotation: Anthranilic acid; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.098,"smiles":null,"spectrum_id":"CCMSLIB00017317371","spectrum_index":50831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 430.0906 Da; putative annotation: 5-(5,7-Dihydroxy-3-methoxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl .beta.-D-xylopyranoside; putative formula: C21H18O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.151,"smiles":null,"spectrum_id":"CCMSLIB00017317372","spectrum_index":50832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 60.0 eV (delta mass: 119.0713 Da; putative annotation: 2-Amino-1-phenylethanol; putative formula: C8H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.147,"smiles":null,"spectrum_id":"CCMSLIB00017317373","spectrum_index":50833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 123.0677 Da; putative annotation: Ethosuximide; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.138,"smiles":null,"spectrum_id":"CCMSLIB00017317374","spectrum_index":50834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 144.0554 Da; putative annotation: 4-Methylcinnamic acid; putative formula: C10H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.126,"smiles":null,"spectrum_id":"CCMSLIB00017317375","spectrum_index":50835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 208.087 Da; putative annotation: PyroGlu-Pro; putative formula: C10H12N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.242,"smiles":null,"spectrum_id":"CCMSLIB00017317376","spectrum_index":50836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 119.0379 Da; putative annotation: 4-AMINOBENZOATE - 20.0 eV; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.161,"smiles":null,"spectrum_id":"CCMSLIB00017317377","spectrum_index":50837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 193.0748 Da; putative annotation: 6-Maleimidocaproic acid; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.167,"smiles":null,"spectrum_id":"CCMSLIB00017317378","spectrum_index":50838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 102.047 Da; putative annotation: 4-Vinylphenol; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.196,"smiles":null,"spectrum_id":"CCMSLIB00017317379","spectrum_index":50839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 780.465 Da; putative annotation: NCGC00179944-04_C42H70O14_(24Z)-26-(Hexopyranosyloxy)-1,21-dihydroxy-9,19-cyclolanost-24-en-3-yl hexopyranoside; putative formula: C42H68O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.536,"smiles":null,"spectrum_id":"CCMSLIB00017317380","spectrum_index":50840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 198.1045 Da; putative annotation: (1R,6R)-6-Benzylcyclohex-3-enecarboxylic acid; putative formula: C14H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.17,"smiles":null,"spectrum_id":"CCMSLIB00017317381","spectrum_index":50841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 256.0688 Da; putative annotation: N/A; putative formula: C12H17O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.15,"smiles":null,"spectrum_id":"CCMSLIB00017317382","spectrum_index":50842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 249.0898 Da; putative annotation: N/A; putative formula: C7H15N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.181,"smiles":null,"spectrum_id":"CCMSLIB00017317383","spectrum_index":50843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 58.0416 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.143,"smiles":null,"spectrum_id":"CCMSLIB00017317384","spectrum_index":50844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 53.9189 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.99,"smiles":null,"spectrum_id":"CCMSLIB00017317385","spectrum_index":50845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 162.0274 Da; putative annotation: N/A; putative formula: C4H6N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.15,"smiles":null,"spectrum_id":"CCMSLIB00017317386","spectrum_index":50846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 80.062 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.133,"smiles":null,"spectrum_id":"CCMSLIB00017317387","spectrum_index":50847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 239.1435 Da; putative annotation: N/A; putative formula: C13H22NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.224,"smiles":null,"spectrum_id":"CCMSLIB00017317388","spectrum_index":50848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 77.0846 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.26,"smiles":null,"spectrum_id":"CCMSLIB00017317389","spectrum_index":50849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 136.067 Da; putative annotation: N/A; putative formula: C12H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.19,"smiles":null,"spectrum_id":"CCMSLIB00017317390","spectrum_index":50850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 132.0371 Da; putative annotation: N/A; putative formula: C4H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.083,"smiles":null,"spectrum_id":"CCMSLIB00017317391","spectrum_index":50851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 401.1392 Da; putative annotation: N/A; putative formula: C21H24NO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.22,"smiles":null,"spectrum_id":"CCMSLIB00017317392","spectrum_index":50852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Bromo-5-chloropyridin-2-ol (delta mass: 384.3458 Da; putative annotation: N/A; putative formula: C21H44N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.262,"smiles":null,"spectrum_id":"CCMSLIB00017317393","spectrum_index":50853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 25.0006 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.076,"smiles":null,"spectrum_id":"CCMSLIB00017317394","spectrum_index":50854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 197.2212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.401,"smiles":null,"spectrum_id":"CCMSLIB00017317395","spectrum_index":50855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 119.0586 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.176,"smiles":null,"spectrum_id":"CCMSLIB00017317396","spectrum_index":50856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 18.1384 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.24,"smiles":null,"spectrum_id":"CCMSLIB00017317397","spectrum_index":50857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 699.3105 Da; putative annotation: N/A; putative formula: C47H45N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1030.46,"smiles":null,"spectrum_id":"CCMSLIB00017317398","spectrum_index":50858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 241.2828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.442,"smiles":null,"spectrum_id":"CCMSLIB00017317399","spectrum_index":50859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 186.0307 Da; putative annotation: N/A; putative formula: C11H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.096,"smiles":null,"spectrum_id":"CCMSLIB00017317400","spectrum_index":50860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 159.0462 Da; putative annotation: N/A; putative formula: C5H9N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.111,"smiles":null,"spectrum_id":"CCMSLIB00017317401","spectrum_index":50861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Acetamido-2-methyl-7-oxononanoic acid (delta mass: 50.0495 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.204,"smiles":null,"spectrum_id":"CCMSLIB00017317402","spectrum_index":50862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lysergol CollisionEnergy:205060 (delta mass: 45.9918 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.141,"smiles":null,"spectrum_id":"CCMSLIB00017317403","spectrum_index":50863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 54.0317 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017317404","spectrum_index":50864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 88.0886 Da; putative annotation: N/A; putative formula: CH8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017317405","spectrum_index":50865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 647.2784 Da; putative annotation: N/A; putative formula: C42H37N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":853.36,"smiles":null,"spectrum_id":"CCMSLIB00017317406","spectrum_index":50866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 241.086 Da; putative annotation: N/A; putative formula: C11H16NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.272,"smiles":null,"spectrum_id":"CCMSLIB00017317407","spectrum_index":50867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ala (delta mass: 353.3991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.481,"smiles":null,"spectrum_id":"CCMSLIB00017317408","spectrum_index":50868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 13.0173 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.14,"smiles":null,"spectrum_id":"CCMSLIB00017317409","spectrum_index":50869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 64.0317 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.259,"smiles":null,"spectrum_id":"CCMSLIB00017317410","spectrum_index":50870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 5.473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017317411","spectrum_index":50871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 271.1534 Da; putative annotation: N/A; putative formula: C12H21N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.245,"smiles":null,"spectrum_id":"CCMSLIB00017317412","spectrum_index":50872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 557.2487 Da; putative annotation: N/A; putative formula: C27H35N5O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.34,"smiles":null,"spectrum_id":"CCMSLIB00017317413","spectrum_index":50873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 218.0918 Da; putative annotation: N/A; putative formula: C9H10N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.172,"smiles":null,"spectrum_id":"CCMSLIB00017317414","spectrum_index":50874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 122.0368 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017317415","spectrum_index":50875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 132.115 Da; putative annotation: N/A; putative formula: C3H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.263,"smiles":null,"spectrum_id":"CCMSLIB00017317416","spectrum_index":50876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 63.9963 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.098,"smiles":null,"spectrum_id":"CCMSLIB00017317417","spectrum_index":50877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.beta.-Homoserine (delta mass: 28.9921 Da; putative annotation: N/A; putative formula: H-1NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":149.058,"smiles":null,"spectrum_id":"CCMSLIB00017317418","spectrum_index":50878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norcodeine (delta mass: 79.1011 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.245,"smiles":null,"spectrum_id":"CCMSLIB00017317419","spectrum_index":50879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 96.046 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.149,"smiles":null,"spectrum_id":"CCMSLIB00017317420","spectrum_index":50880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 9.9707 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.058,"smiles":null,"spectrum_id":"CCMSLIB00017317421","spectrum_index":50881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 117.0796 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.181,"smiles":null,"spectrum_id":"CCMSLIB00017317422","spectrum_index":50882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 114.1047 Da; putative annotation: N/A; putative formula: C7H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.202,"smiles":null,"spectrum_id":"CCMSLIB00017317423","spectrum_index":50883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 198.1188 Da; putative annotation: N/A; putative formula: C10H18N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.194,"smiles":null,"spectrum_id":"CCMSLIB00017317424","spectrum_index":50884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 300.1399 Da; putative annotation: N/A; putative formula: C15H24O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.267,"smiles":null,"spectrum_id":"CCMSLIB00017317425","spectrum_index":50885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 232.0403 Da; putative annotation: N/A; putative formula: C11H9N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.127,"smiles":null,"spectrum_id":"CCMSLIB00017317426","spectrum_index":50886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 98.0727 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.248,"smiles":null,"spectrum_id":"CCMSLIB00017317427","spectrum_index":50887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.alpha.-L-fucopyranosyl)-D-glucopyranose (delta mass: 826.3222 Da; putative annotation: N/A; putative formula: C48H50N4O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1194.48,"smiles":null,"spectrum_id":"CCMSLIB00017317428","spectrum_index":50888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 33.0367 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.112,"smiles":null,"spectrum_id":"CCMSLIB00017317429","spectrum_index":50889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 166.4017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.504,"smiles":null,"spectrum_id":"CCMSLIB00017317430","spectrum_index":50890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 410.1063 Da; putative annotation: N/A; putative formula: C21H14N8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.168,"smiles":null,"spectrum_id":"CCMSLIB00017317431","spectrum_index":50891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Ethylthio)-5-methoxy-1H-benzimidazole (delta mass: 123.0382 Da; putative annotation: N/A; putative formula: H5N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.112,"smiles":null,"spectrum_id":"CCMSLIB00017317432","spectrum_index":50892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 190.1205 Da; putative annotation: N/A; putative formula: C9H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.196,"smiles":null,"spectrum_id":"CCMSLIB00017317433","spectrum_index":50893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 9.9847 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.159,"smiles":null,"spectrum_id":"CCMSLIB00017317434","spectrum_index":50894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-4-methyl- (delta mass: 90.0427 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.233,"smiles":null,"spectrum_id":"CCMSLIB00017317435","spectrum_index":50895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 346.1382 Da; putative annotation: N/A; putative formula: C15H26N2O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.272,"smiles":null,"spectrum_id":"CCMSLIB00017317436","spectrum_index":50896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl Gramine (delta mass: 271.0996 Da; putative annotation: N/A; putative formula: C19H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.238,"smiles":null,"spectrum_id":"CCMSLIB00017317437","spectrum_index":50897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 341.1276 Da; putative annotation: N/A; putative formula: C20H15N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.304,"smiles":null,"spectrum_id":"CCMSLIB00017317438","spectrum_index":50898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 72.028 Da; putative annotation: N/A; putative formula: C2H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.131,"smiles":null,"spectrum_id":"CCMSLIB00017317439","spectrum_index":50899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 72.0362 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.101,"smiles":null,"spectrum_id":"CCMSLIB00017317440","spectrum_index":50900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 57.029 Da; putative annotation: N/A; putative formula: CH3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.108,"smiles":null,"spectrum_id":"CCMSLIB00017317441","spectrum_index":50901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 674.543 Da; putative annotation: N/A; putative formula: C34H66N12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":860.614,"smiles":null,"spectrum_id":"CCMSLIB00017317442","spectrum_index":50902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 333.1434 Da; putative annotation: N/A; putative formula: C15H27NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.255,"smiles":null,"spectrum_id":"CCMSLIB00017317443","spectrum_index":50903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 40.9613 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.084,"smiles":null,"spectrum_id":"CCMSLIB00017317444","spectrum_index":50904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 99.0913 Da; putative annotation: N/A; putative formula: C3H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.167,"smiles":null,"spectrum_id":"CCMSLIB00017317445","spectrum_index":50905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 96.0507 Da; putative annotation: N/A; putative formula: C6H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.137,"smiles":null,"spectrum_id":"CCMSLIB00017317446","spectrum_index":50906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 110.0476 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.134,"smiles":null,"spectrum_id":"CCMSLIB00017317447","spectrum_index":50907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 65.0887 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.227,"smiles":null,"spectrum_id":"CCMSLIB00017317448","spectrum_index":50908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 156.0921 Da; putative annotation: N/A; putative formula: C6H13N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.221,"smiles":null,"spectrum_id":"CCMSLIB00017317449","spectrum_index":50909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 31.0411 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.113,"smiles":null,"spectrum_id":"CCMSLIB00017317450","spectrum_index":50910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00178646-02!2,4-dihydroxyheptadecyl acetate [IIN-based: Match] (delta mass: 92.0968 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.381,"smiles":null,"spectrum_id":"CCMSLIB00017317451","spectrum_index":50911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 78.1803 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.24,"smiles":null,"spectrum_id":"CCMSLIB00017317452","spectrum_index":50912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 162.0497 Da; putative annotation: N/A; putative formula: C4H11N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.162,"smiles":null,"spectrum_id":"CCMSLIB00017317453","spectrum_index":50913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 123.0681 Da; putative annotation: N/A; putative formula: C5H8F3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.128,"smiles":null,"spectrum_id":"CCMSLIB00017317454","spectrum_index":50914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(3-acetamidophenyl)-3-methylpentanamide (delta mass: 3.1874 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.5,"smiles":null,"spectrum_id":"CCMSLIB00017317455","spectrum_index":50915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 255.1475 Da; putative annotation: N/A; putative formula: C14H25NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.249,"smiles":null,"spectrum_id":"CCMSLIB00017317456","spectrum_index":50916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 64.0007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.089,"smiles":null,"spectrum_id":"CCMSLIB00017317457","spectrum_index":50917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 127.0635 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.123,"smiles":null,"spectrum_id":"CCMSLIB00017317458","spectrum_index":50918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 179.1525 Da; putative annotation: N/A; putative formula: C9H17N5O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017317459","spectrum_index":50919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101901 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 43.0423 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.129,"smiles":null,"spectrum_id":"CCMSLIB00017317460","spectrum_index":50920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 297.1176 Da; putative annotation: N/A; putative formula: C9H19N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.209,"smiles":null,"spectrum_id":"CCMSLIB00017317461","spectrum_index":50921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 161.0477 Da; putative annotation: N/A; putative formula: C9H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017317462","spectrum_index":50922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 289.1724 Da; putative annotation: N/A; putative formula: C14H29NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.22,"smiles":null,"spectrum_id":"CCMSLIB00017317463","spectrum_index":50923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 164.8262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.94,"smiles":null,"spectrum_id":"CCMSLIB00017317464","spectrum_index":50924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 111.0587 Da; putative annotation: N/A; putative formula: C6H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.15,"smiles":null,"spectrum_id":"CCMSLIB00017317465","spectrum_index":50925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 102.0317 Da; putative annotation: N/A; putative formula: C5H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.071,"smiles":null,"spectrum_id":"CCMSLIB00017317466","spectrum_index":50926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dovitinib (delta mass: 370.205 Da; putative annotation: N/A; putative formula: C18H26N8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":763.388,"smiles":null,"spectrum_id":"CCMSLIB00017317467","spectrum_index":50927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 197.0688 Da; putative annotation: N/A; putative formula: C10H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.139,"smiles":null,"spectrum_id":"CCMSLIB00017317468","spectrum_index":50928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N'-(7-Fluoropyrrolo[1,2-a]quinoxalin-4-yl)pyrazinohydrazide (delta mass: 224.0715 Da; putative annotation: N/A; putative formula: C10H13N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.177,"smiles":null,"spectrum_id":"CCMSLIB00017317469","spectrum_index":50929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 138.0899 Da; putative annotation: N/A; putative formula: C6H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.259,"smiles":null,"spectrum_id":"CCMSLIB00017317470","spectrum_index":50930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 341.1317 Da; putative annotation: N/A; putative formula: C25H15N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":672.286,"smiles":null,"spectrum_id":"CCMSLIB00017317471","spectrum_index":50931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Asp-Lys (delta mass: 85.0893 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.282,"smiles":null,"spectrum_id":"CCMSLIB00017317472","spectrum_index":50932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 210.0987 Da; putative annotation: N/A; putative formula: C10H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.222,"smiles":null,"spectrum_id":"CCMSLIB00017317473","spectrum_index":50933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 212.1054 Da; putative annotation: N/A; putative formula: C6H13N8O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.202,"smiles":null,"spectrum_id":"CCMSLIB00017317474","spectrum_index":50934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 70.0417 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017317475","spectrum_index":50935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-3,4-(methylenedioxy)benzylamine (delta mass: 48.0363 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.123,"smiles":null,"spectrum_id":"CCMSLIB00017317476","spectrum_index":50936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ecgonine-methyl-ester (EME) (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.123,"smiles":null,"spectrum_id":"CCMSLIB00017317477","spectrum_index":50937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dimethylquinolin-8-ol (delta mass: 28.0309 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.122,"smiles":null,"spectrum_id":"CCMSLIB00017317478","spectrum_index":50938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylbutanoic acid (delta mass: 43.0537 Da; putative annotation: N/A; putative formula: CH5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.14,"smiles":null,"spectrum_id":"CCMSLIB00017317479","spectrum_index":50939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 101.9481 Da; putative annotation: N/A; putative formula: H-2N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.019,"smiles":null,"spectrum_id":"CCMSLIB00017317480","spectrum_index":50940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 989.3423 Da; putative annotation: N/A; putative formula: C54H51N7O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1332.47,"smiles":null,"spectrum_id":"CCMSLIB00017317481","spectrum_index":50941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 78.047 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017317482","spectrum_index":50942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 36.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.17,"smiles":null,"spectrum_id":"CCMSLIB00017317483","spectrum_index":50943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levodopa - 30.0 eV (delta mass: 129.2607 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.337,"smiles":null,"spectrum_id":"CCMSLIB00017317484","spectrum_index":50944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 1078.2833 Da; putative annotation: N/A; putative formula: C56H46N12O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1388.4,"smiles":null,"spectrum_id":"CCMSLIB00017317485","spectrum_index":50945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dihydroxybenzaldehyde (delta mass: 78.0302 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.069,"smiles":null,"spectrum_id":"CCMSLIB00017317486","spectrum_index":50946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 322.4282 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.525,"smiles":null,"spectrum_id":"CCMSLIB00017317487","spectrum_index":50947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 50.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017317488","spectrum_index":50948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 208.0959 Da; putative annotation: N/A; putative formula: C9H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.182,"smiles":null,"spectrum_id":"CCMSLIB00017317489","spectrum_index":50949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 378.2964 Da; putative annotation: N/A; putative formula: C17H34N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.45,"smiles":null,"spectrum_id":"CCMSLIB00017317490","spectrum_index":50950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 317.2358 Da; putative annotation: N/A; putative formula: C20H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.338,"smiles":null,"spectrum_id":"CCMSLIB00017317491","spectrum_index":50951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 49.0057 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.108,"smiles":null,"spectrum_id":"CCMSLIB00017317492","spectrum_index":50952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 41.0601 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.157,"smiles":null,"spectrum_id":"CCMSLIB00017317493","spectrum_index":50953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gabapentin (delta mass: 136.0889 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.222,"smiles":null,"spectrum_id":"CCMSLIB00017317494","spectrum_index":50954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]cyclopropanecarboxamide (delta mass: 77.0842 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.228,"smiles":null,"spectrum_id":"CCMSLIB00017317495","spectrum_index":50955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 282.1014 Da; putative annotation: N/A; putative formula: C9H14N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.188,"smiles":null,"spectrum_id":"CCMSLIB00017317496","spectrum_index":50956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 234.055 Da; putative annotation: N/A; putative formula: C6H6N10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.135,"smiles":null,"spectrum_id":"CCMSLIB00017317497","spectrum_index":50957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aloesin (delta mass: 70.042 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.176,"smiles":null,"spectrum_id":"CCMSLIB00017317498","spectrum_index":50958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 429.3723 Da; putative annotation: N/A; putative formula: C20H47N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.5,"smiles":null,"spectrum_id":"CCMSLIB00017317499","spectrum_index":50959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 460.3458 Da; putative annotation: N/A; putative formula: C31H44N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.474,"smiles":null,"spectrum_id":"CCMSLIB00017317500","spectrum_index":50960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 90.0565 Da; putative annotation: N/A; putative formula: C6H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.18,"smiles":null,"spectrum_id":"CCMSLIB00017317501","spectrum_index":50961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 10.9673 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.064,"smiles":null,"spectrum_id":"CCMSLIB00017317502","spectrum_index":50962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 65.0262 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.149,"smiles":null,"spectrum_id":"CCMSLIB00017317503","spectrum_index":50963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Volinanserin (delta mass: 18.015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.228,"smiles":null,"spectrum_id":"CCMSLIB00017317504","spectrum_index":50964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 126.1617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.227,"smiles":null,"spectrum_id":"CCMSLIB00017317505","spectrum_index":50965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 100.0312 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.143,"smiles":null,"spectrum_id":"CCMSLIB00017317506","spectrum_index":50966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 149.0338 Da; putative annotation: N/A; putative formula: C5H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.157,"smiles":null,"spectrum_id":"CCMSLIB00017317507","spectrum_index":50967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 239.155 Da; putative annotation: N/A; putative formula: C12H22N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.247,"smiles":null,"spectrum_id":"CCMSLIB00017317508","spectrum_index":50968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 480.1459 Da; putative annotation: N/A; putative formula: C16H28N6O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.186,"smiles":null,"spectrum_id":"CCMSLIB00017317509","spectrum_index":50969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 105.0199 Da; putative annotation: Massbank:PR100155 Isonicotinic acid|INA|4-Picolinic acid|4-Pyridinecarboxylic Acid|4-Carboxypyridine; putative formula: C6H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.08,"smiles":null,"spectrum_id":"CCMSLIB00017317510","spectrum_index":50970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 226.168 Da; putative annotation: Ile-Leu; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.302,"smiles":null,"spectrum_id":"CCMSLIB00017317511","spectrum_index":50971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 128.0585 Da; putative annotation: Massbank:PB000465 Glutamine|2,5-diamino-5-oxopentanoic acid; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.219,"smiles":null,"spectrum_id":"CCMSLIB00017317512","spectrum_index":50972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-mannosamine - 40.0 eV (delta mass: 131.0409 Da; putative annotation: L-Methionine; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.138,"smiles":null,"spectrum_id":"CCMSLIB00017317513","spectrum_index":50973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 162.0686 Da; putative annotation: 3-(3-Methoxyphenyl)propionic acid; putative formula: C10H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.139,"smiles":null,"spectrum_id":"CCMSLIB00017317514","spectrum_index":50974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310692 Disaccharide(Hex-Hex) (delta mass: 324.1061 Da; putative annotation: .beta.-Gentiobiose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.23,"smiles":null,"spectrum_id":"CCMSLIB00017317515","spectrum_index":50975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Leu (delta mass: 85.0898 Da; putative annotation: 3-Aminopentan-2-ol; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.219,"smiles":null,"spectrum_id":"CCMSLIB00017317516","spectrum_index":50976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Ala (delta mass: 115.0638 Da; putative annotation: N-Methyl-L-threonine; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.151,"smiles":null,"spectrum_id":"CCMSLIB00017317517","spectrum_index":50977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 98.073 Da; putative annotation: Diethylacetic acid; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.159,"smiles":null,"spectrum_id":"CCMSLIB00017317518","spectrum_index":50978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 306.2454 Da; putative annotation: N/A; putative formula: C22H30N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.3,"smiles":null,"spectrum_id":"CCMSLIB00017317519","spectrum_index":50979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Arabinose (delta mass: 124.0675 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.128,"smiles":null,"spectrum_id":"CCMSLIB00017317520","spectrum_index":50980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannose 6-phosphate (delta mass: 101.9965 Da; putative annotation: N/A; putative formula: C4H-2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.034,"smiles":null,"spectrum_id":"CCMSLIB00017317521","spectrum_index":50981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzylpenicillin_20eV (delta mass: 291.0947 Da; putative annotation: N/A; putative formula: C16H13N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.201,"smiles":null,"spectrum_id":"CCMSLIB00017317522","spectrum_index":50982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 166.0779 Da; putative annotation: N/A; putative formula: C13H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.201,"smiles":null,"spectrum_id":"CCMSLIB00017317523","spectrum_index":50983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 595.4951 Da; putative annotation: N/A; putative formula: C35H61N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":779.592,"smiles":null,"spectrum_id":"CCMSLIB00017317524","spectrum_index":50984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyl-beta-D-galactosamine - 40.0 eV (delta mass: 385.9912 Da; putative annotation: N/A; putative formula: C10H14N2O8S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.088,"smiles":null,"spectrum_id":"CCMSLIB00017317525","spectrum_index":50985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 92.0992 Da; putative annotation: N/A; putative formula: C8H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.164,"smiles":null,"spectrum_id":"CCMSLIB00017317526","spectrum_index":50986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 192.1516 Da; putative annotation: N/A; putative formula: C13H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.275,"smiles":null,"spectrum_id":"CCMSLIB00017317527","spectrum_index":50987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 124.0157 Da; putative annotation: N/A; putative formula: C6H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.086,"smiles":null,"spectrum_id":"CCMSLIB00017317528","spectrum_index":50988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eglumegad (delta mass: 26.0159 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.092,"smiles":null,"spectrum_id":"CCMSLIB00017317529","spectrum_index":50989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 85.9969 Da; putative annotation: N/A; putative formula: C2H2N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.11,"smiles":null,"spectrum_id":"CCMSLIB00017317530","spectrum_index":50990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 18.0882 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.14,"smiles":null,"spectrum_id":"CCMSLIB00017317531","spectrum_index":50991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 852.4146 Da; putative annotation: N/A; putative formula: C38H61N8O12P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1059.5,"smiles":null,"spectrum_id":"CCMSLIB00017317532","spectrum_index":50992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 183.0485 Da; putative annotation: N/A; putative formula: C7H11N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.119,"smiles":null,"spectrum_id":"CCMSLIB00017317533","spectrum_index":50993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 97.0639 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.113,"smiles":null,"spectrum_id":"CCMSLIB00017317534","spectrum_index":50994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 74.037 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.201,"smiles":null,"spectrum_id":"CCMSLIB00017317535","spectrum_index":50995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 258.1165 Da; putative annotation: N/A; putative formula: C10H20N4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.207,"smiles":null,"spectrum_id":"CCMSLIB00017317536","spectrum_index":50996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 1494.6223 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1701.71,"smiles":null,"spectrum_id":"CCMSLIB00017317537","spectrum_index":50997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 239.1899 Da; putative annotation: N/A; putative formula: C14H25NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.271,"smiles":null,"spectrum_id":"CCMSLIB00017317538","spectrum_index":50998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 32.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.222,"smiles":null,"spectrum_id":"CCMSLIB00017317539","spectrum_index":50999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 199.0482 Da; putative annotation: N/A; putative formula: C8H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.171,"smiles":null,"spectrum_id":"CCMSLIB00017317540","spectrum_index":51000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 491.4734 Da; putative annotation: N/A; putative formula: C32H61NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":677.545,"smiles":null,"spectrum_id":"CCMSLIB00017317541","spectrum_index":51001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 151.0091 Da; putative annotation: N/A; putative formula: C7H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.101,"smiles":null,"spectrum_id":"CCMSLIB00017317542","spectrum_index":51002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 37.9547 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.046,"smiles":null,"spectrum_id":"CCMSLIB00017317543","spectrum_index":51003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 396.0854 Da; putative annotation: N/A; putative formula: C22H20O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.156,"smiles":null,"spectrum_id":"CCMSLIB00017317544","spectrum_index":51004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 49.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.316,"smiles":null,"spectrum_id":"CCMSLIB00017317545","spectrum_index":51005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 68.0698 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.187,"smiles":null,"spectrum_id":"CCMSLIB00017317546","spectrum_index":51006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 169.0747 Da; putative annotation: N/A; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.145,"smiles":null,"spectrum_id":"CCMSLIB00017317547","spectrum_index":51007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 234.0736 Da; putative annotation: N/A; putative formula: C9H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.223,"smiles":null,"spectrum_id":"CCMSLIB00017317548","spectrum_index":51008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 83.132 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.192,"smiles":null,"spectrum_id":"CCMSLIB00017317549","spectrum_index":51009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":135.065,"smiles":null,"spectrum_id":"CCMSLIB00017317550","spectrum_index":51010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 304.1958 Da; putative annotation: N/A; putative formula: C19H29OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.272,"smiles":null,"spectrum_id":"CCMSLIB00017317551","spectrum_index":51011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 273.6695 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.746,"smiles":null,"spectrum_id":"CCMSLIB00017317552","spectrum_index":51012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 318.214 Da; putative annotation: N/A; putative formula: C12H22N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.29,"smiles":null,"spectrum_id":"CCMSLIB00017317553","spectrum_index":51013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 110.0731 Da; putative annotation: N/A; putative formula: C7H10O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.138,"smiles":null,"spectrum_id":"CCMSLIB00017317554","spectrum_index":51014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 34.0535 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.145,"smiles":null,"spectrum_id":"CCMSLIB00017317555","spectrum_index":51015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 63.1091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.265,"smiles":null,"spectrum_id":"CCMSLIB00017317556","spectrum_index":51016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 108.0211 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.133,"smiles":null,"spectrum_id":"CCMSLIB00017317557","spectrum_index":51017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 98.0812 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.204,"smiles":null,"spectrum_id":"CCMSLIB00017317558","spectrum_index":51018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Methylsulfanyl)-9H-pyrimido[4,5-b]indole (delta mass: 162.0633 Da; putative annotation: N/A; putative formula: C7H15PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.122,"smiles":null,"spectrum_id":"CCMSLIB00017317559","spectrum_index":51019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 87.0118 Da; putative annotation: N/A; putative formula: C6HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.072,"smiles":null,"spectrum_id":"CCMSLIB00017317560","spectrum_index":51020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00160283-01!1-(8-Quinolinyl)-beta-carboline (delta mass: 273.1435 Da; putative annotation: N/A; putative formula: C10H19N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.262,"smiles":null,"spectrum_id":"CCMSLIB00017317561","spectrum_index":51021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 260.2356 Da; putative annotation: N/A; putative formula: C16H28N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.374,"smiles":null,"spectrum_id":"CCMSLIB00017317562","spectrum_index":51022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 58.0415 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.117,"smiles":null,"spectrum_id":"CCMSLIB00017317563","spectrum_index":51023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 282.2566 Da; putative annotation: N/A; putative formula: C18H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.337,"smiles":null,"spectrum_id":"CCMSLIB00017317564","spectrum_index":51024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 223.1324 Da; putative annotation: N/A; putative formula: C11H17N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.229,"smiles":null,"spectrum_id":"CCMSLIB00017317565","spectrum_index":51025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 46.0507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.149,"smiles":null,"spectrum_id":"CCMSLIB00017317566","spectrum_index":51026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 177.1618 Da; putative annotation: N/A; putative formula: C11H19N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.253,"smiles":null,"spectrum_id":"CCMSLIB00017317567","spectrum_index":51027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 317.1573 Da; putative annotation: N/A; putative formula: C25H19NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.239,"smiles":null,"spectrum_id":"CCMSLIB00017317568","spectrum_index":51028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0,.0?,?.0?,?]octadeca-7(18),8,10,15-tetraen-14-ol (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.175,"smiles":null,"spectrum_id":"CCMSLIB00017317569","spectrum_index":51029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 591.1962 Da; putative annotation: N/A; putative formula: C39H30NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.256,"smiles":null,"spectrum_id":"CCMSLIB00017317570","spectrum_index":51030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 291.9154 Da; putative annotation: N/A; putative formula: C12H4OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.981,"smiles":null,"spectrum_id":"CCMSLIB00017317571","spectrum_index":51031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 645.6489 Da; putative annotation: N/A; putative formula: C38H79N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":831.72,"smiles":null,"spectrum_id":"CCMSLIB00017317572","spectrum_index":51032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 52.8419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.939,"smiles":null,"spectrum_id":"CCMSLIB00017317573","spectrum_index":51033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 124.0783 Da; putative annotation: N/A; putative formula: C8H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.212,"smiles":null,"spectrum_id":"CCMSLIB00017317574","spectrum_index":51034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 18.0054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.017,"smiles":null,"spectrum_id":"CCMSLIB00017317575","spectrum_index":51035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00511 Isatin (delta mass: 73.0192 Da; putative annotation: N/A; putative formula: CH4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.059,"smiles":null,"spectrum_id":"CCMSLIB00017317576","spectrum_index":51036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 51.9867 Da; putative annotation: N/A; putative formula: C3HO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.068,"smiles":null,"spectrum_id":"CCMSLIB00017317577","spectrum_index":51037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 77.0842 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.217,"smiles":null,"spectrum_id":"CCMSLIB00017317578","spectrum_index":51038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methylpyrimidin-2-amine (delta mass: 40.0557 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.127,"smiles":null,"spectrum_id":"CCMSLIB00017317579","spectrum_index":51039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2-imidazolidinethione (delta mass: 24.0556 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.114,"smiles":null,"spectrum_id":"CCMSLIB00017317580","spectrum_index":51040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 45.5224 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.64,"smiles":null,"spectrum_id":"CCMSLIB00017317581","spectrum_index":51041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 31.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.118,"smiles":null,"spectrum_id":"CCMSLIB00017317582","spectrum_index":51042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 413.1531 Da; putative annotation: N/A; putative formula: C15H27NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":918.329,"smiles":null,"spectrum_id":"CCMSLIB00017317583","spectrum_index":51043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 302.7016 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.825,"smiles":null,"spectrum_id":"CCMSLIB00017317584","spectrum_index":51044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 366.209 Da; putative annotation: N/A; putative formula: C18H30N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.333,"smiles":null,"spectrum_id":"CCMSLIB00017317585","spectrum_index":51045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 211.07 Da; putative annotation: N/A; putative formula: C9H14N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.234,"smiles":null,"spectrum_id":"CCMSLIB00017317586","spectrum_index":51046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 122.0971 Da; putative annotation: N/A; putative formula: C6H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.21,"smiles":null,"spectrum_id":"CCMSLIB00017317587","spectrum_index":51047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 339.2876 Da; putative annotation: N/A; putative formula: C19H37N3O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.348,"smiles":null,"spectrum_id":"CCMSLIB00017317588","spectrum_index":51048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Phenoxy-N-(2-pyridinylmethyl)benzamide (delta mass: 23.0146 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.143,"smiles":null,"spectrum_id":"CCMSLIB00017317589","spectrum_index":51049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 325.9985 Da; putative annotation: N/A; putative formula: C17H11OPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.122,"smiles":null,"spectrum_id":"CCMSLIB00017317590","spectrum_index":51050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 38.9248 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.078,"smiles":null,"spectrum_id":"CCMSLIB00017317591","spectrum_index":51051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 181.0724 Da; putative annotation: N/A; putative formula: C5H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.201,"smiles":null,"spectrum_id":"CCMSLIB00017317592","spectrum_index":51052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 45.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.191,"smiles":null,"spectrum_id":"CCMSLIB00017317593","spectrum_index":51053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 40.9752 Da; putative annotation: N/A; putative formula: C16H23N7O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.093,"smiles":null,"spectrum_id":"CCMSLIB00017317594","spectrum_index":51054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2,3-dimethyl-1H-indole (delta mass: 126.0637 Da; putative annotation: N/A; putative formula: C3H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.121,"smiles":null,"spectrum_id":"CCMSLIB00017317595","spectrum_index":51055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 306.1946 Da; putative annotation: N/A; putative formula: C17H26N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.317,"smiles":null,"spectrum_id":"CCMSLIB00017317596","spectrum_index":51056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephromopsic acid (delta mass: 154.099 Da; putative annotation: N/A; putative formula: C9H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.352,"smiles":null,"spectrum_id":"CCMSLIB00017317597","spectrum_index":51057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 70.0778 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.253,"smiles":null,"spectrum_id":"CCMSLIB00017317598","spectrum_index":51058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-5-carboxylic acid (delta mass: 37.9793 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.034,"smiles":null,"spectrum_id":"CCMSLIB00017317599","spectrum_index":51059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 113.0476 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.197,"smiles":null,"spectrum_id":"CCMSLIB00017317600","spectrum_index":51060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 331.1497 Da; putative annotation: N/A; putative formula: C13H25N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.303,"smiles":null,"spectrum_id":"CCMSLIB00017317601","spectrum_index":51061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 80.0108 Da; putative annotation: N/A; putative formula: C2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.07,"smiles":null,"spectrum_id":"CCMSLIB00017317602","spectrum_index":51062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.048,"smiles":null,"spectrum_id":"CCMSLIB00017317603","spectrum_index":51063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 52.0267 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.196,"smiles":null,"spectrum_id":"CCMSLIB00017317604","spectrum_index":51064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 9.0434 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.125,"smiles":null,"spectrum_id":"CCMSLIB00017317605","spectrum_index":51065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Glycolylneuraminic acid (delta mass: 314.2047 Da; putative annotation: N/A; putative formula: C15H31N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.313,"smiles":null,"spectrum_id":"CCMSLIB00017317606","spectrum_index":51066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 439.3128 Da; putative annotation: N/A; putative formula: C26H41N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.378,"smiles":null,"spectrum_id":"CCMSLIB00017317607","spectrum_index":51067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 215.0791 Da; putative annotation: N/A; putative formula: C9H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.139,"smiles":null,"spectrum_id":"CCMSLIB00017317608","spectrum_index":51068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 520.4638 Da; putative annotation: N/A; putative formula: C37H60O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":706.535,"smiles":null,"spectrum_id":"CCMSLIB00017317609","spectrum_index":51069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"12-ethylidene-14-methyl-8,14-diazapentacyclo[9.5.2.0<1,9>.0<2,7>.0<14,17>]octa deca-2,4,6,9-tetraene-10-carbaldehyde, iodide CollisionEnergy:205060\"\" (delta mass: 18.0032 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.184,"smiles":null,"spectrum_id":"CCMSLIB00017317610","spectrum_index":51070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine (delta mass: 85.0854 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.261,"smiles":null,"spectrum_id":"CCMSLIB00017317611","spectrum_index":51071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 285.0249 Da; putative annotation: N/A; putative formula: C18H7NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.179,"smiles":null,"spectrum_id":"CCMSLIB00017317612","spectrum_index":51072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,6a-dihydrodemethoxyguadiscine (delta mass: 59.0119 Da; putative annotation: N/A; putative formula: HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.161,"smiles":null,"spectrum_id":"CCMSLIB00017317613","spectrum_index":51073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 138.0608 Da; putative annotation: N/A; putative formula: C7H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.163,"smiles":null,"spectrum_id":"CCMSLIB00017317614","spectrum_index":51074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 74.1024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.167,"smiles":null,"spectrum_id":"CCMSLIB00017317615","spectrum_index":51075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301108 L-Oxonoreleagnine (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.097,"smiles":null,"spectrum_id":"CCMSLIB00017317616","spectrum_index":51076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 537.1866 Da; putative annotation: N/A; putative formula: C27H31N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":880.31,"smiles":null,"spectrum_id":"CCMSLIB00017317617","spectrum_index":51077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Hydroxy-2-(naphthalen-2-yl)acetamide (delta mass: 67.1249 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.211,"smiles":null,"spectrum_id":"CCMSLIB00017317618","spectrum_index":51078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-3-methyl-5-phenyl-, (5R)- (delta mass: 88.0942 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.209,"smiles":null,"spectrum_id":"CCMSLIB00017317619","spectrum_index":51079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 151.1061 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.128,"smiles":null,"spectrum_id":"CCMSLIB00017317620","spectrum_index":51080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 50.0 eV (delta mass: 140.0468 Da; putative annotation: N/A; putative formula: C7H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.138,"smiles":null,"spectrum_id":"CCMSLIB00017317621","spectrum_index":51081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 127.0993 Da; putative annotation: N/A; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.17,"smiles":null,"spectrum_id":"CCMSLIB00017317622","spectrum_index":51082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 16.0312 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017317623","spectrum_index":51083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 171.021 Da; putative annotation: N/A; putative formula: C4H5N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.107,"smiles":null,"spectrum_id":"CCMSLIB00017317624","spectrum_index":51084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 70.0054 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.128,"smiles":null,"spectrum_id":"CCMSLIB00017317625","spectrum_index":51085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 932.4278 Da; putative annotation: N/A; putative formula: C67H56N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1154.53,"smiles":null,"spectrum_id":"CCMSLIB00017317626","spectrum_index":51086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 269.0412 Da; putative annotation: N/A; putative formula: C17H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.101,"smiles":null,"spectrum_id":"CCMSLIB00017317627","spectrum_index":51087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reserpic acid (delta mass: 370.1895 Da; putative annotation: N/A; putative formula: C16H23N10O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.397,"smiles":null,"spectrum_id":"CCMSLIB00017317628","spectrum_index":51088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 82.0785 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.321,"smiles":null,"spectrum_id":"CCMSLIB00017317629","spectrum_index":51089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 38.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.048,"smiles":null,"spectrum_id":"CCMSLIB00017317630","spectrum_index":51090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 27.0473 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.118,"smiles":null,"spectrum_id":"CCMSLIB00017317631","spectrum_index":51091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxaldehyde (delta mass: 74.0003 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.06,"smiles":null,"spectrum_id":"CCMSLIB00017317632","spectrum_index":51092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 186.099 Da; putative annotation: N/A; putative formula: C10H19O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.196,"smiles":null,"spectrum_id":"CCMSLIB00017317633","spectrum_index":51093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 100.0526 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.217,"smiles":null,"spectrum_id":"CCMSLIB00017317634","spectrum_index":51094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 179.079 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.165,"smiles":null,"spectrum_id":"CCMSLIB00017317635","spectrum_index":51095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 146.0691 Da; putative annotation: N/A; putative formula: C5H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.208,"smiles":null,"spectrum_id":"CCMSLIB00017317636","spectrum_index":51096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(4-Methyl-1-piperazinyl)aniline (delta mass: 258.1597 Da; putative annotation: N/A; putative formula: C13H18N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.309,"smiles":null,"spectrum_id":"CCMSLIB00017317637","spectrum_index":51097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 427.3523 Da; putative annotation: N/A; putative formula: C22H45N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.48,"smiles":null,"spectrum_id":"CCMSLIB00017317638","spectrum_index":51098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 280.4742 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":873.75,"smiles":null,"spectrum_id":"CCMSLIB00017317639","spectrum_index":51099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 98.0392 Da; putative annotation: N/A; putative formula: C4H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.16,"smiles":null,"spectrum_id":"CCMSLIB00017317640","spectrum_index":51100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxyethoxy)-5-(trifluoromethyl)aniline (delta mass: 159.0204 Da; putative annotation: N/A; putative formula: C4H6N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.11,"smiles":null,"spectrum_id":"CCMSLIB00017317641","spectrum_index":51101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 163.0304 Da; putative annotation: N/A; putative formula: C5H9NO3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.106,"smiles":null,"spectrum_id":"CCMSLIB00017317642","spectrum_index":51102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CNP0214803 (delta mass: 64.0165 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.072,"smiles":null,"spectrum_id":"CCMSLIB00017317643","spectrum_index":51103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 99.0682 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.229,"smiles":null,"spectrum_id":"CCMSLIB00017317644","spectrum_index":51104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 79.0731 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.149,"smiles":null,"spectrum_id":"CCMSLIB00017317645","spectrum_index":51105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Bipyridine-4,4'-dicarboxylic acid (delta mass: 33.0026 Da; putative annotation: N/A; putative formula: C3H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.058,"smiles":null,"spectrum_id":"CCMSLIB00017317646","spectrum_index":51106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C17:1 (delta mass: 71.0771 Da; putative annotation: N/A; putative formula: C4H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.472,"smiles":null,"spectrum_id":"CCMSLIB00017317647","spectrum_index":51107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 70.0446 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.09,"smiles":null,"spectrum_id":"CCMSLIB00017317648","spectrum_index":51108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 29.0351 Da; putative annotation: N/A; putative formula: H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.095,"smiles":null,"spectrum_id":"CCMSLIB00017317649","spectrum_index":51109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 40.9985 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.07,"smiles":null,"spectrum_id":"CCMSLIB00017317650","spectrum_index":51110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phthalyl-L-tryptophan (delta mass: 276.0751 Da; putative annotation: N/A; putative formula: C15H19O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.178,"smiles":null,"spectrum_id":"CCMSLIB00017317651","spectrum_index":51111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MELIBIOSE (delta mass: 142.9433 Da; putative annotation: N/A; putative formula: H2NO4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.067,"smiles":null,"spectrum_id":"CCMSLIB00017317652","spectrum_index":51112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 57.0276 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.129,"smiles":null,"spectrum_id":"CCMSLIB00017317653","spectrum_index":51113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 127.0997 Da; putative annotation: DL-Norleucine methyl ester; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.27,"smiles":null,"spectrum_id":"CCMSLIB00017317654","spectrum_index":51114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Ethyl-7-hydroxy-2-methylpyrazolo[1,5-a]pyrimidine-3-carbonitrile (delta mass: 94.0513 Da; putative annotation: (5-Methyl-3-isoxazolyl)methanamine; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.144,"smiles":null,"spectrum_id":"CCMSLIB00017317655","spectrum_index":51115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Norepinephrine (delta mass: 67.0786 Da; putative annotation: Massbank:PR100190 Piperidine|Hexahydropyridine|Perhydroazine|Perhydropyridine|Azacyclohexane|Cyclopentimine|Cypentil|Hexazane|Pentamethyleneimine|Pentamethylenimine; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.16,"smiles":null,"spectrum_id":"CCMSLIB00017317656","spectrum_index":51116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadene acetate (delta mass: 210.1979 Da; putative annotation: tetradecanoic acid; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.466,"smiles":null,"spectrum_id":"CCMSLIB00017317657","spectrum_index":51117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 132.0785 Da; putative annotation: Triethylene glycol; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.144,"smiles":null,"spectrum_id":"CCMSLIB00017317658","spectrum_index":51118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(4-Ethyl-1-piperazinyl)carbonyl]-1H-indole (delta mass: 70.0415 Da; putative annotation: Butanoic acid; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.202,"smiles":null,"spectrum_id":"CCMSLIB00017317659","spectrum_index":51119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 256.11 Da; putative annotation: Gigantol; putative formula: C16H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.186,"smiles":null,"spectrum_id":"CCMSLIB00017317660","spectrum_index":51120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 198.0486 Da; putative annotation: 4'-Fluoro[1,1'-biphenyl]-4-carboxylic acid; putative formula: C13H7FO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.14,"smiles":null,"spectrum_id":"CCMSLIB00017317661","spectrum_index":51121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 294.1453 Da; putative annotation: NCGC00380175-01_C16H24O6_beta-D-Glucopyranoside, 5-methyl-2-(1-methylethyl)phenyl; putative formula: C16H22O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.205,"smiles":null,"spectrum_id":"CCMSLIB00017317662","spectrum_index":51122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 486.3906 Da; putative annotation: N/A; putative formula: C25H46N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.539,"smiles":null,"spectrum_id":"CCMSLIB00017317663","spectrum_index":51123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE10; MS2Dec (delta mass: 255.0688 Da; putative annotation: N/A; putative formula: C10H15N3OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.15,"smiles":null,"spectrum_id":"CCMSLIB00017317664","spectrum_index":51124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroharmine (delta mass: 29.0152 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.149,"smiles":null,"spectrum_id":"CCMSLIB00017317665","spectrum_index":51125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 17.0303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.186,"smiles":null,"spectrum_id":"CCMSLIB00017317666","spectrum_index":51126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 127.9193 Da; putative annotation: N/A; putative formula: C4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.006,"smiles":null,"spectrum_id":"CCMSLIB00017317667","spectrum_index":51127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 350.1716 Da; putative annotation: N/A; putative formula: C23H28O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":695.341,"smiles":null,"spectrum_id":"CCMSLIB00017317668","spectrum_index":51128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 105.0424 Da; putative annotation: N/A; putative formula: C3H7NO3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.108,"smiles":null,"spectrum_id":"CCMSLIB00017317669","spectrum_index":51129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 310.0743 Da; putative annotation: N/A; putative formula: C13H18N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.161,"smiles":null,"spectrum_id":"CCMSLIB00017317670","spectrum_index":51130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 148.9721 Da; putative annotation: N/A; putative formula: C2H3N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.131,"smiles":null,"spectrum_id":"CCMSLIB00017317671","spectrum_index":51131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-6-ol, 1-(4-methoxyphenyl)-2-methyl-3-nitro- (delta mass: 2.0291 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.132,"smiles":null,"spectrum_id":"CCMSLIB00017317672","spectrum_index":51132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 272.1046 Da; putative annotation: N/A; putative formula: C16H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.18,"smiles":null,"spectrum_id":"CCMSLIB00017317673","spectrum_index":51133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 399.1426 Da; putative annotation: N/A; putative formula: C22H26NO2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.223,"smiles":null,"spectrum_id":"CCMSLIB00017317674","spectrum_index":51134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 307.2152 Da; putative annotation: N/A; putative formula: C18H29NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.296,"smiles":null,"spectrum_id":"CCMSLIB00017317675","spectrum_index":51135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 70.0417 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.154,"smiles":null,"spectrum_id":"CCMSLIB00017317676","spectrum_index":51136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 203.9535 Da; putative annotation: N/A; putative formula: C5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.014,"smiles":null,"spectrum_id":"CCMSLIB00017317677","spectrum_index":51137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 163.0624 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.179,"smiles":null,"spectrum_id":"CCMSLIB00017317678","spectrum_index":51138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 763.4499 Da; putative annotation: N/A; putative formula: C54H57N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.51,"smiles":null,"spectrum_id":"CCMSLIB00017317679","spectrum_index":51139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminopyridine (delta mass: 29.0251 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.086,"smiles":null,"spectrum_id":"CCMSLIB00017317680","spectrum_index":51140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 256.2403 Da; putative annotation: N/A; putative formula: C16H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.331,"smiles":null,"spectrum_id":"CCMSLIB00017317681","spectrum_index":51141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380203-01_C26H30ClNO8_2-{7-Acetoxy-5-chloro-3-[(1E,3E)-3,5-dimethyl-1,3-heptadien-1-yl]-7-methyl-6,8-dioxo-7,8-dihydro-2(6H)-isoquinolinyl}pentanedioic acid (delta mass: 519.1603 Da; putative annotation: N/A; putative formula: C15H33N7O7S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1039.33,"smiles":null,"spectrum_id":"CCMSLIB00017317682","spectrum_index":51142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 281.2712 Da; putative annotation: N/A; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.368,"smiles":null,"spectrum_id":"CCMSLIB00017317683","spectrum_index":51143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C9:0 (delta mass: 140.1196 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.326,"smiles":null,"spectrum_id":"CCMSLIB00017317684","spectrum_index":51144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 254.1776 Da; putative annotation: N/A; putative formula: C17H22N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.269,"smiles":null,"spectrum_id":"CCMSLIB00017317685","spectrum_index":51145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 112.0066 Da; putative annotation: N/A; putative formula: C7N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.093,"smiles":null,"spectrum_id":"CCMSLIB00017317686","spectrum_index":51146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 410.0604 Da; putative annotation: N/A; putative formula: C19H15N4O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.173,"smiles":null,"spectrum_id":"CCMSLIB00017317687","spectrum_index":51147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 92.0739 Da; putative annotation: N/A; putative formula: C6H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.16,"smiles":null,"spectrum_id":"CCMSLIB00017317688","spectrum_index":51148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 273.1831 Da; putative annotation: N/A; putative formula: C16H23N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.285,"smiles":null,"spectrum_id":"CCMSLIB00017317689","spectrum_index":51149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 130.1144 Da; putative annotation: N/A; putative formula: C11H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.238,"smiles":null,"spectrum_id":"CCMSLIB00017317690","spectrum_index":51150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 32.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.19,"smiles":null,"spectrum_id":"CCMSLIB00017317691","spectrum_index":51151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-3-[4-(carboxymethyl)phenyl]propanoic acid (delta mass: 70.0203 Da; putative annotation: N/A; putative formula: C7H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.112,"smiles":null,"spectrum_id":"CCMSLIB00017317692","spectrum_index":51152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Cyclopropyl-1H-indole (delta mass: 126.0427 Da; putative annotation: N/A; putative formula: C5H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.139,"smiles":null,"spectrum_id":"CCMSLIB00017317693","spectrum_index":51153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ358309 Eseroline|1,3a,8-Trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-ol|3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol (delta mass: 72.0459 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017317694","spectrum_index":51154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE10; MS2Dec (delta mass: 178.2086 Da; putative annotation: N/A; putative formula: C14H26O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.29,"smiles":null,"spectrum_id":"CCMSLIB00017317695","spectrum_index":51155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 64.0074 Da; putative annotation: N/A; putative formula: C3N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.104,"smiles":null,"spectrum_id":"CCMSLIB00017317696","spectrum_index":51156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 209.2504 Da; putative annotation: N/A; putative formula: C15H31NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.3,"smiles":null,"spectrum_id":"CCMSLIB00017317697","spectrum_index":51157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N'-(7-Fluoropyrrolo[1,2-a]quinoxalin-4-yl)pyrazinohydrazide (delta mass: 144.0467 Da; putative annotation: N/A; putative formula: C4H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.152,"smiles":null,"spectrum_id":"CCMSLIB00017317698","spectrum_index":51158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 752.4537 Da; putative annotation: N/A; putative formula: C41H68O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.514,"smiles":null,"spectrum_id":"CCMSLIB00017317699","spectrum_index":51159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 115.181 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017317700","spectrum_index":51160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 183.1874 Da; putative annotation: N/A; putative formula: C9H21N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.227,"smiles":null,"spectrum_id":"CCMSLIB00017317701","spectrum_index":51161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM823401 N-Butylbenzenesulfonamide (delta mass: 14.1071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.197,"smiles":null,"spectrum_id":"CCMSLIB00017317702","spectrum_index":51162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 13.0187 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.115,"smiles":null,"spectrum_id":"CCMSLIB00017317703","spectrum_index":51163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 251.1006 Da; putative annotation: N/A; putative formula: C9H17NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.255,"smiles":null,"spectrum_id":"CCMSLIB00017317704","spectrum_index":51164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 522.9842 Da; putative annotation: N/A; putative formula: C24H13NO7S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.056,"smiles":null,"spectrum_id":"CCMSLIB00017317705","spectrum_index":51165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 120.0193 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.09,"smiles":null,"spectrum_id":"CCMSLIB00017317706","spectrum_index":51166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 456.1738 Da; putative annotation: N/A; putative formula: C33H20N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":693.286,"smiles":null,"spectrum_id":"CCMSLIB00017317707","spectrum_index":51167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 200.1182 Da; putative annotation: N/A; putative formula: C9H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.204,"smiles":null,"spectrum_id":"CCMSLIB00017317708","spectrum_index":51168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 50.9839 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":161.044,"smiles":null,"spectrum_id":"CCMSLIB00017317709","spectrum_index":51169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 246.1174 Da; putative annotation: N/A; putative formula: C15H19OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.246,"smiles":null,"spectrum_id":"CCMSLIB00017317710","spectrum_index":51170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1-pentanamine (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.185,"smiles":null,"spectrum_id":"CCMSLIB00017317711","spectrum_index":51171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 314.1617 Da; putative annotation: N/A; putative formula: C12H23N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.321,"smiles":null,"spectrum_id":"CCMSLIB00017317712","spectrum_index":51172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 69.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.18,"smiles":null,"spectrum_id":"CCMSLIB00017317713","spectrum_index":51173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 158.0686 Da; putative annotation: N/A; putative formula: C8H15O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.218,"smiles":null,"spectrum_id":"CCMSLIB00017317714","spectrum_index":51174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 240.2093 Da; putative annotation: N/A; putative formula: C15H28O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.384,"smiles":null,"spectrum_id":"CCMSLIB00017317715","spectrum_index":51175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 143.1314 Da; putative annotation: N/A; putative formula: C8H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.238,"smiles":null,"spectrum_id":"CCMSLIB00017317716","spectrum_index":51176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 90.0681 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.17,"smiles":null,"spectrum_id":"CCMSLIB00017317717","spectrum_index":51177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 109.085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.181,"smiles":null,"spectrum_id":"CCMSLIB00017317718","spectrum_index":51178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 999.642 Da; putative annotation: N/A; putative formula: C50H89N13O2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1221.74,"smiles":null,"spectrum_id":"CCMSLIB00017317719","spectrum_index":51179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 27.999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.107,"smiles":null,"spectrum_id":"CCMSLIB00017317720","spectrum_index":51180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 450.2977 Da; putative annotation: N/A; putative formula: C26H42O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.373,"smiles":null,"spectrum_id":"CCMSLIB00017317721","spectrum_index":51181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 31.043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.182,"smiles":null,"spectrum_id":"CCMSLIB00017317722","spectrum_index":51182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 428.3612 Da; putative annotation: N/A; putative formula: C24H48N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.489,"smiles":null,"spectrum_id":"CCMSLIB00017317723","spectrum_index":51183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 405.169 Da; putative annotation: N/A; putative formula: C23H23N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.24,"smiles":null,"spectrum_id":"CCMSLIB00017317724","spectrum_index":51184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 115.0635 Da; putative annotation: N/A; putative formula: C5H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.118,"smiles":null,"spectrum_id":"CCMSLIB00017317725","spectrum_index":51185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 894.8881 Da; putative annotation: N/A; putative formula: C60H114N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1116.99,"smiles":null,"spectrum_id":"CCMSLIB00017317726","spectrum_index":51186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydromorphine (delta mass: 156.0636 Da; putative annotation: N/A; putative formula: C5H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.223,"smiles":null,"spectrum_id":"CCMSLIB00017317727","spectrum_index":51187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 189.0993 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.201,"smiles":null,"spectrum_id":"CCMSLIB00017317728","spectrum_index":51188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of BETA-LACTOSE (delta mass: 178.9341 Da; putative annotation: N/A; putative formula: C3HNO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.058,"smiles":null,"spectrum_id":"CCMSLIB00017317729","spectrum_index":51189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-exo)-3-[3-Methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octane (delta mass: 61.0381 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.23,"smiles":null,"spectrum_id":"CCMSLIB00017317730","spectrum_index":51190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 44.0149 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.122,"smiles":null,"spectrum_id":"CCMSLIB00017317731","spectrum_index":51191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arthrobactin (delta mass: 42.0104 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.266,"smiles":null,"spectrum_id":"CCMSLIB00017317732","spectrum_index":51192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 129.0529 Da; putative annotation: N/A; putative formula: C4H7N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.133,"smiles":null,"spectrum_id":"CCMSLIB00017317733","spectrum_index":51193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 577.3782 Da; putative annotation: N/A; putative formula: C37H47N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.454,"smiles":null,"spectrum_id":"CCMSLIB00017317734","spectrum_index":51194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 32.0191 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.14,"smiles":null,"spectrum_id":"CCMSLIB00017317735","spectrum_index":51195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tert-Butyl 2-(aminomethyl)phenylcarbamate (delta mass: 46.0058 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.15,"smiles":null,"spectrum_id":"CCMSLIB00017317736","spectrum_index":51196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 68.0631 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.139,"smiles":null,"spectrum_id":"CCMSLIB00017317737","spectrum_index":51197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 79.953 Da; putative annotation: N/A; putative formula: H3O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.091,"smiles":null,"spectrum_id":"CCMSLIB00017317738","spectrum_index":51198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 370.7342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.81,"smiles":null,"spectrum_id":"CCMSLIB00017317739","spectrum_index":51199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 75.503 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.574,"smiles":null,"spectrum_id":"CCMSLIB00017317740","spectrum_index":51200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Lys (delta mass: 71.0361 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.176,"smiles":null,"spectrum_id":"CCMSLIB00017317741","spectrum_index":51201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-Binaphthyl-8,8'-dicarboxylic acid (delta mass: 343.3879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.484,"smiles":null,"spectrum_id":"CCMSLIB00017317742","spectrum_index":51202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 120.0575 Da; putative annotation: N/A; putative formula: C8H8O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017317743","spectrum_index":51203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-(2-naphthyl)acetamide (delta mass: 74.0327 Da; putative annotation: N/A; putative formula: C2H6N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.085,"smiles":null,"spectrum_id":"CCMSLIB00017317744","spectrum_index":51204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylnicotinic acid (delta mass: 88.0157 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.071,"smiles":null,"spectrum_id":"CCMSLIB00017317745","spectrum_index":51205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 78.0839 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.207,"smiles":null,"spectrum_id":"CCMSLIB00017317746","spectrum_index":51206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 269.1271 Da; putative annotation: N/A; putative formula: C14H23NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.167,"smiles":null,"spectrum_id":"CCMSLIB00017317747","spectrum_index":51207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 251.1268 Da; putative annotation: N/A; putative formula: C12H17N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.229,"smiles":null,"spectrum_id":"CCMSLIB00017317748","spectrum_index":51208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dopamine (delta mass: 285.1328 Da; putative annotation: N/A; putative formula: C12H19N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.219,"smiles":null,"spectrum_id":"CCMSLIB00017317749","spectrum_index":51209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 239.1155 Da; putative annotation: N/A; putative formula: C12H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.217,"smiles":null,"spectrum_id":"CCMSLIB00017317750","spectrum_index":51210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 257.8673 Da; putative annotation: N/A; putative formula: C4H4OP2S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.979,"smiles":null,"spectrum_id":"CCMSLIB00017317751","spectrum_index":51211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 124.0742 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.192,"smiles":null,"spectrum_id":"CCMSLIB00017317752","spectrum_index":51212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 154.0625 Da; putative annotation: N/A; putative formula: C8H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.175,"smiles":null,"spectrum_id":"CCMSLIB00017317753","spectrum_index":51213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 26.23 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.416,"smiles":null,"spectrum_id":"CCMSLIB00017317754","spectrum_index":51214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 488.1187 Da; putative annotation: N/A; putative formula: C21H30O7P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.22,"smiles":null,"spectrum_id":"CCMSLIB00017317755","spectrum_index":51215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 212.1309 Da; putative annotation: N/A; putative formula: C14H16N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.279,"smiles":null,"spectrum_id":"CCMSLIB00017317756","spectrum_index":51216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1218.4573 Da; putative annotation: N/A; putative formula: C67H62N16O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1561.58,"smiles":null,"spectrum_id":"CCMSLIB00017317757","spectrum_index":51217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine-C9:0 (delta mass: 56.0253 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.232,"smiles":null,"spectrum_id":"CCMSLIB00017317758","spectrum_index":51218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-4-methyl-2-pentanone (delta mass: 116.0644 Da; putative annotation: N/A; putative formula: C6H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.155,"smiles":null,"spectrum_id":"CCMSLIB00017317759","spectrum_index":51219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 451.171 Da; putative annotation: N/A; putative formula: C19H35NO5P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.273,"smiles":null,"spectrum_id":"CCMSLIB00017317760","spectrum_index":51220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ferrioxamine B [M+Fe-2H] (delta mass: 129.0422 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":743.314,"smiles":null,"spectrum_id":"CCMSLIB00017317761","spectrum_index":51221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 38.0153 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.201,"smiles":null,"spectrum_id":"CCMSLIB00017317762","spectrum_index":51222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 90.0317 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.097,"smiles":null,"spectrum_id":"CCMSLIB00017317763","spectrum_index":51223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 82.0784 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.149,"smiles":null,"spectrum_id":"CCMSLIB00017317764","spectrum_index":51224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SEROTONIN (delta mass: 238.23 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.332,"smiles":null,"spectrum_id":"CCMSLIB00017317765","spectrum_index":51225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal (delta mass: 90.047 Da; putative annotation: N/A; putative formula: C7H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.096,"smiles":null,"spectrum_id":"CCMSLIB00017317766","spectrum_index":51226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 119.8703 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.93,"smiles":null,"spectrum_id":"CCMSLIB00017317767","spectrum_index":51227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 130.069 Da; putative annotation: N/A; putative formula: C4H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.249,"smiles":null,"spectrum_id":"CCMSLIB00017317768","spectrum_index":51228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 302.1151 Da; putative annotation: N/A; putative formula: C12H23N4O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.18,"smiles":null,"spectrum_id":"CCMSLIB00017317769","spectrum_index":51229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 36.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.17,"smiles":null,"spectrum_id":"CCMSLIB00017317770","spectrum_index":51230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 16.1467 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.246,"smiles":null,"spectrum_id":"CCMSLIB00017317771","spectrum_index":51231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385698-01!2-(1H-indol-3-yl)propanoic acid (delta mass: 17.0266 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.113,"smiles":null,"spectrum_id":"CCMSLIB00017317772","spectrum_index":51232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Heptyl-4-hydroxyquinoline N-oxide (delta mass: 82.0786 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.243,"smiles":null,"spectrum_id":"CCMSLIB00017317773","spectrum_index":51233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-methylaurotetanine (delta mass: 2.086 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.256,"smiles":null,"spectrum_id":"CCMSLIB00017317774","spectrum_index":51234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 216.1565 Da; putative annotation: N/A; putative formula: C12H26O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.254,"smiles":null,"spectrum_id":"CCMSLIB00017317775","spectrum_index":51235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 9.0597 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.146,"smiles":null,"spectrum_id":"CCMSLIB00017317776","spectrum_index":51236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 781.3331 Da; putative annotation: N/A; putative formula: C43H51N5O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1003.43,"smiles":null,"spectrum_id":"CCMSLIB00017317777","spectrum_index":51237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 1011.4026 Da; putative annotation: N/A; putative formula: C55H61N7O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1177.49,"smiles":null,"spectrum_id":"CCMSLIB00017317778","spectrum_index":51238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 73.056 Da; putative annotation: N/A; putative formula: C3H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.168,"smiles":null,"spectrum_id":"CCMSLIB00017317779","spectrum_index":51239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 87.0685 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.15,"smiles":null,"spectrum_id":"CCMSLIB00017317780","spectrum_index":51240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 336.1941 Da; putative annotation: N/A; putative formula: C12H28N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.265,"smiles":null,"spectrum_id":"CCMSLIB00017317781","spectrum_index":51241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 547.2058 Da; putative annotation: N/A; putative formula: C22H30N9O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.292,"smiles":null,"spectrum_id":"CCMSLIB00017317782","spectrum_index":51242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S)-2-amino-3-(4-methoxyphenyl)propanoic acid CollisionEnergy:102040 (delta mass: 46.0056 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017317783","spectrum_index":51243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.284,"smiles":null,"spectrum_id":"CCMSLIB00017317784","spectrum_index":51244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 108.0216 Da; putative annotation: N/A; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.082,"smiles":null,"spectrum_id":"CCMSLIB00017317785","spectrum_index":51245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 54.9969 Da; putative annotation: N/A; putative formula: C2H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.115,"smiles":null,"spectrum_id":"CCMSLIB00017317786","spectrum_index":51246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 273.1803 Da; putative annotation: N/A; putative formula: C11H23N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.24,"smiles":null,"spectrum_id":"CCMSLIB00017317787","spectrum_index":51247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 53.0392 Da; putative annotation: N/A; putative formula: C2H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.121,"smiles":null,"spectrum_id":"CCMSLIB00017317788","spectrum_index":51248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 26.051 Da; putative annotation: N/A; putative formula: C3H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.163,"smiles":null,"spectrum_id":"CCMSLIB00017317789","spectrum_index":51249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 62.0338 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.135,"smiles":null,"spectrum_id":"CCMSLIB00017317790","spectrum_index":51250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 207.0619 Da; putative annotation: N/A; putative formula: C9H9N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.177,"smiles":null,"spectrum_id":"CCMSLIB00017317791","spectrum_index":51251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 99.0308 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.122,"smiles":null,"spectrum_id":"CCMSLIB00017317792","spectrum_index":51252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of thymidine (delta mass: 18.0049 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.102,"smiles":null,"spectrum_id":"CCMSLIB00017317793","spectrum_index":51253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004401 1-hydroxypyrene|pyren-1-ol (delta mass: 13.0374 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.118,"smiles":null,"spectrum_id":"CCMSLIB00017317794","spectrum_index":51254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin_120248 (delta mass: 222.0772 Da; putative annotation: N/A; putative formula: C7H15N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.169,"smiles":null,"spectrum_id":"CCMSLIB00017317795","spectrum_index":51255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 731.296 Da; putative annotation: N/A; putative formula: C28H49N3O19)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1062.45,"smiles":null,"spectrum_id":"CCMSLIB00017317796","spectrum_index":51256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 9H-carbazole-3-carboxylate (delta mass: 114.0316 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.134,"smiles":null,"spectrum_id":"CCMSLIB00017317797","spectrum_index":51257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 315.1468 Da; putative annotation: N/A; putative formula: C18H21NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.249,"smiles":null,"spectrum_id":"CCMSLIB00017317798","spectrum_index":51258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 110.0848 Da; putative annotation: N/A; putative formula: C6H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.214,"smiles":null,"spectrum_id":"CCMSLIB00017317799","spectrum_index":51259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 85.051 Da; putative annotation: N/A; putative formula: H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.142,"smiles":null,"spectrum_id":"CCMSLIB00017317800","spectrum_index":51260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 16.0618 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.139,"smiles":null,"spectrum_id":"CCMSLIB00017317801","spectrum_index":51261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 112.0914 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.118,"smiles":null,"spectrum_id":"CCMSLIB00017317802","spectrum_index":51262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2,3-diol (delta mass: 112.0891 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.144,"smiles":null,"spectrum_id":"CCMSLIB00017317803","spectrum_index":51263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 111.9583 Da; putative annotation: N/A; putative formula: HO5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.023,"smiles":null,"spectrum_id":"CCMSLIB00017317804","spectrum_index":51264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 80.0628 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.138,"smiles":null,"spectrum_id":"CCMSLIB00017317805","spectrum_index":51265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 74.0409 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.132,"smiles":null,"spectrum_id":"CCMSLIB00017317806","spectrum_index":51266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-indol-3-yl)ethanamine (delta mass: 84.0927 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017317807","spectrum_index":51267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CNP0214803 (delta mass: 46.0058 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.061,"smiles":null,"spectrum_id":"CCMSLIB00017317808","spectrum_index":51268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(2-Aminoethoxy)phenoxy]ethanamine (delta mass: 41.0162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.145,"smiles":null,"spectrum_id":"CCMSLIB00017317809","spectrum_index":51269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Nitrophenyl N-acetyl-alpha-galactosaminide CollisionEnergy:205060 (delta mass: 113.0929 Da; putative annotation: N/A; putative formula: C5H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.207,"smiles":null,"spectrum_id":"CCMSLIB00017317810","spectrum_index":51270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 57.0208 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.092,"smiles":null,"spectrum_id":"CCMSLIB00017317811","spectrum_index":51271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 166.135 Da; putative annotation: 10-Hendecenoic acid; putative formula: C11H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.215,"smiles":null,"spectrum_id":"CCMSLIB00017317812","spectrum_index":51272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 142.0745 Da; putative annotation: Ala-Ala; putative formula: C6H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.161,"smiles":null,"spectrum_id":"CCMSLIB00017317813","spectrum_index":51273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 101.0476 Da; putative annotation: O-Methyl-DL-serine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017317814","spectrum_index":51274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 286.1931 Da; putative annotation: h_266_oxandrolone_m3; putative formula: C19H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.317,"smiles":null,"spectrum_id":"CCMSLIB00017317815","spectrum_index":51275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Gly-Leu (delta mass: 131.0943 Da; putative annotation: Triethanolamine; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.239,"smiles":null,"spectrum_id":"CCMSLIB00017317816","spectrum_index":51276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 146.0716 Da; putative annotation: Eugenol; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.116,"smiles":null,"spectrum_id":"CCMSLIB00017317817","spectrum_index":51277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 1200.5383 Da; putative annotation: (2E,6E)-3,7,11-Trimethyldodeca-2,6,10-trien-1-yl 6-deoxyhexopyranosyl-(1->4)pentopyranosyl-(1->4)-6-deoxyhexopyranosyl-(1->4)-6-deoxyhexopyranosyl-(1->3)-[pentopyranosyl-(1->4)pentopyranosyl-(1->6)]hexopyranoside; putative formula: C54H88O29)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1407.62,"smiles":null,"spectrum_id":"CCMSLIB00017317818","spectrum_index":51278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-acetyl beta carboline (delta mass: 56.0359 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.122,"smiles":null,"spectrum_id":"CCMSLIB00017317819","spectrum_index":51279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 265.0679 Da; putative annotation: N/A; putative formula: C15H11N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.191,"smiles":null,"spectrum_id":"CCMSLIB00017317820","spectrum_index":51280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 86.0368 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.139,"smiles":null,"spectrum_id":"CCMSLIB00017317821","spectrum_index":51281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 113.1072 Da; putative annotation: N/A; putative formula: C4H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.194,"smiles":null,"spectrum_id":"CCMSLIB00017317822","spectrum_index":51282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 91.0118 Da; putative annotation: N/A; putative formula: C2H7NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.093,"smiles":null,"spectrum_id":"CCMSLIB00017317823","spectrum_index":51283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 96.0288 Da; putative annotation: N/A; putative formula: N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.131,"smiles":null,"spectrum_id":"CCMSLIB00017317824","spectrum_index":51284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 35.0375 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.213,"smiles":null,"spectrum_id":"CCMSLIB00017317825","spectrum_index":51285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 41.113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.182,"smiles":null,"spectrum_id":"CCMSLIB00017317826","spectrum_index":51286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 180.043 Da; putative annotation: N/A; putative formula: C2H8N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.065,"smiles":null,"spectrum_id":"CCMSLIB00017317827","spectrum_index":51287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 32.8646 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.924,"smiles":null,"spectrum_id":"CCMSLIB00017317828","spectrum_index":51288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 238.229 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.31,"smiles":null,"spectrum_id":"CCMSLIB00017317829","spectrum_index":51289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylserotonin (delta mass: 402.0472 Da; putative annotation: N/A; putative formula: C15H19N2O5PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.16,"smiles":null,"spectrum_id":"CCMSLIB00017317830","spectrum_index":51290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 189.0824 Da; putative annotation: N/A; putative formula: C8H15NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.153,"smiles":null,"spectrum_id":"CCMSLIB00017317831","spectrum_index":51291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dobutamine (delta mass: 92.0626 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.238,"smiles":null,"spectrum_id":"CCMSLIB00017317832","spectrum_index":51292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 331.2007 Da; putative annotation: N/A; putative formula: C17H25N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.276,"smiles":null,"spectrum_id":"CCMSLIB00017317833","spectrum_index":51293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 14.0521 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.118,"smiles":null,"spectrum_id":"CCMSLIB00017317834","spectrum_index":51294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 309.1731 Da; putative annotation: N/A; putative formula: C20H23NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.297,"smiles":null,"spectrum_id":"CCMSLIB00017317835","spectrum_index":51295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 240.0796 Da; putative annotation: N/A; putative formula: C15H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.203,"smiles":null,"spectrum_id":"CCMSLIB00017317836","spectrum_index":51296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Penten-1-ol (delta mass: 24.0365 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":111.117,"smiles":null,"spectrum_id":"CCMSLIB00017317837","spectrum_index":51297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 192.1355 Da; putative annotation: N/A; putative formula: C13H20O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.306,"smiles":null,"spectrum_id":"CCMSLIB00017317838","spectrum_index":51298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 75.0261 Da; putative annotation: N/A; putative formula: CH5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.212,"smiles":null,"spectrum_id":"CCMSLIB00017317839","spectrum_index":51299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 10.1018 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.183,"smiles":null,"spectrum_id":"CCMSLIB00017317840","spectrum_index":51300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-azaniumyl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (delta mass: 85.0979 Da; putative annotation: N/A; putative formula: C4H11N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.146,"smiles":null,"spectrum_id":"CCMSLIB00017317841","spectrum_index":51301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 33.0213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.149,"smiles":null,"spectrum_id":"CCMSLIB00017317842","spectrum_index":51302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 298.1278 Da; putative annotation: N/A; putative formula: C12H18N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.225,"smiles":null,"spectrum_id":"CCMSLIB00017317843","spectrum_index":51303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bamethane (delta mass: 30.047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.196,"smiles":null,"spectrum_id":"CCMSLIB00017317844","spectrum_index":51304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 219.1257 Da; putative annotation: N/A; putative formula: C13H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.238,"smiles":null,"spectrum_id":"CCMSLIB00017317845","spectrum_index":51305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 62.0186 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.105,"smiles":null,"spectrum_id":"CCMSLIB00017317846","spectrum_index":51306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 21.992 Da; putative annotation: N/A; putative formula: CH-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":134.031,"smiles":null,"spectrum_id":"CCMSLIB00017317847","spectrum_index":51307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300815 Isocorydine (delta mass: 115.0567 Da; putative annotation: N/A; putative formula: C4H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.227,"smiles":null,"spectrum_id":"CCMSLIB00017317848","spectrum_index":51308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 269.1542 Da; putative annotation: N/A; putative formula: C14H24NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.256,"smiles":null,"spectrum_id":"CCMSLIB00017317849","spectrum_index":51309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 633.5175 Da; putative annotation: N/A; putative formula: C39H73NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":796.578,"smiles":null,"spectrum_id":"CCMSLIB00017317850","spectrum_index":51310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 524.17 Da; putative annotation: N/A; putative formula: C30H36S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.23,"smiles":null,"spectrum_id":"CCMSLIB00017317851","spectrum_index":51311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 264.0996 Da; putative annotation: N/A; putative formula: C14H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.212,"smiles":null,"spectrum_id":"CCMSLIB00017317852","spectrum_index":51312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 83.061 Da; putative annotation: N/A; putative formula: C2H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.184,"smiles":null,"spectrum_id":"CCMSLIB00017317853","spectrum_index":51313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 598.5068 Da; putative annotation: N/A; putative formula: C38H66N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.578,"smiles":null,"spectrum_id":"CCMSLIB00017317854","spectrum_index":51314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 101.0476 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.098,"smiles":null,"spectrum_id":"CCMSLIB00017317855","spectrum_index":51315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 127.0614 Da; putative annotation: N/A; putative formula: C2H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.159,"smiles":null,"spectrum_id":"CCMSLIB00017317856","spectrum_index":51316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 311.1508 Da; putative annotation: N/A; putative formula: C11H25N3O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":544.3,"smiles":null,"spectrum_id":"CCMSLIB00017317857","spectrum_index":51317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methoxyquinoline-3-carbaldehyde (delta mass: 11.9999 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.065,"smiles":null,"spectrum_id":"CCMSLIB00017317858","spectrum_index":51318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 727.2844 Da; putative annotation: N/A; putative formula: C30H53N3O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":933.366,"smiles":null,"spectrum_id":"CCMSLIB00017317859","spectrum_index":51319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 254.0661 Da; putative annotation: N/A; putative formula: C14H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.178,"smiles":null,"spectrum_id":"CCMSLIB00017317860","spectrum_index":51320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vibriobactin (delta mass: 18.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":724.283,"smiles":null,"spectrum_id":"CCMSLIB00017317861","spectrum_index":51321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 7.0048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":145.096,"smiles":null,"spectrum_id":"CCMSLIB00017317862","spectrum_index":51322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 320.2123 Da; putative annotation: N/A; putative formula: C16H33O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.324,"smiles":null,"spectrum_id":"CCMSLIB00017317863","spectrum_index":51323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltopentaose from NIST14 (delta mass: 324.1052 Da; putative annotation: N/A; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1153.39,"smiles":null,"spectrum_id":"CCMSLIB00017317864","spectrum_index":51324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 456.0499 Da; putative annotation: N/A; putative formula: C27H20O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":771.209,"smiles":null,"spectrum_id":"CCMSLIB00017317865","spectrum_index":51325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 188.1148 Da; putative annotation: N/A; putative formula: C10H21O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.264,"smiles":null,"spectrum_id":"CCMSLIB00017317866","spectrum_index":51326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 122.0363 Da; putative annotation: N/A; putative formula: CH7N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.123,"smiles":null,"spectrum_id":"CCMSLIB00017317867","spectrum_index":51327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isatin (delta mass: 104.0473 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.087,"smiles":null,"spectrum_id":"CCMSLIB00017317868","spectrum_index":51328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1070.6817 Da; putative annotation: N/A; putative formula: C64H98N2O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1292.78,"smiles":null,"spectrum_id":"CCMSLIB00017317869","spectrum_index":51329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 502.2201 Da; putative annotation: N/A; putative formula: C27H34O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.322,"smiles":null,"spectrum_id":"CCMSLIB00017317870","spectrum_index":51330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 45.9999 Da; putative annotation: N/A; putative formula: H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.123,"smiles":null,"spectrum_id":"CCMSLIB00017317871","spectrum_index":51331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desomorphine (delta mass: 501.3338 Da; putative annotation: N/A; putative formula: C25H48N3O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":773.498,"smiles":null,"spectrum_id":"CCMSLIB00017317872","spectrum_index":51332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1H-indole-2-carboxamide (delta mass: 68.0721 Da; putative annotation: N/A; putative formula: C4H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017317873","spectrum_index":51333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 365.3654 Da; putative annotation: N/A; putative formula: C24H47NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.441,"smiles":null,"spectrum_id":"CCMSLIB00017317874","spectrum_index":51334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 121.0233 Da; putative annotation: N/A; putative formula: H3N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.073,"smiles":null,"spectrum_id":"CCMSLIB00017317875","spectrum_index":51335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 49.053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.186,"smiles":null,"spectrum_id":"CCMSLIB00017317876","spectrum_index":51336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005787 Indole-3-carboxylic acid|1H-indole-3-carboxylic acid (delta mass: 124.0619 Da; putative annotation: N/A; putative formula: C2H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.117,"smiles":null,"spectrum_id":"CCMSLIB00017317877","spectrum_index":51337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 516.1659 Da; putative annotation: N/A; putative formula: C36H24N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":861.299,"smiles":null,"spectrum_id":"CCMSLIB00017317878","spectrum_index":51338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 30.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.128,"smiles":null,"spectrum_id":"CCMSLIB00017317879","spectrum_index":51339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 160.0744 Da; putative annotation: N/A; putative formula: C8H16O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.198,"smiles":null,"spectrum_id":"CCMSLIB00017317880","spectrum_index":51340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 14.035 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.142,"smiles":null,"spectrum_id":"CCMSLIB00017317881","spectrum_index":51341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 500.3833 Da; putative annotation: N/A; putative formula: C28H56N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.443,"smiles":null,"spectrum_id":"CCMSLIB00017317882","spectrum_index":51342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 28.0555 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.137,"smiles":null,"spectrum_id":"CCMSLIB00017317883","spectrum_index":51343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 42.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.133,"smiles":null,"spectrum_id":"CCMSLIB00017317884","spectrum_index":51344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 129.042 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.123,"smiles":null,"spectrum_id":"CCMSLIB00017317885","spectrum_index":51345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 170.0964 Da; putative annotation: N/A; putative formula: C10H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.194,"smiles":null,"spectrum_id":"CCMSLIB00017317886","spectrum_index":51346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 99.0323 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.103,"smiles":null,"spectrum_id":"CCMSLIB00017317887","spectrum_index":51347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 367.3239 Da; putative annotation: N/A; putative formula: C26H41N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.447,"smiles":null,"spectrum_id":"CCMSLIB00017317888","spectrum_index":51348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 26.1094 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.164,"smiles":null,"spectrum_id":"CCMSLIB00017317889","spectrum_index":51349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 60.0211 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.139,"smiles":null,"spectrum_id":"CCMSLIB00017317890","spectrum_index":51350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 144.0321 Da; putative annotation: N/A; putative formula: C8H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.159,"smiles":null,"spectrum_id":"CCMSLIB00017317891","spectrum_index":51351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Leu (delta mass: 179.0829 Da; putative annotation: N/A; putative formula: C5H14N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.212,"smiles":null,"spectrum_id":"CCMSLIB00017317892","spectrum_index":51352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Norepinephrine (delta mass: 290.1618 Da; putative annotation: N/A; putative formula: C18H27O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.243,"smiles":null,"spectrum_id":"CCMSLIB00017317893","spectrum_index":51353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 82.0345 Da; putative annotation: N/A; putative formula: C5H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.074,"smiles":null,"spectrum_id":"CCMSLIB00017317894","spectrum_index":51354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 210.1005 Da; putative annotation: N/A; putative formula: C10H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.255,"smiles":null,"spectrum_id":"CCMSLIB00017317895","spectrum_index":51355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 195.9243 Da; putative annotation: N/A; putative formula: C2N2O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.026,"smiles":null,"spectrum_id":"CCMSLIB00017317896","spectrum_index":51356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 135.9617 Da; putative annotation: N/A; putative formula: C6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.042,"smiles":null,"spectrum_id":"CCMSLIB00017317897","spectrum_index":51357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 10.9829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.085,"smiles":null,"spectrum_id":"CCMSLIB00017317898","spectrum_index":51358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 222.1035 Da; putative annotation: N/A; putative formula: C10H15N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.19,"smiles":null,"spectrum_id":"CCMSLIB00017317899","spectrum_index":51359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Magnoflorine (delta mass: 130.0562 Da; putative annotation: N/A; putative formula: C5H10N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.226,"smiles":null,"spectrum_id":"CCMSLIB00017317900","spectrum_index":51360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-3'-Hydroxycotinine (delta mass: 39.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.15,"smiles":null,"spectrum_id":"CCMSLIB00017317901","spectrum_index":51361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 60.0334 Da; putative annotation: N/A; putative formula: CH4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.109,"smiles":null,"spectrum_id":"CCMSLIB00017317902","spectrum_index":51362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 782.8431 Da; putative annotation: N/A; putative formula: C54H106N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":989.929,"smiles":null,"spectrum_id":"CCMSLIB00017317903","spectrum_index":51363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 197.0915 Da; putative annotation: N/A; putative formula: C7H11N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.24,"smiles":null,"spectrum_id":"CCMSLIB00017317904","spectrum_index":51364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(3-methoxybenzyl)ethanamine (delta mass: 123.0229 Da; putative annotation: N/A; putative formula: C8HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.167,"smiles":null,"spectrum_id":"CCMSLIB00017317905","spectrum_index":51365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 64.1036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.195,"smiles":null,"spectrum_id":"CCMSLIB00017317906","spectrum_index":51366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 546.3626 Da; putative annotation: N/A; putative formula: C36H51O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":801.497,"smiles":null,"spectrum_id":"CCMSLIB00017317907","spectrum_index":51367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 40.0314 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.107,"smiles":null,"spectrum_id":"CCMSLIB00017317908","spectrum_index":51368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 462.283 Da; putative annotation: N/A; putative formula: C23H42O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.395,"smiles":null,"spectrum_id":"CCMSLIB00017317909","spectrum_index":51369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 168.1515 Da; putative annotation: N/A; putative formula: C11H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.232,"smiles":null,"spectrum_id":"CCMSLIB00017317910","spectrum_index":51370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chromone-2-carboxylic acid (delta mass: 81.0426 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.077,"smiles":null,"spectrum_id":"CCMSLIB00017317911","spectrum_index":51371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 162.0588 Da; putative annotation: N/A; putative formula: C4H12N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.118,"smiles":null,"spectrum_id":"CCMSLIB00017317912","spectrum_index":51372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 365.1337 Da; putative annotation: N/A; putative formula: C15H19N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.235,"smiles":null,"spectrum_id":"CCMSLIB00017317913","spectrum_index":51373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 64.5624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.664,"smiles":null,"spectrum_id":"CCMSLIB00017317914","spectrum_index":51374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 17.0271 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.301,"smiles":null,"spectrum_id":"CCMSLIB00017317915","spectrum_index":51375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 229.9854 Da; putative annotation: N/A; putative formula: C4H10N2O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.144,"smiles":null,"spectrum_id":"CCMSLIB00017317916","spectrum_index":51376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-4-oxobutanoic acid (delta mass: 162.0318 Da; putative annotation: N/A; putative formula: C9H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.113,"smiles":null,"spectrum_id":"CCMSLIB00017317917","spectrum_index":51377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 370.2504 Da; putative annotation: N/A; putative formula: C24H34O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.352,"smiles":null,"spectrum_id":"CCMSLIB00017317918","spectrum_index":51378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 52.9803 Da; putative annotation: N/A; putative formula: C2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.087,"smiles":null,"spectrum_id":"CCMSLIB00017317919","spectrum_index":51379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 283.299 Da; putative annotation: N/A; putative formula: C17H37N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.37,"smiles":null,"spectrum_id":"CCMSLIB00017317920","spectrum_index":51380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 903.1037 Da; putative annotation: N/A; putative formula: C37H31N9O11P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1125.2,"smiles":null,"spectrum_id":"CCMSLIB00017317921","spectrum_index":51381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 235.1415 Da; putative annotation: N/A; putative formula: C10H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.317,"smiles":null,"spectrum_id":"CCMSLIB00017317922","spectrum_index":51382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 440.6433 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.74,"smiles":null,"spectrum_id":"CCMSLIB00017317923","spectrum_index":51383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-4-nitronbenzoyl homoveratrylamine (delta mass: 171.1042 Da; putative annotation: N/A; putative formula: C6H14N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.233,"smiles":null,"spectrum_id":"CCMSLIB00017317924","spectrum_index":51384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 206.1309 Da; putative annotation: N/A; putative formula: C13H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.228,"smiles":null,"spectrum_id":"CCMSLIB00017317925","spectrum_index":51385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 221.0348 Da; putative annotation: N/A; putative formula: C4H3N11O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.121,"smiles":null,"spectrum_id":"CCMSLIB00017317926","spectrum_index":51386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 63.027 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.129,"smiles":null,"spectrum_id":"CCMSLIB00017317927","spectrum_index":51387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 194.0099 Da; putative annotation: N/A; putative formula: C5H11N2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.112,"smiles":null,"spectrum_id":"CCMSLIB00017317928","spectrum_index":51388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 67.0672 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017317929","spectrum_index":51389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 281.0905 Da; putative annotation: N/A; putative formula: C8H12N9OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":786.267,"smiles":null,"spectrum_id":"CCMSLIB00017317930","spectrum_index":51390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 126.0317 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.155,"smiles":null,"spectrum_id":"CCMSLIB00017317931","spectrum_index":51391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 216.0811 Da; putative annotation: N/A; putative formula: C12H13N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.205,"smiles":null,"spectrum_id":"CCMSLIB00017317932","spectrum_index":51392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 224.0938 Da; putative annotation: N/A; putative formula: C6H16N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.195,"smiles":null,"spectrum_id":"CCMSLIB00017317933","spectrum_index":51393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 99.0321 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.145,"smiles":null,"spectrum_id":"CCMSLIB00017317934","spectrum_index":51394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of colchicine CollisionEnergy:205060 (delta mass: 17.945 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.121,"smiles":null,"spectrum_id":"CCMSLIB00017317935","spectrum_index":51395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 322.0805 Da; putative annotation: N/A; putative formula: C17H15N4O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.167,"smiles":null,"spectrum_id":"CCMSLIB00017317936","spectrum_index":51396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dimethylnicotinic acid (delta mass: 38.0169 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.087,"smiles":null,"spectrum_id":"CCMSLIB00017317937","spectrum_index":51397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmine hydrochloride (delta mass: 120.0545 Da; putative annotation: N/A; putative formula: C4H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.133,"smiles":null,"spectrum_id":"CCMSLIB00017317938","spectrum_index":51398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 112.0522 Da; putative annotation: 4-Oxohexanoic acid; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.133,"smiles":null,"spectrum_id":"CCMSLIB00017317939","spectrum_index":51399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 121.0526 Da; putative annotation: 5-Amino-2-methoxyphenol; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.149,"smiles":null,"spectrum_id":"CCMSLIB00017317940","spectrum_index":51400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 189.0428 Da; putative annotation: (3-Oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetic acid; putative formula: C10H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.134,"smiles":null,"spectrum_id":"CCMSLIB00017317941","spectrum_index":51401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Desmethylquinidine (delta mass: 310.1589 Da; putative annotation: trans-Crocetin; putative formula: C20H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.334,"smiles":null,"spectrum_id":"CCMSLIB00017317942","spectrum_index":51402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 91.0422 Da; putative annotation: 3-Aminophenol; AIF; CE0; CorrDec; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.097,"smiles":null,"spectrum_id":"CCMSLIB00017317943","spectrum_index":51403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 399.2428 Da; putative annotation: Aspochalasin H; putative formula: C24H33NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.34,"smiles":null,"spectrum_id":"CCMSLIB00017317944","spectrum_index":51404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tazettine (delta mass: 180.0775 Da; putative annotation: Guaiphenesin; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.227,"smiles":null,"spectrum_id":"CCMSLIB00017317945","spectrum_index":51405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 117.0424 Da; putative annotation: Adenine; putative formula: C5H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.134,"smiles":null,"spectrum_id":"CCMSLIB00017317946","spectrum_index":51406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 147.0784 Da; putative annotation: N/A; putative formula: C8H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.181,"smiles":null,"spectrum_id":"CCMSLIB00017317947","spectrum_index":51407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CLE_291.1026_12.2 (delta mass: 4.1237 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.226,"smiles":null,"spectrum_id":"CCMSLIB00017317948","spectrum_index":51408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 161.0341 Da; putative annotation: N/A; putative formula: C6H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.11,"smiles":null,"spectrum_id":"CCMSLIB00017317949","spectrum_index":51409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 240.1038 Da; putative annotation: N/A; putative formula: C10H16N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.192,"smiles":null,"spectrum_id":"CCMSLIB00017317950","spectrum_index":51410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 96.0324 Da; putative annotation: N/A; putative formula: C4H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.103,"smiles":null,"spectrum_id":"CCMSLIB00017317951","spectrum_index":51411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 287.1283 Da; putative annotation: N/A; putative formula: C16H13N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":646.314,"smiles":null,"spectrum_id":"CCMSLIB00017317952","spectrum_index":51412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 156.1505 Da; putative annotation: N/A; putative formula: C10H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.231,"smiles":null,"spectrum_id":"CCMSLIB00017317953","spectrum_index":51413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 162.0994 Da; putative annotation: N/A; putative formula: C6H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.17,"smiles":null,"spectrum_id":"CCMSLIB00017317954","spectrum_index":51414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 763.416 Da; putative annotation: N/A; putative formula: C41H57N5O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":956.487,"smiles":null,"spectrum_id":"CCMSLIB00017317955","spectrum_index":51415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 146.0218 Da; putative annotation: N/A; putative formula: C5H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.103,"smiles":null,"spectrum_id":"CCMSLIB00017317956","spectrum_index":51416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 109.0525 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.144,"smiles":null,"spectrum_id":"CCMSLIB00017317957","spectrum_index":51417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 192.1884 Da; putative annotation: N/A; putative formula: C14H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.275,"smiles":null,"spectrum_id":"CCMSLIB00017317958","spectrum_index":51418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)benzamide (delta mass: 9.9546 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.088,"smiles":null,"spectrum_id":"CCMSLIB00017317959","spectrum_index":51419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 36.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.102,"smiles":null,"spectrum_id":"CCMSLIB00017317960","spectrum_index":51420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 47.0087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.089,"smiles":null,"spectrum_id":"CCMSLIB00017317961","spectrum_index":51421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 109.0269 Da; putative annotation: N/A; putative formula: C4H3N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.103,"smiles":null,"spectrum_id":"CCMSLIB00017317962","spectrum_index":51422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxytryptophol (delta mass: 117.0578 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.144,"smiles":null,"spectrum_id":"CCMSLIB00017317963","spectrum_index":51423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3-Aminopropyl)-4-methyl-2-nitroaniline (delta mass: 88.0308 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.155,"smiles":null,"spectrum_id":"CCMSLIB00017317964","spectrum_index":51424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 89.0015 Da; putative annotation: N/A; putative formula: C4H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.061,"smiles":null,"spectrum_id":"CCMSLIB00017317965","spectrum_index":51425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 83.1665 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.226,"smiles":null,"spectrum_id":"CCMSLIB00017317966","spectrum_index":51426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 4.0332 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.151,"smiles":null,"spectrum_id":"CCMSLIB00017317967","spectrum_index":51427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 41.3288 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.41,"smiles":null,"spectrum_id":"CCMSLIB00017317968","spectrum_index":51428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 103.0629 Da; putative annotation: N/A; putative formula: C4H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.123,"smiles":null,"spectrum_id":"CCMSLIB00017317969","spectrum_index":51429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 925.2817 Da; putative annotation: N/A; putative formula: C50H47N5O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1137.33,"smiles":null,"spectrum_id":"CCMSLIB00017317970","spectrum_index":51430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 224.12 Da; putative annotation: N/A; putative formula: C16H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.191,"smiles":null,"spectrum_id":"CCMSLIB00017317971","spectrum_index":51431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Isopropyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid (delta mass: 179.0786 Da; putative annotation: N/A; putative formula: C3H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.223,"smiles":null,"spectrum_id":"CCMSLIB00017317972","spectrum_index":51432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 165.0871 Da; putative annotation: N/A; putative formula: C4H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.208,"smiles":null,"spectrum_id":"CCMSLIB00017317973","spectrum_index":51433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 131.0985 Da; putative annotation: N/A; putative formula: C5H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.161,"smiles":null,"spectrum_id":"CCMSLIB00017317974","spectrum_index":51434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homoveratrylamine (delta mass: 27.0113 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.129,"smiles":null,"spectrum_id":"CCMSLIB00017317975","spectrum_index":51435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380136-01!1-(2,3-dihydropyrrol-1-yl)-8,9-dihydroxy-2-methyldecane-1,3-dione (delta mass: 300.2072 Da; putative annotation: N/A; putative formula: C14H29N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.393,"smiles":null,"spectrum_id":"CCMSLIB00017317976","spectrum_index":51436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 357.2154 Da; putative annotation: N/A; putative formula: C18H31NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.276,"smiles":null,"spectrum_id":"CCMSLIB00017317977","spectrum_index":51437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 149.0736 Da; putative annotation: N/A; putative formula: C4H12N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.253,"smiles":null,"spectrum_id":"CCMSLIB00017317978","spectrum_index":51438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE30; MS2Dec (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":100.076,"smiles":null,"spectrum_id":"CCMSLIB00017317979","spectrum_index":51439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 419.3663 Da; putative annotation: N/A; putative formula: C29H45N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.536,"smiles":null,"spectrum_id":"CCMSLIB00017317980","spectrum_index":51440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-7-methoxy-6-oxooxepino[2,3-b]chromene-5-carboxylic acid (delta mass: 502.1527 Da; putative annotation: N/A; putative formula: C26H27N6O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":819.218,"smiles":null,"spectrum_id":"CCMSLIB00017317981","spectrum_index":51441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1127.3753 Da; putative annotation: N/A; putative formula: C43H69NO33)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1290.44,"smiles":null,"spectrum_id":"CCMSLIB00017317982","spectrum_index":51442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 92.073 Da; putative annotation: N/A; putative formula: C6H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.11,"smiles":null,"spectrum_id":"CCMSLIB00017317983","spectrum_index":51443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 208.1201 Da; putative annotation: N/A; putative formula: C11H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.258,"smiles":null,"spectrum_id":"CCMSLIB00017317984","spectrum_index":51444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4R,5R,6S)-2-[[(2R,3S,4S,5R,6R)-6-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol (delta mass: 74.9117 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":684.202,"smiles":null,"spectrum_id":"CCMSLIB00017317985","spectrum_index":51445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl (2Z)-2-cyano-3-(1H-indol-3-yl)prop-2-enoate (delta mass: 17.0028 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.1,"smiles":null,"spectrum_id":"CCMSLIB00017317986","spectrum_index":51446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 204.1882 Da; putative annotation: N/A; putative formula: C15H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.3,"smiles":null,"spectrum_id":"CCMSLIB00017317987","spectrum_index":51447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 432.795 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.866,"smiles":null,"spectrum_id":"CCMSLIB00017317988","spectrum_index":51448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 43.3919 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.457,"smiles":null,"spectrum_id":"CCMSLIB00017317989","spectrum_index":51449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 59.1302 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.289,"smiles":null,"spectrum_id":"CCMSLIB00017317990","spectrum_index":51450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 80.1499 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.226,"smiles":null,"spectrum_id":"CCMSLIB00017317991","spectrum_index":51451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 27.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.18,"smiles":null,"spectrum_id":"CCMSLIB00017317992","spectrum_index":51452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 562.241 Da; putative annotation: N/A; putative formula: C42H30N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":781.343,"smiles":null,"spectrum_id":"CCMSLIB00017317993","spectrum_index":51453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 804.5721 Da; putative annotation: N/A; putative formula: C43H84N2O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":967.632,"smiles":null,"spectrum_id":"CCMSLIB00017317994","spectrum_index":51454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 169.1216 Da; putative annotation: N/A; putative formula: C8H15N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.239,"smiles":null,"spectrum_id":"CCMSLIB00017317995","spectrum_index":51455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 445.2993 Da; putative annotation: N/A; putative formula: C23H39N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.375,"smiles":null,"spectrum_id":"CCMSLIB00017317996","spectrum_index":51456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 665.4302 Da; putative annotation: N/A; putative formula: C41H55N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":798.506,"smiles":null,"spectrum_id":"CCMSLIB00017317997","spectrum_index":51457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olodaterol (delta mass: 229.1029 Da; putative annotation: N/A; putative formula: C5H11N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.294,"smiles":null,"spectrum_id":"CCMSLIB00017317998","spectrum_index":51458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine N-oxide (delta mass: 16.1529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.297,"smiles":null,"spectrum_id":"CCMSLIB00017317999","spectrum_index":51459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 38.121 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.181,"smiles":null,"spectrum_id":"CCMSLIB00017318000","spectrum_index":51460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 46.0091 Da; putative annotation: N/A; putative formula: H3N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.096,"smiles":null,"spectrum_id":"CCMSLIB00017318001","spectrum_index":51461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 280.0988 Da; putative annotation: N/A; putative formula: C12H24OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.187,"smiles":null,"spectrum_id":"CCMSLIB00017318002","spectrum_index":51462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 160.0871 Da; putative annotation: N/A; putative formula: C11H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.262,"smiles":null,"spectrum_id":"CCMSLIB00017318003","spectrum_index":51463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 25.0314 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.144,"smiles":null,"spectrum_id":"CCMSLIB00017318004","spectrum_index":51464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 464.1529 Da; putative annotation: N/A; putative formula: C19H28O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.213,"smiles":null,"spectrum_id":"CCMSLIB00017318005","spectrum_index":51465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 16.0055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.154,"smiles":null,"spectrum_id":"CCMSLIB00017318006","spectrum_index":51466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 209.1658 Da; putative annotation: N/A; putative formula: C10H19N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.171,"smiles":null,"spectrum_id":"CCMSLIB00017318007","spectrum_index":51467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 78.0091 Da; putative annotation: N/A; putative formula: CH-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.116,"smiles":null,"spectrum_id":"CCMSLIB00017318008","spectrum_index":51468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 9.9844 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.07,"smiles":null,"spectrum_id":"CCMSLIB00017318009","spectrum_index":51469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Asp-Gly (delta mass: 63.0216 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.088,"smiles":null,"spectrum_id":"CCMSLIB00017318010","spectrum_index":51470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(+)-4-Amino-3-hydroxybutyric acid (delta mass: 240.202 Da; putative annotation: N/A; putative formula: C14H28N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.267,"smiles":null,"spectrum_id":"CCMSLIB00017318011","spectrum_index":51471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin D (delta mass: 50.0501 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.235,"smiles":null,"spectrum_id":"CCMSLIB00017318012","spectrum_index":51472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Lactose from NIST14 (delta mass: 149.0206 Da; putative annotation: N/A; putative formula: C2H-1N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.144,"smiles":null,"spectrum_id":"CCMSLIB00017318013","spectrum_index":51473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 83.0371 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017318014","spectrum_index":51474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 65.0266 Da; putative annotation: N/A; putative formula: C4H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.081,"smiles":null,"spectrum_id":"CCMSLIB00017318015","spectrum_index":51475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 545.1959 Da; putative annotation: N/A; putative formula: C34H31N3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.319,"smiles":null,"spectrum_id":"CCMSLIB00017318016","spectrum_index":51476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 327.2087 Da; putative annotation: N/A; putative formula: C15H29N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.337,"smiles":null,"spectrum_id":"CCMSLIB00017318017","spectrum_index":51477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 99.0094 Da; putative annotation: N/A; putative formula: CH2N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.106,"smiles":null,"spectrum_id":"CCMSLIB00017318018","spectrum_index":51478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 257.1252 Da; putative annotation: N/A; putative formula: C9H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.248,"smiles":null,"spectrum_id":"CCMSLIB00017318019","spectrum_index":51479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 220.106 Da; putative annotation: N/A; putative formula: C8H16N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.208,"smiles":null,"spectrum_id":"CCMSLIB00017318020","spectrum_index":51480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2a-Hydroxy-7-(hydroxymethyl)-2,2,4a,10b-tetramethyl-1a,2a,4,4a,10,10a,10b,11a-octahydro-2H,7H-[1]benzoxireno[3,4-f]pyrano[2,3-b]chromene-9,11(3H,8H)-dione (delta mass: 27.9987 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.19,"smiles":null,"spectrum_id":"CCMSLIB00017318021","spectrum_index":51481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 83.0188 Da; putative annotation: N/A; putative formula: C4H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.157,"smiles":null,"spectrum_id":"CCMSLIB00017318022","spectrum_index":51482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 26.015 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.19,"smiles":null,"spectrum_id":"CCMSLIB00017318023","spectrum_index":51483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thiodiglycol (delta mass: 55.0501 Da; putative annotation: N/A; putative formula: C2H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.098,"smiles":null,"spectrum_id":"CCMSLIB00017318024","spectrum_index":51484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 184.0732 Da; putative annotation: N/A; putative formula: C9H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.176,"smiles":null,"spectrum_id":"CCMSLIB00017318025","spectrum_index":51485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 584.2263 Da; putative annotation: N/A; putative formula: C34H37N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":803.328,"smiles":null,"spectrum_id":"CCMSLIB00017318026","spectrum_index":51486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ornithine-C4:0 (delta mass: 118.0416 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.181,"smiles":null,"spectrum_id":"CCMSLIB00017318027","spectrum_index":51487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 158.0407 Da; putative annotation: N/A; putative formula: C7H10O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.132,"smiles":null,"spectrum_id":"CCMSLIB00017318028","spectrum_index":51488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Leu (delta mass: 63.0359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.165,"smiles":null,"spectrum_id":"CCMSLIB00017318029","spectrum_index":51489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 289.1527 Da; putative annotation: N/A; putative formula: C13H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.25,"smiles":null,"spectrum_id":"CCMSLIB00017318030","spectrum_index":51490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyluridine (delta mass: 17.0879 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.18,"smiles":null,"spectrum_id":"CCMSLIB00017318031","spectrum_index":51491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 69.0582 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.155,"smiles":null,"spectrum_id":"CCMSLIB00017318032","spectrum_index":51492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 482.404 Da; putative annotation: N/A; putative formula: C35H50N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":645.464,"smiles":null,"spectrum_id":"CCMSLIB00017318033","spectrum_index":51493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 345.1644 Da; putative annotation: N/A; putative formula: C23H24NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":633.287,"smiles":null,"spectrum_id":"CCMSLIB00017318034","spectrum_index":51494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 85.0535 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.224,"smiles":null,"spectrum_id":"CCMSLIB00017318035","spectrum_index":51495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 224.1766 Da; putative annotation: N/A; putative formula: C14H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.341,"smiles":null,"spectrum_id":"CCMSLIB00017318036","spectrum_index":51496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 86.0507 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.106,"smiles":null,"spectrum_id":"CCMSLIB00017318037","spectrum_index":51497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 146.0729 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.144,"smiles":null,"spectrum_id":"CCMSLIB00017318038","spectrum_index":51498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 301.0101 Da; putative annotation: N/A; putative formula: C9H8N3O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.06,"smiles":null,"spectrum_id":"CCMSLIB00017318039","spectrum_index":51499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 159.0865 Da; putative annotation: N/A; putative formula: C3H9N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.146,"smiles":null,"spectrum_id":"CCMSLIB00017318040","spectrum_index":51500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dimethoxyindole (delta mass: 146.0549 Da; putative annotation: N/A; putative formula: C2H6N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.141,"smiles":null,"spectrum_id":"CCMSLIB00017318041","spectrum_index":51501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-amino-3-hydroxynonanoic acid CollisionEnergy:102040 (delta mass: 27.9952 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017318042","spectrum_index":51502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 298.1567 Da; putative annotation: N/A; putative formula: C19H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.274,"smiles":null,"spectrum_id":"CCMSLIB00017318043","spectrum_index":51503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoformosanine (delta mass: 110.013 Da; putative annotation: N/A; putative formula: C4H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.194,"smiles":null,"spectrum_id":"CCMSLIB00017318044","spectrum_index":51504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin (delta mass: 106.0624 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.174,"smiles":null,"spectrum_id":"CCMSLIB00017318045","spectrum_index":51505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 146.0733 Da; putative annotation: N/A; putative formula: C6H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.133,"smiles":null,"spectrum_id":"CCMSLIB00017318046","spectrum_index":51506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005787 Indole-3-carboxylic acid|1H-indole-3-carboxylic acid (delta mass: 32.0392 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.094,"smiles":null,"spectrum_id":"CCMSLIB00017318047","spectrum_index":51507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thiamine thiozole (delta mass: 486.1492 Da; putative annotation: N/A; putative formula: C23H27N4O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.197,"smiles":null,"spectrum_id":"CCMSLIB00017318048","spectrum_index":51508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 30.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.16,"smiles":null,"spectrum_id":"CCMSLIB00017318049","spectrum_index":51509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Statine (delta mass: 50.0521 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.18,"smiles":null,"spectrum_id":"CCMSLIB00017318050","spectrum_index":51510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 204.1377 Da; putative annotation: N/A; putative formula: C11H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.255,"smiles":null,"spectrum_id":"CCMSLIB00017318051","spectrum_index":51511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[(2,3-Dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl)sulfonyl]propanoic acid (delta mass: 17.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.064,"smiles":null,"spectrum_id":"CCMSLIB00017318052","spectrum_index":51512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 246.198 Da; putative annotation: N/A; putative formula: C17H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.295,"smiles":null,"spectrum_id":"CCMSLIB00017318053","spectrum_index":51513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 214.1319 Da; putative annotation: N/A; putative formula: C10H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.229,"smiles":null,"spectrum_id":"CCMSLIB00017318054","spectrum_index":51514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 123.0116 Da; putative annotation: N/A; putative formula: CH5N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.135,"smiles":null,"spectrum_id":"CCMSLIB00017318055","spectrum_index":51515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 123.0117 Da; putative annotation: N/A; putative formula: CH5N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.135,"smiles":null,"spectrum_id":"CCMSLIB00017318056","spectrum_index":51516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(1H)-Quinolinone, 3,4-dihydro-4-hydroxy-3-methoxy-4-(4-methoxyphenyl)- (delta mass: 95.0373 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.16,"smiles":null,"spectrum_id":"CCMSLIB00017318057","spectrum_index":51517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxytyramine (delta mass: 23.4137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017318058","spectrum_index":51518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(1H-Indol-3-yl)ethyl]benzamide (delta mass: 141.0418 Da; putative annotation: N/A; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.175,"smiles":null,"spectrum_id":"CCMSLIB00017318059","spectrum_index":51519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 187.0035 Da; putative annotation: N/A; putative formula: C6H6NO4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.105,"smiles":null,"spectrum_id":"CCMSLIB00017318060","spectrum_index":51520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Methoxy-5H-dibenzo[b,f]azepine (delta mass: 17.0221 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.129,"smiles":null,"spectrum_id":"CCMSLIB00017318061","spectrum_index":51521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 27.0467 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.207,"smiles":null,"spectrum_id":"CCMSLIB00017318062","spectrum_index":51522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 120.0666 Da; putative annotation: N/A; putative formula: C2H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.152,"smiles":null,"spectrum_id":"CCMSLIB00017318063","spectrum_index":51523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 334.1263 Da; putative annotation: N/A; putative formula: C12H10N14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.218,"smiles":null,"spectrum_id":"CCMSLIB00017318064","spectrum_index":51524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentaethylenehexamine (delta mass: 51.0496 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.294,"smiles":null,"spectrum_id":"CCMSLIB00017318065","spectrum_index":51525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Gly-Ile from NIST14 (delta mass: 129.0426 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.166,"smiles":null,"spectrum_id":"CCMSLIB00017318066","spectrum_index":51526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 82.0784 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.248,"smiles":null,"spectrum_id":"CCMSLIB00017318067","spectrum_index":51527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Cyanomethyl)-1H-indole-2-carboxylic acid (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.061,"smiles":null,"spectrum_id":"CCMSLIB00017318068","spectrum_index":51528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of lysergol (delta mass: 59.0828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.232,"smiles":null,"spectrum_id":"CCMSLIB00017318069","spectrum_index":51529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 11.0161 Da; putative annotation: N/A; putative formula: CHNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.102,"smiles":null,"spectrum_id":"CCMSLIB00017318070","spectrum_index":51530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 269.1485 Da; putative annotation: N/A; putative formula: C11H19N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.261,"smiles":null,"spectrum_id":"CCMSLIB00017318071","spectrum_index":51531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 117.0862 Da; putative annotation: N/A; putative formula: H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.272,"smiles":null,"spectrum_id":"CCMSLIB00017318072","spectrum_index":51532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol (delta mass: 208.0368 Da; putative annotation: N/A; putative formula: C10H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.102,"smiles":null,"spectrum_id":"CCMSLIB00017318073","spectrum_index":51533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(5,7-Difluoro-2-methyl-1H-indol-3-yl)ethanamine (delta mass: 9.0278 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.132,"smiles":null,"spectrum_id":"CCMSLIB00017318074","spectrum_index":51534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 126.0814 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.152,"smiles":null,"spectrum_id":"CCMSLIB00017318075","spectrum_index":51535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 163.0771 Da; putative annotation: 4'-Fluoromethcathinone; putative formula: C10H10FN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.159,"smiles":null,"spectrum_id":"CCMSLIB00017318076","spectrum_index":51536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 113.0855 Da; putative annotation: N-Methyl-L-valine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.235,"smiles":null,"spectrum_id":"CCMSLIB00017318077","spectrum_index":51537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Leu (delta mass: 212.154 Da; putative annotation: Leu-Val; putative formula: C11H20N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.324,"smiles":null,"spectrum_id":"CCMSLIB00017318078","spectrum_index":51538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 225.0733 Da; putative annotation: Cytidine; putative formula: C9H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.133,"smiles":null,"spectrum_id":"CCMSLIB00017318079","spectrum_index":51539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 169.0744 Da; putative annotation: Ethyl 2-acetamido-3-oxobutanoate; putative formula: C8H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.145,"smiles":null,"spectrum_id":"CCMSLIB00017318080","spectrum_index":51540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 256.1208 Da; putative annotation: Massbank:CE000061 IAA-Val; putative formula: C15H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.191,"smiles":null,"spectrum_id":"CCMSLIB00017318081","spectrum_index":51541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 211.0917 Da; putative annotation: Pro-Asn; putative formula: C9H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.245,"smiles":null,"spectrum_id":"CCMSLIB00017318082","spectrum_index":51542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 112.0514 Da; putative annotation: 5-(1-Hydroxyethyl)oxolan-2-one; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.164,"smiles":null,"spectrum_id":"CCMSLIB00017318083","spectrum_index":51543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 190.1347 Da; putative annotation: 4,4,7a-Trimethyl-3a,5,6,7-tetrahydro-3H-indene-1-carboxylic acid; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.247,"smiles":null,"spectrum_id":"CCMSLIB00017318084","spectrum_index":51544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 160.099 Da; putative annotation: 4-Phenylbutanehydrazide; putative formula: C10H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017318085","spectrum_index":51545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 192.1874 Da; putative annotation: (Z,E)-Tetradeca-9,12-dienol; putative formula: C14H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.258,"smiles":null,"spectrum_id":"CCMSLIB00017318086","spectrum_index":51546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 334.2149 Da; putative annotation: 1-Naphthalenepentanoic acid, 5-carboxy-1,2,3,4,4a,7,8,8a-octahydro-7-hydroxy-.beta.,1,2,4a-tetramethyl-; putative formula: C20H30O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.263,"smiles":null,"spectrum_id":"CCMSLIB00017318087","spectrum_index":51547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 67.0428 Da; putative annotation: 2-Pyrrolidinone; AIF; CE10; CorrDec; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017318088","spectrum_index":51548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 80.0617 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.236,"smiles":null,"spectrum_id":"CCMSLIB00017318089","spectrum_index":51549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TYRAMINE - 50.0 eV (delta mass: 408.3031 Da; putative annotation: N/A; putative formula: C28H40O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.394,"smiles":null,"spectrum_id":"CCMSLIB00017318090","spectrum_index":51550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indolmycin (delta mass: 424.2552 Da; putative annotation: N/A; putative formula: C34H32O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":682.379,"smiles":null,"spectrum_id":"CCMSLIB00017318091","spectrum_index":51551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 158.1915 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.226,"smiles":null,"spectrum_id":"CCMSLIB00017318092","spectrum_index":51552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose - 40.0 eV (delta mass: 215.0939 Da; putative annotation: N/A; putative formula: C7H14N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.217,"smiles":null,"spectrum_id":"CCMSLIB00017318093","spectrum_index":51553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 29.0158 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.138,"smiles":null,"spectrum_id":"CCMSLIB00017318094","spectrum_index":51554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 119.0574 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.117,"smiles":null,"spectrum_id":"CCMSLIB00017318095","spectrum_index":51555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 92.0631 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.139,"smiles":null,"spectrum_id":"CCMSLIB00017318096","spectrum_index":51556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 122.1005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.224,"smiles":null,"spectrum_id":"CCMSLIB00017318097","spectrum_index":51557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 85.0526 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.128,"smiles":null,"spectrum_id":"CCMSLIB00017318098","spectrum_index":51558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 232.1095 Da; putative annotation: N/A; putative formula: C14H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.233,"smiles":null,"spectrum_id":"CCMSLIB00017318099","spectrum_index":51559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 176.0303 Da; putative annotation: N/A; putative formula: C3H8N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.205,"smiles":null,"spectrum_id":"CCMSLIB00017318100","spectrum_index":51560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 155.0583 Da; putative annotation: N/A; putative formula: C7H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.145,"smiles":null,"spectrum_id":"CCMSLIB00017318101","spectrum_index":51561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 178.1144 Da; putative annotation: N/A; putative formula: C15H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.201,"smiles":null,"spectrum_id":"CCMSLIB00017318102","spectrum_index":51562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017318103","spectrum_index":51563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 168.1146 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.179,"smiles":null,"spectrum_id":"CCMSLIB00017318104","spectrum_index":51564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 128.1558 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.236,"smiles":null,"spectrum_id":"CCMSLIB00017318105","spectrum_index":51565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 115.0526 Da; putative annotation: N/A; putative formula: C7H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.16,"smiles":null,"spectrum_id":"CCMSLIB00017318106","spectrum_index":51566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 46.0042 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.101,"smiles":null,"spectrum_id":"CCMSLIB00017318107","spectrum_index":51567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 62.0156 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.081,"smiles":null,"spectrum_id":"CCMSLIB00017318108","spectrum_index":51568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 27.991 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.093,"smiles":null,"spectrum_id":"CCMSLIB00017318109","spectrum_index":51569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 383.6745 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.776,"smiles":null,"spectrum_id":"CCMSLIB00017318110","spectrum_index":51570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alline (delta mass: 177.0751 Da; putative annotation: N/A; putative formula: C5H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.193,"smiles":null,"spectrum_id":"CCMSLIB00017318111","spectrum_index":51571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 22.9977 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.062,"smiles":null,"spectrum_id":"CCMSLIB00017318112","spectrum_index":51572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Glu (delta mass: 129.0427 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.187,"smiles":null,"spectrum_id":"CCMSLIB00017318113","spectrum_index":51573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 212.0866 Da; putative annotation: N/A; putative formula: C13H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.246,"smiles":null,"spectrum_id":"CCMSLIB00017318114","spectrum_index":51574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 134.0576 Da; putative annotation: N/A; putative formula: C5H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.144,"smiles":null,"spectrum_id":"CCMSLIB00017318115","spectrum_index":51575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 27.0151 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.149,"smiles":null,"spectrum_id":"CCMSLIB00017318116","spectrum_index":51576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole-3-acetic acid CollisionEnergy:205060 (delta mass: 176.0769 Da; putative annotation: N/A; putative formula: C2H8N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.142,"smiles":null,"spectrum_id":"CCMSLIB00017318117","spectrum_index":51577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-3-pyridazinol (delta mass: 323.1085 Da; putative annotation: N/A; putative formula: C10H21N5O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.164,"smiles":null,"spectrum_id":"CCMSLIB00017318118","spectrum_index":51578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 568.2255 Da; putative annotation: N/A; putative formula: C23H28N12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":735.287,"smiles":null,"spectrum_id":"CCMSLIB00017318119","spectrum_index":51579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1022.2959 Da; putative annotation: N/A; putative formula: C38H66N6O14S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1185.36,"smiles":null,"spectrum_id":"CCMSLIB00017318120","spectrum_index":51580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 239.1533 Da; putative annotation: N/A; putative formula: C14H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.355,"smiles":null,"spectrum_id":"CCMSLIB00017318121","spectrum_index":51581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methyl indole CollisionEnergy:102040 (delta mass: 104.0614 Da; putative annotation: N/A; putative formula: C2H9N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.142,"smiles":null,"spectrum_id":"CCMSLIB00017318122","spectrum_index":51582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 266.0733 Da; putative annotation: N/A; putative formula: C20H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.155,"smiles":null,"spectrum_id":"CCMSLIB00017318123","spectrum_index":51583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Pyridyl)-4-methylthiazole-5-carboxylic acid (delta mass: 18.0165 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.054,"smiles":null,"spectrum_id":"CCMSLIB00017318124","spectrum_index":51584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl .alpha.-D-mannopyranoside (delta mass: 24.4137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.5,"smiles":null,"spectrum_id":"CCMSLIB00017318125","spectrum_index":51585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 56.0632 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.181,"smiles":null,"spectrum_id":"CCMSLIB00017318126","spectrum_index":51586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Benzimidazol-2-ylamino)-1-propanol (delta mass: 118.041 Da; putative annotation: N/A; putative formula: C2H7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.154,"smiles":null,"spectrum_id":"CCMSLIB00017318127","spectrum_index":51587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1073.37 Da; putative annotation: N/A; putative formula: C41H70N7O18P3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1236.43,"smiles":null,"spectrum_id":"CCMSLIB00017318128","spectrum_index":51588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 978.3056 Da; putative annotation: N/A; putative formula: C64H42N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1141.37,"smiles":null,"spectrum_id":"CCMSLIB00017318129","spectrum_index":51589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline [M+H-H2O]+; AIF; CE0; MS2Dec (delta mass: 221.0683 Da; putative annotation: N/A; putative formula: C11H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.15,"smiles":null,"spectrum_id":"CCMSLIB00017318130","spectrum_index":51590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 30.501 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.523,"smiles":null,"spectrum_id":"CCMSLIB00017318131","spectrum_index":51591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 329.1483 Da; putative annotation: N/A; putative formula: C16H27NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.224,"smiles":null,"spectrum_id":"CCMSLIB00017318132","spectrum_index":51592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 329.1841 Da; putative annotation: N/A; putative formula: C16H27NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.26,"smiles":null,"spectrum_id":"CCMSLIB00017318133","spectrum_index":51593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 227.3187 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.488,"smiles":null,"spectrum_id":"CCMSLIB00017318134","spectrum_index":51594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 15.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.086,"smiles":null,"spectrum_id":"CCMSLIB00017318135","spectrum_index":51595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 56.087 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.221,"smiles":null,"spectrum_id":"CCMSLIB00017318136","spectrum_index":51596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 131.0293 Da; putative annotation: N/A; putative formula: C8H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.131,"smiles":null,"spectrum_id":"CCMSLIB00017318137","spectrum_index":51597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucosamine; AIF; CE10; MS2Dec (delta mass: 91.0415 Da; putative annotation: N/A; putative formula: H6N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.128,"smiles":null,"spectrum_id":"CCMSLIB00017318138","spectrum_index":51598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(5-Nitro-1H-indol-3-yl)ethan-1-one (delta mass: 39.1298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.191,"smiles":null,"spectrum_id":"CCMSLIB00017318139","spectrum_index":51599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 72.0217 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.15,"smiles":null,"spectrum_id":"CCMSLIB00017318140","spectrum_index":51600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 154.0265 Da; putative annotation: N/A; putative formula: C7H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.139,"smiles":null,"spectrum_id":"CCMSLIB00017318141","spectrum_index":51601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 74.0731 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017318142","spectrum_index":51602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 21.9844 Da; putative annotation: N/A; putative formula: C2H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.086,"smiles":null,"spectrum_id":"CCMSLIB00017318143","spectrum_index":51603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 111.0471 Da; putative annotation: N/A; putative formula: C9H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.091,"smiles":null,"spectrum_id":"CCMSLIB00017318144","spectrum_index":51604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Skatole - 40.0 eV (delta mass: 57.9592 Da; putative annotation: N/A; putative formula: CH-1OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.04,"smiles":null,"spectrum_id":"CCMSLIB00017318145","spectrum_index":51605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 14.016 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.108,"smiles":null,"spectrum_id":"CCMSLIB00017318146","spectrum_index":51606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 4.3976 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.5,"smiles":null,"spectrum_id":"CCMSLIB00017318147","spectrum_index":51607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-3-methyl-5-phenyl-, (5R)- (delta mass: 39.0853 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.2,"smiles":null,"spectrum_id":"CCMSLIB00017318148","spectrum_index":51608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001048999-01!1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole\"\" (delta mass: 111.0332 Da; putative annotation: N/A; putative formula: C5H5NO2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.141,"smiles":null,"spectrum_id":"CCMSLIB00017318149","spectrum_index":51609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 96.0428 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.212,"smiles":null,"spectrum_id":"CCMSLIB00017318150","spectrum_index":51610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Fluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 42.0126 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.084,"smiles":null,"spectrum_id":"CCMSLIB00017318151","spectrum_index":51611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 48.0453 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.132,"smiles":null,"spectrum_id":"CCMSLIB00017318152","spectrum_index":51612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 118.0279 Da; putative annotation: N/A; putative formula: C5H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.093,"smiles":null,"spectrum_id":"CCMSLIB00017318153","spectrum_index":51613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Indolinone (delta mass: 24.0017 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.062,"smiles":null,"spectrum_id":"CCMSLIB00017318154","spectrum_index":51614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 26.9992 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.085,"smiles":null,"spectrum_id":"CCMSLIB00017318155","spectrum_index":51615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 31.0172 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.124,"smiles":null,"spectrum_id":"CCMSLIB00017318156","spectrum_index":51616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 80.0626 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.118,"smiles":null,"spectrum_id":"CCMSLIB00017318157","spectrum_index":51617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 83.0273 Da; putative annotation: N/A; putative formula: C4H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.103,"smiles":null,"spectrum_id":"CCMSLIB00017318158","spectrum_index":51618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 43.0244 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.1,"smiles":null,"spectrum_id":"CCMSLIB00017318159","spectrum_index":51619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 39.9941 Da; putative annotation: N/A; putative formula: C2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.054,"smiles":null,"spectrum_id":"CCMSLIB00017318160","spectrum_index":51620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 236.1106 Da; putative annotation: N/A; putative formula: C4H8N14O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.176,"smiles":null,"spectrum_id":"CCMSLIB00017318161","spectrum_index":51621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 76.0287 Da; putative annotation: N/A; putative formula: CH4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.115,"smiles":null,"spectrum_id":"CCMSLIB00017318162","spectrum_index":51622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 17.0233 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017318163","spectrum_index":51623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 64.0464 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017318164","spectrum_index":51624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 33.1043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.186,"smiles":null,"spectrum_id":"CCMSLIB00017318165","spectrum_index":51625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 125.0064 Da; putative annotation: N/A; putative formula: H3N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.087,"smiles":null,"spectrum_id":"CCMSLIB00017318166","spectrum_index":51626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 56.0169 Da; putative annotation: N/A; putative formula: C3H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.182,"smiles":null,"spectrum_id":"CCMSLIB00017318167","spectrum_index":51627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 504.349 Da; putative annotation: N/A; putative formula: C28H56OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":813.461,"smiles":null,"spectrum_id":"CCMSLIB00017318168","spectrum_index":51628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE30; CorrDec (delta mass: 47.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.07,"smiles":null,"spectrum_id":"CCMSLIB00017318169","spectrum_index":51629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 86.0958 Da; putative annotation: N/A; putative formula: C3H10N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.112,"smiles":null,"spectrum_id":"CCMSLIB00017318170","spectrum_index":51630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole (delta mass: 495.2277 Da; putative annotation: N/A; putative formula: C29H29N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.288,"smiles":null,"spectrum_id":"CCMSLIB00017318171","spectrum_index":51631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 805.4264 Da; putative annotation: N/A; putative formula: C43H59N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":986.497,"smiles":null,"spectrum_id":"CCMSLIB00017318172","spectrum_index":51632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 61.0316 Da; putative annotation: N/A; putative formula: C5H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017318173","spectrum_index":51633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 152.1301 Da; putative annotation: N/A; putative formula: C9H16N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.216,"smiles":null,"spectrum_id":"CCMSLIB00017318174","spectrum_index":51634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6H-2-Benzopyran-6-one, 5-chloro-3-(3,4-dihydroxy-3,5-dimethyl-1-hepten-1-yl)-7,8-dihydro-7,8-dihydroxy-7-methyl- (delta mass: 164.1659 Da; putative annotation: N/A; putative formula: C11H20N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.307,"smiles":null,"spectrum_id":"CCMSLIB00017318175","spectrum_index":51635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 361.9032 Da; putative annotation: N/A; putative formula: C12H10OS6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.0,"smiles":null,"spectrum_id":"CCMSLIB00017318176","spectrum_index":51636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301324 Ethylbeta-carboline (delta mass: 16.0127 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.12,"smiles":null,"spectrum_id":"CCMSLIB00017318177","spectrum_index":51637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 26.0356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.189,"smiles":null,"spectrum_id":"CCMSLIB00017318178","spectrum_index":51638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(4-Fluorophenoxy)phenyl]-N-methylmethanamine (delta mass: 63.0155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.129,"smiles":null,"spectrum_id":"CCMSLIB00017318179","spectrum_index":51639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 17.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.159,"smiles":null,"spectrum_id":"CCMSLIB00017318180","spectrum_index":51640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 194.0741 Da; putative annotation: N/A; putative formula: C7H10N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.203,"smiles":null,"spectrum_id":"CCMSLIB00017318181","spectrum_index":51641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 197.9215 Da; putative annotation: N/A; putative formula: C2H2N2O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.023,"smiles":null,"spectrum_id":"CCMSLIB00017318182","spectrum_index":51642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 211.1921 Da; putative annotation: N/A; putative formula: C9H21N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.321,"smiles":null,"spectrum_id":"CCMSLIB00017318183","spectrum_index":51643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 62.0554 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.225,"smiles":null,"spectrum_id":"CCMSLIB00017318184","spectrum_index":51644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 99.0697 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.187,"smiles":null,"spectrum_id":"CCMSLIB00017318185","spectrum_index":51645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 110.0367 Da; putative annotation: N/A; putative formula: C6H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.144,"smiles":null,"spectrum_id":"CCMSLIB00017318186","spectrum_index":51646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 109.1162 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.196,"smiles":null,"spectrum_id":"CCMSLIB00017318187","spectrum_index":51647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 127.0634 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.186,"smiles":null,"spectrum_id":"CCMSLIB00017318188","spectrum_index":51648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 67.0786 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017318189","spectrum_index":51649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 139.0416 Da; putative annotation: N/A; putative formula: C4H6N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.107,"smiles":null,"spectrum_id":"CCMSLIB00017318190","spectrum_index":51650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to DL-Norepinephrine from NIST14 (delta mass: 268.0948 Da; putative annotation: N/A; putative formula: C13H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.176,"smiles":null,"spectrum_id":"CCMSLIB00017318191","spectrum_index":51651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 83.0372 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.103,"smiles":null,"spectrum_id":"CCMSLIB00017318192","spectrum_index":51652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-O-.beta.-Galactopyranosyl-D-mannopyranose (delta mass: 170.0765 Da; putative annotation: N/A; putative formula: C9H14OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.2,"smiles":null,"spectrum_id":"CCMSLIB00017318193","spectrum_index":51653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 693.4988 Da; putative annotation: N/A; putative formula: C44H63N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":879.57,"smiles":null,"spectrum_id":"CCMSLIB00017318194","spectrum_index":51654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 908.2423 Da; putative annotation: N/A; putative formula: C28H60N8O11S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1251.37,"smiles":null,"spectrum_id":"CCMSLIB00017318195","spectrum_index":51655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 221.2354 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.327,"smiles":null,"spectrum_id":"CCMSLIB00017318196","spectrum_index":51656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 69.0214 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.097,"smiles":null,"spectrum_id":"CCMSLIB00017318197","spectrum_index":51657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 66.0132 Da; putative annotation: N/A; putative formula: C4H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.105,"smiles":null,"spectrum_id":"CCMSLIB00017318198","spectrum_index":51658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 490.3141 Da; putative annotation: N/A; putative formula: C25H46O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":653.374,"smiles":null,"spectrum_id":"CCMSLIB00017318199","spectrum_index":51659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 189.1041 Da; putative annotation: N/A; putative formula: C7H16N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.18,"smiles":null,"spectrum_id":"CCMSLIB00017318200","spectrum_index":51660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 175.0571 Da; putative annotation: N/A; putative formula: C9H9N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.129,"smiles":null,"spectrum_id":"CCMSLIB00017318201","spectrum_index":51661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 93.9691 Da; putative annotation: N/A; putative formula: C4H-2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.06,"smiles":null,"spectrum_id":"CCMSLIB00017318202","spectrum_index":51662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 29.0494 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.146,"smiles":null,"spectrum_id":"CCMSLIB00017318203","spectrum_index":51663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 390.2731 Da; putative annotation: N/A; putative formula: C19H38N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.333,"smiles":null,"spectrum_id":"CCMSLIB00017318204","spectrum_index":51664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 119.0322 Da; putative annotation: N/A; putative formula: C4H10NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.14,"smiles":null,"spectrum_id":"CCMSLIB00017318205","spectrum_index":51665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 1194.4597 Da; putative annotation: N/A; putative formula: C78H63N6O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1416.56,"smiles":null,"spectrum_id":"CCMSLIB00017318206","spectrum_index":51666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 96.0939 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.222,"smiles":null,"spectrum_id":"CCMSLIB00017318207","spectrum_index":51667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 261.1573 Da; putative annotation: N/A; putative formula: C12H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.233,"smiles":null,"spectrum_id":"CCMSLIB00017318208","spectrum_index":51668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100022 Adenosine|9-beta-D-Ribofuranosyladenine|Adenine riboside|Sandesin|Boniton|Myocol|Nucleocardyl|Adenocard (delta mass: 84.0574 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.161,"smiles":null,"spectrum_id":"CCMSLIB00017318209","spectrum_index":51669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 100.0171 Da; putative annotation: N/A; putative formula: C5N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.077,"smiles":null,"spectrum_id":"CCMSLIB00017318210","spectrum_index":51670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 51.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.134,"smiles":null,"spectrum_id":"CCMSLIB00017318211","spectrum_index":51671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine (delta mass: 57.0579 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.234,"smiles":null,"spectrum_id":"CCMSLIB00017318212","spectrum_index":51672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 15.0103 Da; putative annotation: N/A; putative formula: HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.185,"smiles":null,"spectrum_id":"CCMSLIB00017318213","spectrum_index":51673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole-3-carbinol CollisionEnergy:205060 (delta mass: 179.0586 Da; putative annotation: N/A; putative formula: C9H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.134,"smiles":null,"spectrum_id":"CCMSLIB00017318214","spectrum_index":51674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 42.0683 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.133,"smiles":null,"spectrum_id":"CCMSLIB00017318215","spectrum_index":51675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 58.0939 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.165,"smiles":null,"spectrum_id":"CCMSLIB00017318216","spectrum_index":51676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 82.0418 Da; putative annotation: N/A; putative formula: C5H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.102,"smiles":null,"spectrum_id":"CCMSLIB00017318217","spectrum_index":51677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 285.2672 Da; putative annotation: N/A; putative formula: C17H35NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.338,"smiles":null,"spectrum_id":"CCMSLIB00017318218","spectrum_index":51678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 227.1019 Da; putative annotation: N/A; putative formula: C8H13N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.188,"smiles":null,"spectrum_id":"CCMSLIB00017318219","spectrum_index":51679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 160.0459 Da; putative annotation: N/A; putative formula: C9H5FN2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.211,"smiles":null,"spectrum_id":"CCMSLIB00017318220","spectrum_index":51680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Untitled CollisionEnergy:102040 (delta mass: 299.1856 Da; putative annotation: N/A; putative formula: C15H29N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.35,"smiles":null,"spectrum_id":"CCMSLIB00017318221","spectrum_index":51681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 102.079 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.233,"smiles":null,"spectrum_id":"CCMSLIB00017318222","spectrum_index":51682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile (delta mass: 28.0533 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.065,"smiles":null,"spectrum_id":"CCMSLIB00017318223","spectrum_index":51683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 12.0575 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017318224","spectrum_index":51684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(3-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]-, ethyl ester (delta mass: 80.0633 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.287,"smiles":null,"spectrum_id":"CCMSLIB00017318225","spectrum_index":51685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 113.0518 Da; putative annotation: N/A; putative formula: C4H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.133,"smiles":null,"spectrum_id":"CCMSLIB00017318226","spectrum_index":51686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 397.1389 Da; putative annotation: N/A; putative formula: C19H19N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.251,"smiles":null,"spectrum_id":"CCMSLIB00017318227","spectrum_index":51687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 152.1296 Da; putative annotation: N/A; putative formula: C9H16N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.221,"smiles":null,"spectrum_id":"CCMSLIB00017318228","spectrum_index":51688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Morphine N-oxide (delta mass: 25.048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.187,"smiles":null,"spectrum_id":"CCMSLIB00017318229","spectrum_index":51689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 96.0634 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.14,"smiles":null,"spectrum_id":"CCMSLIB00017318230","spectrum_index":51690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 185.0603 Da; putative annotation: N/A; putative formula: C8H12NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.142,"smiles":null,"spectrum_id":"CCMSLIB00017318231","spectrum_index":51691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 256.1367 Da; putative annotation: N/A; putative formula: C19H16N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.311,"smiles":null,"spectrum_id":"CCMSLIB00017318232","spectrum_index":51692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 178.062 Da; putative annotation: N/A; putative formula: C4H11N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.148,"smiles":null,"spectrum_id":"CCMSLIB00017318233","spectrum_index":51693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 148.0509 Da; putative annotation: Tropic acid; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.147,"smiles":null,"spectrum_id":"CCMSLIB00017318234","spectrum_index":51694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 113.0832 Da; putative annotation: 4-Amino-4-methylpentanoic acid; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.159,"smiles":null,"spectrum_id":"CCMSLIB00017318235","spectrum_index":51695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 139.1366 Da; putative annotation: 2-Amino-3-cyclohexylpropan-1-ol; putative formula: C9H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.264,"smiles":null,"spectrum_id":"CCMSLIB00017318236","spectrum_index":51696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 97.052 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.117,"smiles":null,"spectrum_id":"CCMSLIB00017318237","spectrum_index":51697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 246.1184 Da; putative annotation: 6,8-Dihydroxy-8a-methyl-3,5-dimethylidenedecahydronaphtho[2,3-b]furan-2(3H)-one; putative formula: C15H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.272,"smiles":null,"spectrum_id":"CCMSLIB00017318238","spectrum_index":51698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 102.047 Da; putative annotation: 4-Vinylphenol; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.18,"smiles":null,"spectrum_id":"CCMSLIB00017318239","spectrum_index":51699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 250.1564 Da; putative annotation: 2-(9-Decenyl)glutaconic acid; putative formula: C15H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.243,"smiles":null,"spectrum_id":"CCMSLIB00017318240","spectrum_index":51700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 132.0942 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.321,"smiles":null,"spectrum_id":"CCMSLIB00017318241","spectrum_index":51701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 179.0945 Da; putative annotation: Tenuazonic acid; putative formula: C10H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.165,"smiles":null,"spectrum_id":"CCMSLIB00017318242","spectrum_index":51702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 169.1102 Da; putative annotation: 7-Keto-8-aminopelargonic acid; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.181,"smiles":null,"spectrum_id":"CCMSLIB00017318243","spectrum_index":51703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 188.0842 Da; putative annotation: 4-(2,5-Dimethylphenyl)-4-oxobutanoic acid; putative formula: C12H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.155,"smiles":null,"spectrum_id":"CCMSLIB00017318244","spectrum_index":51704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 1044.547 Da; putative annotation: NCGC00386040-01_C52H86O22_alpha-L-Arabinopyranoside, (3beta,5xi,9xi,16alpha)-13,28-epoxy-16,23-dihydroxyoleanan-3-yl O-beta-D-glucopyranosyl-(1->2)-O-[O-beta-D-xylopyranosyl-(1->2)-beta-D-glucopyranosyl-(1->4)]-; putative formula: C52H84O21)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1207.61,"smiles":null,"spectrum_id":"CCMSLIB00017318245","spectrum_index":51705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 134.0732 Da; putative annotation: 4-Hydroxynonenal alkyne; putative formula: C9H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.133,"smiles":null,"spectrum_id":"CCMSLIB00017318246","spectrum_index":51706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 236.1781 Da; putative annotation: 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol; putative formula: C15H24O2)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.243,"smiles":null,"spectrum_id":"CCMSLIB00017318247","spectrum_index":51707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 129.0979 Da; putative annotation: N/A; putative formula: C7H15NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.268,"smiles":null,"spectrum_id":"CCMSLIB00017318248","spectrum_index":51708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 136.055 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.184,"smiles":null,"spectrum_id":"CCMSLIB00017318249","spectrum_index":51709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 82.085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.2,"smiles":null,"spectrum_id":"CCMSLIB00017318250","spectrum_index":51710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Aminopropyl(2-phenylethyl)phosphinic acid (delta mass: 119.1079 Da; putative annotation: N/A; putative formula: C9H13NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.223,"smiles":null,"spectrum_id":"CCMSLIB00017318251","spectrum_index":51711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 723.419 Da; putative annotation: N/A; putative formula: C51H53N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.479,"smiles":null,"spectrum_id":"CCMSLIB00017318252","spectrum_index":51712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 725.435 Da; putative annotation: N/A; putative formula: C38H63NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":888.495,"smiles":null,"spectrum_id":"CCMSLIB00017318253","spectrum_index":51713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 132.0938 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.169,"smiles":null,"spectrum_id":"CCMSLIB00017318254","spectrum_index":51714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 227.1157 Da; putative annotation: N/A; putative formula: C11H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.218,"smiles":null,"spectrum_id":"CCMSLIB00017318255","spectrum_index":51715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 104.0266 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.123,"smiles":null,"spectrum_id":"CCMSLIB00017318256","spectrum_index":51716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 94.0271 Da; putative annotation: N/A; putative formula: C3H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.181,"smiles":null,"spectrum_id":"CCMSLIB00017318257","spectrum_index":51717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 87.0318 Da; putative annotation: N/A; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.081,"smiles":null,"spectrum_id":"CCMSLIB00017318258","spectrum_index":51718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 20.0169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.099,"smiles":null,"spectrum_id":"CCMSLIB00017318259","spectrum_index":51719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 377.1486 Da; putative annotation: N/A; putative formula: C20H19N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.219,"smiles":null,"spectrum_id":"CCMSLIB00017318260","spectrum_index":51720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-butyric acid (delta mass: 181.1195 Da; putative annotation: N/A; putative formula: C5H11N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.221,"smiles":null,"spectrum_id":"CCMSLIB00017318261","spectrum_index":51721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 97.0524 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.155,"smiles":null,"spectrum_id":"CCMSLIB00017318262","spectrum_index":51722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide IV (delta mass: 147.0459 Da; putative annotation: N/A; putative formula: C4H9N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.154,"smiles":null,"spectrum_id":"CCMSLIB00017318263","spectrum_index":51723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 270.1205 Da; putative annotation: N/A; putative formula: C9H10N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.201,"smiles":null,"spectrum_id":"CCMSLIB00017318264","spectrum_index":51724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 53.0728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.206,"smiles":null,"spectrum_id":"CCMSLIB00017318265","spectrum_index":51725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 148.0394 Da; putative annotation: N/A; putative formula: C6H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.115,"smiles":null,"spectrum_id":"CCMSLIB00017318266","spectrum_index":51726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 52.0098 Da; putative annotation: N/A; putative formula: C2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.112,"smiles":null,"spectrum_id":"CCMSLIB00017318267","spectrum_index":51727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 319.2348 Da; putative annotation: N/A; putative formula: C13H25N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.3,"smiles":null,"spectrum_id":"CCMSLIB00017318268","spectrum_index":51728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 220.1154 Da; putative annotation: N/A; putative formula: C11H16N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.165,"smiles":null,"spectrum_id":"CCMSLIB00017318269","spectrum_index":51729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1,N1-dimethyl-N2-phenyl-1,2-ethanediamine (delta mass: 145.0384 Da; putative annotation: N/A; putative formula: C6H11NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.177,"smiles":null,"spectrum_id":"CCMSLIB00017318270","spectrum_index":51730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 208.121 Da; putative annotation: N/A; putative formula: C11H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.213,"smiles":null,"spectrum_id":"CCMSLIB00017318271","spectrum_index":51731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 119.0578 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.134,"smiles":null,"spectrum_id":"CCMSLIB00017318272","spectrum_index":51732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 61.0425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.082,"smiles":null,"spectrum_id":"CCMSLIB00017318273","spectrum_index":51733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxytyramine (delta mass: 126.0481 Da; putative annotation: N/A; putative formula: C10H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.15,"smiles":null,"spectrum_id":"CCMSLIB00017318274","spectrum_index":51734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 142.0927 Da; putative annotation: N/A; putative formula: C7H14N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.198,"smiles":null,"spectrum_id":"CCMSLIB00017318275","spectrum_index":51735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 208.0742 Da; putative annotation: N/A; putative formula: C12H16O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.239,"smiles":null,"spectrum_id":"CCMSLIB00017318276","spectrum_index":51736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 417.201 Da; putative annotation: N/A; putative formula: C30H28NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.277,"smiles":null,"spectrum_id":"CCMSLIB00017318277","spectrum_index":51737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-3-carbaldehyde (delta mass: 456.2416 Da; putative annotation: N/A; putative formula: C29H32N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.292,"smiles":null,"spectrum_id":"CCMSLIB00017318278","spectrum_index":51738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 78.0313 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.097,"smiles":null,"spectrum_id":"CCMSLIB00017318279","spectrum_index":51739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 341.1944 Da; putative annotation: N/A; putative formula: C18H32NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.323,"smiles":null,"spectrum_id":"CCMSLIB00017318280","spectrum_index":51740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 85.135 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.232,"smiles":null,"spectrum_id":"CCMSLIB00017318281","spectrum_index":51741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piperolactam B (delta mass: 16.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.165,"smiles":null,"spectrum_id":"CCMSLIB00017318282","spectrum_index":51742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 304.1826 Da; putative annotation: N/A; putative formula: C22H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.28,"smiles":null,"spectrum_id":"CCMSLIB00017318283","spectrum_index":51743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 230.1617 Da; putative annotation: N/A; putative formula: C13H27O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.321,"smiles":null,"spectrum_id":"CCMSLIB00017318284","spectrum_index":51744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 58.0416 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.117,"smiles":null,"spectrum_id":"CCMSLIB00017318285","spectrum_index":51745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385014-01!(E)-1,7-bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 90.1382 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.287,"smiles":null,"spectrum_id":"CCMSLIB00017318286","spectrum_index":51746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSAMINE (delta mass: 372.128 Da; putative annotation: N/A; putative formula: C24H21O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.215,"smiles":null,"spectrum_id":"CCMSLIB00017318287","spectrum_index":51747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 309.2139 Da; putative annotation: N/A; putative formula: C18H33NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.379,"smiles":null,"spectrum_id":"CCMSLIB00017318288","spectrum_index":51748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 346.1378 Da; putative annotation: N/A; putative formula: C14H22N2O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.235,"smiles":null,"spectrum_id":"CCMSLIB00017318289","spectrum_index":51749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 257.2376 Da; putative annotation: N/A; putative formula: C14H32N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.329,"smiles":null,"spectrum_id":"CCMSLIB00017318290","spectrum_index":51750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 150.0321 Da; putative annotation: N/A; putative formula: C8H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.124,"smiles":null,"spectrum_id":"CCMSLIB00017318291","spectrum_index":51751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 116.0479 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.093,"smiles":null,"spectrum_id":"CCMSLIB00017318292","spectrum_index":51752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 78.0689 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.129,"smiles":null,"spectrum_id":"CCMSLIB00017318293","spectrum_index":51753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 13.9448 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.12,"smiles":null,"spectrum_id":"CCMSLIB00017318294","spectrum_index":51754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroalstonine (delta mass: 110.1379 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.324,"smiles":null,"spectrum_id":"CCMSLIB00017318295","spectrum_index":51755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cimaterol (delta mass: 73.9917 Da; putative annotation: N/A; putative formula: C2H3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.136,"smiles":null,"spectrum_id":"CCMSLIB00017318296","spectrum_index":51756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 279.0622 Da; putative annotation: N/A; putative formula: C8H14N3O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.175,"smiles":null,"spectrum_id":"CCMSLIB00017318297","spectrum_index":51757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 293.2359 Da; putative annotation: N/A; putative formula: C18H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.323,"smiles":null,"spectrum_id":"CCMSLIB00017318298","spectrum_index":51758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ST069303 CollisionEnergy:205060 (delta mass: 53.0574 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.222,"smiles":null,"spectrum_id":"CCMSLIB00017318299","spectrum_index":51759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 42.0559 Da; putative annotation: N/A; putative formula: C2H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.158,"smiles":null,"spectrum_id":"CCMSLIB00017318300","spectrum_index":51760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 24.99 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.113,"smiles":null,"spectrum_id":"CCMSLIB00017318301","spectrum_index":51761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Carboline-1-propionic acid (delta mass: 144.0501 Da; putative annotation: N/A; putative formula: CH4N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.147,"smiles":null,"spectrum_id":"CCMSLIB00017318302","spectrum_index":51762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 117.0779 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.18,"smiles":null,"spectrum_id":"CCMSLIB00017318303","spectrum_index":51763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 30.9165 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.997,"smiles":null,"spectrum_id":"CCMSLIB00017318304","spectrum_index":51764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 536.3331 Da; putative annotation: N/A; putative formula: C27H40N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.492,"smiles":null,"spectrum_id":"CCMSLIB00017318305","spectrum_index":51765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 70.145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.247,"smiles":null,"spectrum_id":"CCMSLIB00017318306","spectrum_index":51766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110101 Terbutaline|5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol (delta mass: 47.001 Da; putative annotation: N/A; putative formula: HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.145,"smiles":null,"spectrum_id":"CCMSLIB00017318307","spectrum_index":51767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 96.2008 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.298,"smiles":null,"spectrum_id":"CCMSLIB00017318308","spectrum_index":51768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 241.2769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.374,"smiles":null,"spectrum_id":"CCMSLIB00017318309","spectrum_index":51769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 161.068 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.144,"smiles":null,"spectrum_id":"CCMSLIB00017318310","spectrum_index":51770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 69.0211 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017318311","spectrum_index":51771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 253.131 Da; putative annotation: N/A; putative formula: C13H19NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.269,"smiles":null,"spectrum_id":"CCMSLIB00017318312","spectrum_index":51772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 358.1236 Da; putative annotation: N/A; putative formula: C22H19N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.209,"smiles":null,"spectrum_id":"CCMSLIB00017318313","spectrum_index":51773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 280.1313 Da; putative annotation: N/A; putative formula: C15H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.233,"smiles":null,"spectrum_id":"CCMSLIB00017318314","spectrum_index":51774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 155.0517 Da; putative annotation: N/A; putative formula: C6H9N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.133,"smiles":null,"spectrum_id":"CCMSLIB00017318315","spectrum_index":51775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 189.0126 Da; putative annotation: N/A; putative formula: C5H8N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.094,"smiles":null,"spectrum_id":"CCMSLIB00017318316","spectrum_index":51776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (delta mass: 76.0388 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.128,"smiles":null,"spectrum_id":"CCMSLIB00017318317","spectrum_index":51777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 50.0313 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017318318","spectrum_index":51778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 250.0473 Da; putative annotation: N/A; putative formula: C12H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.107,"smiles":null,"spectrum_id":"CCMSLIB00017318319","spectrum_index":51779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzyl homoveratrylamine (delta mass: 3.3355 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.5,"smiles":null,"spectrum_id":"CCMSLIB00017318320","spectrum_index":51780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 190.1717 Da; putative annotation: N/A; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.237,"smiles":null,"spectrum_id":"CCMSLIB00017318321","spectrum_index":51781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Galactose (delta mass: 37.9569 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.028,"smiles":null,"spectrum_id":"CCMSLIB00017318322","spectrum_index":51782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 459.4608 Da; putative annotation: N/A; putative formula: C30H57N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":767.61,"smiles":null,"spectrum_id":"CCMSLIB00017318323","spectrum_index":51783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-methoxyphenyl)-2-[(methylethyl)amino]ethan-1-ol CollisionEnergy:102040 (delta mass: 60.0692 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.218,"smiles":null,"spectrum_id":"CCMSLIB00017318324","spectrum_index":51784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 106.0265 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.196,"smiles":null,"spectrum_id":"CCMSLIB00017318325","spectrum_index":51785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP022902 D-Sorbitol|Sorbo|(3S,4S,5R)-hexane-1,2,3,4,5,6-hexol (delta mass: 57.0213 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.108,"smiles":null,"spectrum_id":"CCMSLIB00017318326","spectrum_index":51786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 390.1309 Da; putative annotation: N/A; putative formula: C14H23N4O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.243,"smiles":null,"spectrum_id":"CCMSLIB00017318327","spectrum_index":51787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 281.3081 Da; putative annotation: N/A; putative formula: C19H39N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.368,"smiles":null,"spectrum_id":"CCMSLIB00017318328","spectrum_index":51788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide III (delta mass: 46.0155 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.181,"smiles":null,"spectrum_id":"CCMSLIB00017318329","spectrum_index":51789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 95.0393 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.099,"smiles":null,"spectrum_id":"CCMSLIB00017318330","spectrum_index":51790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 103.019 Da; putative annotation: N/A; putative formula: C3H6NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.079,"smiles":null,"spectrum_id":"CCMSLIB00017318331","spectrum_index":51791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olodaterol (delta mass: 264.162 Da; putative annotation: N/A; putative formula: C10H24N4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.353,"smiles":null,"spectrum_id":"CCMSLIB00017318332","spectrum_index":51792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 195.2387 Da; putative annotation: N/A; putative formula: C14H29NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.398,"smiles":null,"spectrum_id":"CCMSLIB00017318333","spectrum_index":51793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 162.0526 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.203,"smiles":null,"spectrum_id":"CCMSLIB00017318334","spectrum_index":51794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 318.8134 Da; putative annotation: N/A; putative formula: C3H3N3O-1P2S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.9,"smiles":null,"spectrum_id":"CCMSLIB00017318335","spectrum_index":51795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 167.0732 Da; putative annotation: N/A; putative formula: C12H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.181,"smiles":null,"spectrum_id":"CCMSLIB00017318336","spectrum_index":51796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 1045.8011 Da; putative annotation: N/A; putative formula: C72H99N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1550.98,"smiles":null,"spectrum_id":"CCMSLIB00017318337","spectrum_index":51797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 1035.2636 Da; putative annotation: N/A; putative formula: C40H60N7O13P3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1540.44,"smiles":null,"spectrum_id":"CCMSLIB00017318338","spectrum_index":51798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 178.0995 Da; putative annotation: N/A; putative formula: C11H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.212,"smiles":null,"spectrum_id":"CCMSLIB00017318339","spectrum_index":51799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benz[a]anthracen-1-ol, 8-methoxy-3-methyl- (delta mass: 76.0371 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.159,"smiles":null,"spectrum_id":"CCMSLIB00017318340","spectrum_index":51800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 300.0879 Da; putative annotation: N/A; putative formula: C10H20O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.2,"smiles":null,"spectrum_id":"CCMSLIB00017318341","spectrum_index":51801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 117.043 Da; putative annotation: N/A; putative formula: C4H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.103,"smiles":null,"spectrum_id":"CCMSLIB00017318342","spectrum_index":51802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 104.0491 Da; putative annotation: N/A; putative formula: C5H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.203,"smiles":null,"spectrum_id":"CCMSLIB00017318343","spectrum_index":51803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Heptanone, 7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)- (delta mass: 66.036 Da; putative annotation: N/A; putative formula: C2H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.19,"smiles":null,"spectrum_id":"CCMSLIB00017318344","spectrum_index":51804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 78.0323 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.207,"smiles":null,"spectrum_id":"CCMSLIB00017318345","spectrum_index":51805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 170.1505 Da; putative annotation: N/A; putative formula: C11H22O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.216,"smiles":null,"spectrum_id":"CCMSLIB00017318346","spectrum_index":51806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 612.3299 Da; putative annotation: N/A; putative formula: C35H48O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":925.473,"smiles":null,"spectrum_id":"CCMSLIB00017318347","spectrum_index":51807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 296.2351 Da; putative annotation: N/A; putative formula: C18H32O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.3,"smiles":null,"spectrum_id":"CCMSLIB00017318348","spectrum_index":51808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 53.0269 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.113,"smiles":null,"spectrum_id":"CCMSLIB00017318349","spectrum_index":51809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 86.0519 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.175,"smiles":null,"spectrum_id":"CCMSLIB00017318350","spectrum_index":51810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 67.0909 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.229,"smiles":null,"spectrum_id":"CCMSLIB00017318351","spectrum_index":51811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 467.2829 Da; putative annotation: N/A; putative formula: C25H37N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.348,"smiles":null,"spectrum_id":"CCMSLIB00017318352","spectrum_index":51812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoli ne CollisionEnergy:102040\"\" (delta mass: 18.1198 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.29,"smiles":null,"spectrum_id":"CCMSLIB00017318353","spectrum_index":51813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 344.3214 Da; putative annotation: N/A; putative formula: C23H40N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.419,"smiles":null,"spectrum_id":"CCMSLIB00017318354","spectrum_index":51814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 342.2503 Da; putative annotation: N/A; putative formula: C22H34N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.285,"smiles":null,"spectrum_id":"CCMSLIB00017318355","spectrum_index":51815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 283.0502 Da; putative annotation: N/A; putative formula: C8H11N7OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.174,"smiles":null,"spectrum_id":"CCMSLIB00017318356","spectrum_index":51816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-carboxypropanoylamino)-3-indol-3-ylpropanoic acid CollisionEnergy:102040 (delta mass: 321.1341 Da; putative annotation: N/A; putative formula: C13H24NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.247,"smiles":null,"spectrum_id":"CCMSLIB00017318357","spectrum_index":51817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 243.1098 Da; putative annotation: N/A; putative formula: C8H9N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.175,"smiles":null,"spectrum_id":"CCMSLIB00017318358","spectrum_index":51818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 352.212 Da; putative annotation: N/A; putative formula: C18H32N4O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.283,"smiles":null,"spectrum_id":"CCMSLIB00017318359","spectrum_index":51819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5H-Dibenzo[a,d]cyclohepten-5,10-imine, 10,11-dihydro-5-methyl-, (5S,10R)- (delta mass: 99.064 Da; putative annotation: N/A; putative formula: CH5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.192,"smiles":null,"spectrum_id":"CCMSLIB00017318360","spectrum_index":51820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 122.0417 Da; putative annotation: N/A; putative formula: C6H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.129,"smiles":null,"spectrum_id":"CCMSLIB00017318361","spectrum_index":51821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylulose (delta mass: 86.0525 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.113,"smiles":null,"spectrum_id":"CCMSLIB00017318362","spectrum_index":51822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-5H-dibenz(b,f)azepine (delta mass: 210.1406 Da; putative annotation: N/A; putative formula: C16H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.253,"smiles":null,"spectrum_id":"CCMSLIB00017318363","spectrum_index":51823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(1H)-Quinolinone, 3,4-dihydro-4-hydroxy-3-methoxy-4-(4-methoxyphenyl)- (delta mass: 23.9997 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.123,"smiles":null,"spectrum_id":"CCMSLIB00017318364","spectrum_index":51824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 63.07 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.219,"smiles":null,"spectrum_id":"CCMSLIB00017318365","spectrum_index":51825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 126.092 Da; putative annotation: N/A; putative formula: C5H10N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.251,"smiles":null,"spectrum_id":"CCMSLIB00017318366","spectrum_index":51826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4R,5R,6S)-2-[[(2R,3S,4S,5R,6R)-6-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol (delta mass: 57.8854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.176,"smiles":null,"spectrum_id":"CCMSLIB00017318367","spectrum_index":51827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (delta mass: 256.1085 Da; putative annotation: N/A; putative formula: C10H17N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.146,"smiles":null,"spectrum_id":"CCMSLIB00017318368","spectrum_index":51828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Etilefrine|3-[2-(ethylamino)-1-hydroxyethyl]phenol (delta mass: 98.0253 Da; putative annotation: N/A; putative formula: C7H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.143,"smiles":null,"spectrum_id":"CCMSLIB00017318369","spectrum_index":51829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 179.1505 Da; putative annotation: N/A; putative formula: C9H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.263,"smiles":null,"spectrum_id":"CCMSLIB00017318370","spectrum_index":51830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 35.0454 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.142,"smiles":null,"spectrum_id":"CCMSLIB00017318371","spectrum_index":51831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 17.0849 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.196,"smiles":null,"spectrum_id":"CCMSLIB00017318372","spectrum_index":51832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Man3 a (delta mass: 15.5092 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.844,"smiles":null,"spectrum_id":"CCMSLIB00017318373","spectrum_index":51833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 11.9997 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.122,"smiles":null,"spectrum_id":"CCMSLIB00017318374","spectrum_index":51834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 190.1713 Da; putative annotation: N/A; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.283,"smiles":null,"spectrum_id":"CCMSLIB00017318375","spectrum_index":51835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 84.021 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.092,"smiles":null,"spectrum_id":"CCMSLIB00017318376","spectrum_index":51836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 148.0524 Da; putative annotation: N/A; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.15,"smiles":null,"spectrum_id":"CCMSLIB00017318377","spectrum_index":51837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 130.035 Da; putative annotation: N/A; putative formula: H2N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.067,"smiles":null,"spectrum_id":"CCMSLIB00017318378","spectrum_index":51838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 52.056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017318379","spectrum_index":51839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 324.0851 Da; putative annotation: N/A; putative formula: C8H16N6O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.171,"smiles":null,"spectrum_id":"CCMSLIB00017318380","spectrum_index":51840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 298.1934 Da; putative annotation: N/A; putative formula: C20H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.274,"smiles":null,"spectrum_id":"CCMSLIB00017318381","spectrum_index":51841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS001049055-01!1-methylindole-3-carboxamide (delta mass: 13.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.113,"smiles":null,"spectrum_id":"CCMSLIB00017318382","spectrum_index":51842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"bis[(3,5-dimethoxyphenyl)methyl]amine CollisionEnergy:205060\"\" (delta mass: 49.0389 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.209,"smiles":null,"spectrum_id":"CCMSLIB00017318383","spectrum_index":51843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R)-4-Methyl-6-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one (delta mass: 97.9849 Da; putative annotation: N/A; putative formula: C4H4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.178,"smiles":null,"spectrum_id":"CCMSLIB00017318384","spectrum_index":51844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Penicillin G (delta mass: 81.0495 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.155,"smiles":null,"spectrum_id":"CCMSLIB00017318385","spectrum_index":51845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 99.0665 Da; putative annotation: 4-Amino-2-methylbutanoic acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.19,"smiles":null,"spectrum_id":"CCMSLIB00017318386","spectrum_index":51846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1,N1-dimethyl-N2-phenyl-1,2-ethanediamine (delta mass: 199.1205 Da; putative annotation: N-.alpha.-(tert-Butoxycarbonyl)-L-valine; putative formula: C10H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.259,"smiles":null,"spectrum_id":"CCMSLIB00017318387","spectrum_index":51847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 84.1048 Da; putative annotation: N-Methylbutane-1,4-diamine; putative formula: C5H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.17,"smiles":null,"spectrum_id":"CCMSLIB00017318388","spectrum_index":51848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 190.1719 Da; putative annotation: 1-Ethynylcyclododecanol; putative formula: C14H22)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.258,"smiles":null,"spectrum_id":"CCMSLIB00017318389","spectrum_index":51849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 101.0466 Da; putative annotation: L-Threonine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.107,"smiles":null,"spectrum_id":"CCMSLIB00017318390","spectrum_index":51850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 108.0204 Da; putative annotation: Maltol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.091,"smiles":null,"spectrum_id":"CCMSLIB00017318391","spectrum_index":51851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 338.2811 Da; putative annotation: Monoelaidin; putative formula: C21H38O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.352,"smiles":null,"spectrum_id":"CCMSLIB00017318392","spectrum_index":51852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 204.1515 Da; putative annotation: 5-Hydroxy-10,10-dimethyl-6-methylenebicyclo[7.2.0]undecan-2-one; putative formula: C14H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.206,"smiles":null,"spectrum_id":"CCMSLIB00017318393","spectrum_index":51853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 252.1001 Da; putative annotation: Phenylmethyl-glucopyranoside; putative formula: C13H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.176,"smiles":null,"spectrum_id":"CCMSLIB00017318394","spectrum_index":51854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 119.0368 Da; putative annotation: 2-Aminobenzoic acid; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.086,"smiles":null,"spectrum_id":"CCMSLIB00017318395","spectrum_index":51855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 127.0998 Da; putative annotation: 2-(Aminomethyl)-4-methylpentanoic acid; putative formula: C7H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.16,"smiles":null,"spectrum_id":"CCMSLIB00017318396","spectrum_index":51856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine - 30.0 eV (delta mass: 99.0685 Da; putative annotation: 4-Amino-2-methylbutanoic acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.244,"smiles":null,"spectrum_id":"CCMSLIB00017318397","spectrum_index":51857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 720.405 Da; putative annotation: N/A; putative formula: C36H67O8P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.465,"smiles":null,"spectrum_id":"CCMSLIB00017318398","spectrum_index":51858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 122.0362 Da; putative annotation: N/A; putative formula: C7H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.096,"smiles":null,"spectrum_id":"CCMSLIB00017318399","spectrum_index":51859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169598-02!1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 16.0397 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.204,"smiles":null,"spectrum_id":"CCMSLIB00017318400","spectrum_index":51860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 15.9804 Da; putative annotation: N/A; putative formula: O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.029,"smiles":null,"spectrum_id":"CCMSLIB00017318401","spectrum_index":51861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 92.0254 Da; putative annotation: N/A; putative formula: H5N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.127,"smiles":null,"spectrum_id":"CCMSLIB00017318402","spectrum_index":51862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-4-phenyl-1,3-dihydroquinolin-2-one (delta mass: 51.0165 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.113,"smiles":null,"spectrum_id":"CCMSLIB00017318403","spectrum_index":51863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 24.0586 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.07,"smiles":null,"spectrum_id":"CCMSLIB00017318404","spectrum_index":51864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 231.1459 Da; putative annotation: N/A; putative formula: C11H21NO4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.233,"smiles":null,"spectrum_id":"CCMSLIB00017318405","spectrum_index":51865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 250.0631 Da; putative annotation: N/A; putative formula: C16H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.134,"smiles":null,"spectrum_id":"CCMSLIB00017318406","spectrum_index":51866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 564.2568 Da; putative annotation: N/A; putative formula: C42H32N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":728.349,"smiles":null,"spectrum_id":"CCMSLIB00017318407","spectrum_index":51867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Amlexanox (delta mass: 2.0016 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.104,"smiles":null,"spectrum_id":"CCMSLIB00017318408","spectrum_index":51868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 324.2296 Da; putative annotation: N/A; putative formula: C19H32O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.326,"smiles":null,"spectrum_id":"CCMSLIB00017318409","spectrum_index":51869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spermine (delta mass: 190.0633 Da; putative annotation: N/A; putative formula: C11H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.286,"smiles":null,"spectrum_id":"CCMSLIB00017318410","spectrum_index":51870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmaline (delta mass: 165.0753 Da; putative annotation: N/A; putative formula: C4H11N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.193,"smiles":null,"spectrum_id":"CCMSLIB00017318411","spectrum_index":51871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 689.2756 Da; putative annotation: N/A; putative formula: C49H39NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":852.336,"smiles":null,"spectrum_id":"CCMSLIB00017318412","spectrum_index":51872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 87.0583 Da; putative annotation: N/A; putative formula: C4H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.134,"smiles":null,"spectrum_id":"CCMSLIB00017318413","spectrum_index":51873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 19.9055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.986,"smiles":null,"spectrum_id":"CCMSLIB00017318414","spectrum_index":51874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 111.0111 Da; putative annotation: N/A; putative formula: C8HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.129,"smiles":null,"spectrum_id":"CCMSLIB00017318415","spectrum_index":51875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[4-[Acetyl(hydroxy)amino]butylcarbamoyl]-5-[3-[acetyl(hydroxy)amino]propylamino]-3-hydroxy-5-oxopentanoic acid (delta mass: 2.0334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.242,"smiles":null,"spectrum_id":"CCMSLIB00017318416","spectrum_index":51876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 277.9755 Da; putative annotation: N/A; putative formula: C10H6N4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.062,"smiles":null,"spectrum_id":"CCMSLIB00017318417","spectrum_index":51877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Arabinose (delta mass: 49.0313 Da; putative annotation: N/A; putative formula: C4H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.091,"smiles":null,"spectrum_id":"CCMSLIB00017318418","spectrum_index":51878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169064-02!N-[2-(4-hydroxyphenyl)ethyl]acetamide (delta mass: 201.0433 Da; putative annotation: N/A; putative formula: C9H6F3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.145,"smiles":null,"spectrum_id":"CCMSLIB00017318419","spectrum_index":51879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 86.0004 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.082,"smiles":null,"spectrum_id":"CCMSLIB00017318420","spectrum_index":51880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 12-Chloro-6b-hydroxy-3,14b,14c-trimethyl-5-oxo-2,3,4,5,6b,7,8,8a,9,14,14b,14c,15,16-tetradecahydro-4,16a-epoxy[1]benzoxocino[7',8':6,7]indeno[1,2-b]indol-3-yl 2-hydroxy-2-methylpropanoate (delta mass: 62.0292 Da; putative annotation: N/A; putative formula: C4H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.255,"smiles":null,"spectrum_id":"CCMSLIB00017318421","spectrum_index":51881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 44.0104 Da; putative annotation: N/A; putative formula: C2H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.159,"smiles":null,"spectrum_id":"CCMSLIB00017318422","spectrum_index":51882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoroindole-2-carboxylic acid (delta mass: 224.2545 Da; putative annotation: N/A; putative formula: C16H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.3,"smiles":null,"spectrum_id":"CCMSLIB00017318423","spectrum_index":51883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 82.0271 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.171,"smiles":null,"spectrum_id":"CCMSLIB00017318424","spectrum_index":51884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10,11-Dihydro-10,11-dihydroxycarbamazepine (delta mass: 112.0836 Da; putative annotation: N/A; putative formula: C3H8N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.191,"smiles":null,"spectrum_id":"CCMSLIB00017318425","spectrum_index":51885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-HYDROXYINDOLE (delta mass: 59.0729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.133,"smiles":null,"spectrum_id":"CCMSLIB00017318426","spectrum_index":51886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norisoboldine (delta mass: 166.1209 Da; putative annotation: N/A; putative formula: C8H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.26,"smiles":null,"spectrum_id":"CCMSLIB00017318427","spectrum_index":51887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 267.9885 Da; putative annotation: N/A; putative formula: C7H8O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.074,"smiles":null,"spectrum_id":"CCMSLIB00017318428","spectrum_index":51888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 939.6334 Da; putative annotation: N/A; putative formula: C57H85N3O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1282.76,"smiles":null,"spectrum_id":"CCMSLIB00017318429","spectrum_index":51889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 102.0858 Da; putative annotation: N/A; putative formula: C9H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.339,"smiles":null,"spectrum_id":"CCMSLIB00017318430","spectrum_index":51890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 255.1773 Da; putative annotation: N/A; putative formula: C13H25N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.253,"smiles":null,"spectrum_id":"CCMSLIB00017318431","spectrum_index":51891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 32.026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017318432","spectrum_index":51892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 498.0945 Da; putative annotation: N/A; putative formula: C20H22N2O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.155,"smiles":null,"spectrum_id":"CCMSLIB00017318433","spectrum_index":51893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 29.0273 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.192,"smiles":null,"spectrum_id":"CCMSLIB00017318434","spectrum_index":51894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 630.1949 Da; putative annotation: N/A; putative formula: C31H34O14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":842.287,"smiles":null,"spectrum_id":"CCMSLIB00017318435","spectrum_index":51895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 76.0765 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.2,"smiles":null,"spectrum_id":"CCMSLIB00017318436","spectrum_index":51896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 50.0 eV (delta mass: 133.9996 Da; putative annotation: N/A; putative formula: CH3N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.075,"smiles":null,"spectrum_id":"CCMSLIB00017318437","spectrum_index":51897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nonen-1-ol, (Z)- (delta mass: 40.0315 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.174,"smiles":null,"spectrum_id":"CCMSLIB00017318438","spectrum_index":51898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 176.198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.284,"smiles":null,"spectrum_id":"CCMSLIB00017318439","spectrum_index":51899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Levallorphan (delta mass: 128.0532 Da; putative annotation: N/A; putative formula: C4H8N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.254,"smiles":null,"spectrum_id":"CCMSLIB00017318440","spectrum_index":51900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.175,"smiles":null,"spectrum_id":"CCMSLIB00017318441","spectrum_index":51901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aristolactam (delta mass: 17.1055 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.182,"smiles":null,"spectrum_id":"CCMSLIB00017318442","spectrum_index":51902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 116.0621 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017318443","spectrum_index":51903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 182.1308 Da; putative annotation: N/A; putative formula: C11H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.228,"smiles":null,"spectrum_id":"CCMSLIB00017318444","spectrum_index":51904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Chloro-1-decanol (delta mass: 34.0289 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.164,"smiles":null,"spectrum_id":"CCMSLIB00017318445","spectrum_index":51905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 144.1397 Da; putative annotation: N/A; putative formula: C6H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.247,"smiles":null,"spectrum_id":"CCMSLIB00017318446","spectrum_index":51906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Bromo-6-chloro-1H-indole-2-carboxylic acid (delta mass: 17.0178 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.944,"smiles":null,"spectrum_id":"CCMSLIB00017318447","spectrum_index":51907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 168.1495 Da; putative annotation: N/A; putative formula: C7H16N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.329,"smiles":null,"spectrum_id":"CCMSLIB00017318448","spectrum_index":51908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 323.1368 Da; putative annotation: N/A; putative formula: C16H21NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.307,"smiles":null,"spectrum_id":"CCMSLIB00017318449","spectrum_index":51909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 264.1147 Da; putative annotation: N/A; putative formula: C10H20N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.249,"smiles":null,"spectrum_id":"CCMSLIB00017318450","spectrum_index":51910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 129.9601 Da; putative annotation: N/A; putative formula: H-1N6O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.04,"smiles":null,"spectrum_id":"CCMSLIB00017318451","spectrum_index":51911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 193.0532 Da; putative annotation: N/A; putative formula: C6H7N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.144,"smiles":null,"spectrum_id":"CCMSLIB00017318452","spectrum_index":51912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 614.3167 Da; putative annotation: N/A; putative formula: C28H46N4O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.381,"smiles":null,"spectrum_id":"CCMSLIB00017318453","spectrum_index":51913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 117.0793 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.177,"smiles":null,"spectrum_id":"CCMSLIB00017318454","spectrum_index":51914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 72.0827 Da; putative annotation: N/A; putative formula: C2H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.184,"smiles":null,"spectrum_id":"CCMSLIB00017318455","spectrum_index":51915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 214.0888 Da; putative annotation: N/A; putative formula: C8H14N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.17,"smiles":null,"spectrum_id":"CCMSLIB00017318456","spectrum_index":51916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 112.0653 Da; putative annotation: N/A; putative formula: C5H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.24,"smiles":null,"spectrum_id":"CCMSLIB00017318457","spectrum_index":51917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 68.031 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.217,"smiles":null,"spectrum_id":"CCMSLIB00017318458","spectrum_index":51918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 171.0994 Da; putative annotation: N/A; putative formula: C3H9N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.202,"smiles":null,"spectrum_id":"CCMSLIB00017318459","spectrum_index":51919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 15.9933 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.122,"smiles":null,"spectrum_id":"CCMSLIB00017318460","spectrum_index":51920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 42.0825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.304,"smiles":null,"spectrum_id":"CCMSLIB00017318461","spectrum_index":51921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 218.2035 Da; putative annotation: N/A; putative formula: C16H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.305,"smiles":null,"spectrum_id":"CCMSLIB00017318462","spectrum_index":51922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 584.1952 Da; putative annotation: N/A; putative formula: C23H36O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":735.255,"smiles":null,"spectrum_id":"CCMSLIB00017318463","spectrum_index":51923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 16.9977 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.094,"smiles":null,"spectrum_id":"CCMSLIB00017318464","spectrum_index":51924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 242.2398 Da; putative annotation: N/A; putative formula: C19H30O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":587.373,"smiles":null,"spectrum_id":"CCMSLIB00017318465","spectrum_index":51925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 45.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.133,"smiles":null,"spectrum_id":"CCMSLIB00017318466","spectrum_index":51926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 73.015 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.117,"smiles":null,"spectrum_id":"CCMSLIB00017318467","spectrum_index":51927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 118.0993 Da; putative annotation: N/A; putative formula: C2H10N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.201,"smiles":null,"spectrum_id":"CCMSLIB00017318468","spectrum_index":51928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmaline (delta mass: 181.07 Da; putative annotation: N/A; putative formula: C4H11N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.188,"smiles":null,"spectrum_id":"CCMSLIB00017318469","spectrum_index":51929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 239.1159 Da; putative annotation: N/A; putative formula: C12H17NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.207,"smiles":null,"spectrum_id":"CCMSLIB00017318470","spectrum_index":51930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 17.0709 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.178,"smiles":null,"spectrum_id":"CCMSLIB00017318471","spectrum_index":51931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 78.0315 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.18,"smiles":null,"spectrum_id":"CCMSLIB00017318472","spectrum_index":51932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 66.0477 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.269,"smiles":null,"spectrum_id":"CCMSLIB00017318473","spectrum_index":51933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 70.0406 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.127,"smiles":null,"spectrum_id":"CCMSLIB00017318474","spectrum_index":51934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of proline_betaine (delta mass: 99.0685 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.17,"smiles":null,"spectrum_id":"CCMSLIB00017318475","spectrum_index":51935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C5:0 (delta mass: 85.0047 Da; putative annotation: N/A; putative formula: C5H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.169,"smiles":null,"spectrum_id":"CCMSLIB00017318476","spectrum_index":51936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1151.395 Da; putative annotation: N/A; putative formula: C89H53NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1494.52,"smiles":null,"spectrum_id":"CCMSLIB00017318477","spectrum_index":51937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 273.2309 Da; putative annotation: N/A; putative formula: C15H31NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":604.385,"smiles":null,"spectrum_id":"CCMSLIB00017318478","spectrum_index":51938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 541.9186 Da; putative annotation: N/A; putative formula: C13H2N8O13S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.016,"smiles":null,"spectrum_id":"CCMSLIB00017318479","spectrum_index":51939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[4-(dimethylamino)butyl]isothiourea (delta mass: 234.3497 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.471,"smiles":null,"spectrum_id":"CCMSLIB00017318480","spectrum_index":51940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine (delta mass: 224.8406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017318481","spectrum_index":51941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 234.2713 Da; putative annotation: N/A; putative formula: C18H34O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.373,"smiles":null,"spectrum_id":"CCMSLIB00017318482","spectrum_index":51942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 305.1592 Da; putative annotation: N/A; putative formula: C13H27N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.256,"smiles":null,"spectrum_id":"CCMSLIB00017318483","spectrum_index":51943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 133.0481 Da; putative annotation: N/A; putative formula: C5H12NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.13,"smiles":null,"spectrum_id":"CCMSLIB00017318484","spectrum_index":51944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 795.0197 Da; putative annotation: N/A; putative formula: C40H29NO3S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1017.12,"smiles":null,"spectrum_id":"CCMSLIB00017318485","spectrum_index":51945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 397.222 Da; putative annotation: N/A; putative formula: C20H35N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.33,"smiles":null,"spectrum_id":"CCMSLIB00017318486","spectrum_index":51946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 200.0433 Da; putative annotation: N/A; putative formula: C7H8N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.13,"smiles":null,"spectrum_id":"CCMSLIB00017318487","spectrum_index":51947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250803 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 146.2039 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.264,"smiles":null,"spectrum_id":"CCMSLIB00017318488","spectrum_index":51948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 263.1734 Da; putative annotation: N/A; putative formula: C12H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.26,"smiles":null,"spectrum_id":"CCMSLIB00017318489","spectrum_index":51949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 224.2138 Da; putative annotation: N/A; putative formula: C15H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.274,"smiles":null,"spectrum_id":"CCMSLIB00017318490","spectrum_index":51950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 779.0428 Da; putative annotation: N/A; putative formula: C28H25N7O12S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":960.114,"smiles":null,"spectrum_id":"CCMSLIB00017318491","spectrum_index":51951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 576.4855 Da; putative annotation: N/A; putative formula: C35H64N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.572,"smiles":null,"spectrum_id":"CCMSLIB00017318492","spectrum_index":51952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(4-nitrobenzyl)ethanamine (delta mass: 86.051 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.17,"smiles":null,"spectrum_id":"CCMSLIB00017318493","spectrum_index":51953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 118.1145 Da; putative annotation: N/A; putative formula: C10H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.357,"smiles":null,"spectrum_id":"CCMSLIB00017318494","spectrum_index":51954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxyethoxy)-5-(trifluoromethyl)aniline (delta mass: 73.0221 Da; putative annotation: N/A; putative formula: CH4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.111,"smiles":null,"spectrum_id":"CCMSLIB00017318495","spectrum_index":51955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 150.1049 Da; putative annotation: N/A; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.274,"smiles":null,"spectrum_id":"CCMSLIB00017318496","spectrum_index":51956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 112.0671 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.138,"smiles":null,"spectrum_id":"CCMSLIB00017318497","spectrum_index":51957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 137.0836 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.253,"smiles":null,"spectrum_id":"CCMSLIB00017318498","spectrum_index":51958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 322.1895 Da; putative annotation: N/A; putative formula: C17H26N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.249,"smiles":null,"spectrum_id":"CCMSLIB00017318499","spectrum_index":51959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 144.126 Da; putative annotation: N/A; putative formula: C7H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.296,"smiles":null,"spectrum_id":"CCMSLIB00017318500","spectrum_index":51960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dextrorphan (delta mass: 110.0423 Da; putative annotation: N/A; putative formula: C5H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.228,"smiles":null,"spectrum_id":"CCMSLIB00017318501","spectrum_index":51961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 177.1515 Da; putative annotation: N/A; putative formula: C12H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.233,"smiles":null,"spectrum_id":"CCMSLIB00017318502","spectrum_index":51962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 61.0858 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.097,"smiles":null,"spectrum_id":"CCMSLIB00017318503","spectrum_index":51963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Acetylindol-3-yl)-5-methyl-3-pyrazolin-3-one (delta mass: 111.0414 Da; putative annotation: N/A; putative formula: HN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017318504","spectrum_index":51964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Cyclohexylethanol (delta mass: 27.9944 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":157.122,"smiles":null,"spectrum_id":"CCMSLIB00017318505","spectrum_index":51965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 146.0359 Da; putative annotation: N/A; putative formula: C3H7N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.148,"smiles":null,"spectrum_id":"CCMSLIB00017318506","spectrum_index":51966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310796 Aminobutyl benzamide (delta mass: 42.022 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.156,"smiles":null,"spectrum_id":"CCMSLIB00017318507","spectrum_index":51967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 8.9996 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":168.08,"smiles":null,"spectrum_id":"CCMSLIB00017318508","spectrum_index":51968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 90.0851 Da; putative annotation: N/A; putative formula: C8H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.322,"smiles":null,"spectrum_id":"CCMSLIB00017318509","spectrum_index":51969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 48.0418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.185,"smiles":null,"spectrum_id":"CCMSLIB00017318510","spectrum_index":51970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 83.037 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017318511","spectrum_index":51971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 52.0671 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.304,"smiles":null,"spectrum_id":"CCMSLIB00017318512","spectrum_index":51972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 141.0419 Da; putative annotation: (.alpha.S,1S,2R)-.alpha.-Amino-2-carboxycyclopropaneacetic acid; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.113,"smiles":null,"spectrum_id":"CCMSLIB00017318513","spectrum_index":51973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 119.0373 Da; putative annotation: 2-Pyridylacetic acid; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.214,"smiles":null,"spectrum_id":"CCMSLIB00017318514","spectrum_index":51974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 111.0434 Da; putative annotation: 5-Methoxy-4-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one; putative formula: C4H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.103,"smiles":null,"spectrum_id":"CCMSLIB00017318515","spectrum_index":51975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 136.1248 Da; putative annotation: endo-Borneol; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.195,"smiles":null,"spectrum_id":"CCMSLIB00017318516","spectrum_index":51976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(-)-Tagatose (delta mass: 96.0577 Da; putative annotation: 2-Butenoic acid, 2-ethyl-, (Z)-; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.128,"smiles":null,"spectrum_id":"CCMSLIB00017318517","spectrum_index":51977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Piperazinyl)-1H-indole (delta mass: 183.1171 Da; putative annotation: 4-(1-Piperazinyl)-1H-indole; putative formula: C12H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.251,"smiles":null,"spectrum_id":"CCMSLIB00017318518","spectrum_index":51978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 176.0321 Da; putative annotation: D-Glucuronic acid; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.124,"smiles":null,"spectrum_id":"CCMSLIB00017318519","spectrum_index":51979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 182.1665 Da; putative annotation: Dodecanoic acid; putative formula: C12H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.227,"smiles":null,"spectrum_id":"CCMSLIB00017318520","spectrum_index":51980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 113.0845 Da; putative annotation: 1747371 - 40.0 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.255,"smiles":null,"spectrum_id":"CCMSLIB00017318521","spectrum_index":51981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 228.1153 Da; putative annotation: Glu-Val; putative formula: C10H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.191,"smiles":null,"spectrum_id":"CCMSLIB00017318522","spectrum_index":51982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ile-Glu from NIST14 (delta mass: 85.0891 Da; putative annotation: 3-Aminopentan-2-ol; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.234,"smiles":null,"spectrum_id":"CCMSLIB00017318523","spectrum_index":51983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 125.0469 Da; putative annotation: 2-((2,2,2-Trifluoroethyl)amino)ethan-1-ol; putative formula: C4H6F3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.107,"smiles":null,"spectrum_id":"CCMSLIB00017318524","spectrum_index":51984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 104.0472 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017318525","spectrum_index":51985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 349.179 Da; putative annotation: N/A; putative formula: C21H23N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":678.365,"smiles":null,"spectrum_id":"CCMSLIB00017318526","spectrum_index":51986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 345.1223 Da; putative annotation: N/A; putative formula: C19H15N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.292,"smiles":null,"spectrum_id":"CCMSLIB00017318527","spectrum_index":51987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 226.0633 Da; putative annotation: N/A; putative formula: C6H16N2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.233,"smiles":null,"spectrum_id":"CCMSLIB00017318528","spectrum_index":51988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 147.0683 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.197,"smiles":null,"spectrum_id":"CCMSLIB00017318529","spectrum_index":51989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 108.0577 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.138,"smiles":null,"spectrum_id":"CCMSLIB00017318530","spectrum_index":51990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Gln (delta mass: 240.0746 Da; putative annotation: N/A; putative formula: C15H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.194,"smiles":null,"spectrum_id":"CCMSLIB00017318531","spectrum_index":51991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 210.1977 Da; putative annotation: N/A; putative formula: C14H26O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.284,"smiles":null,"spectrum_id":"CCMSLIB00017318532","spectrum_index":51992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 498.2465 Da; putative annotation: N/A; putative formula: C25H38O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.295,"smiles":null,"spectrum_id":"CCMSLIB00017318533","spectrum_index":51993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 43.0145 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.08,"smiles":null,"spectrum_id":"CCMSLIB00017318534","spectrum_index":51994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 357.1801 Da; putative annotation: N/A; putative formula: C18H23N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":516.26,"smiles":null,"spectrum_id":"CCMSLIB00017318535","spectrum_index":51995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 763.3625 Da; putative annotation: N/A; putative formula: C41H57N5O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":926.423,"smiles":null,"spectrum_id":"CCMSLIB00017318536","spectrum_index":51996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 96.0274 Da; putative annotation: N/A; putative formula: N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.197,"smiles":null,"spectrum_id":"CCMSLIB00017318537","spectrum_index":51997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 247.0877 Da; putative annotation: N/A; putative formula: C10H17NO4S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.174,"smiles":null,"spectrum_id":"CCMSLIB00017318538","spectrum_index":51998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 263.1406 Da; putative annotation: N/A; putative formula: C11H18N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.31,"smiles":null,"spectrum_id":"CCMSLIB00017318539","spectrum_index":51999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Heptanone, 7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)- (delta mass: 82.0263 Da; putative annotation: N/A; putative formula: C2H2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.18,"smiles":null,"spectrum_id":"CCMSLIB00017318540","spectrum_index":52000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-yl)ethanamine (delta mass: 44.9986 Da; putative annotation: N/A; putative formula: C4H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.101,"smiles":null,"spectrum_id":"CCMSLIB00017318541","spectrum_index":52001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 51.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.138,"smiles":null,"spectrum_id":"CCMSLIB00017318542","spectrum_index":52002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 54.0106 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.092,"smiles":null,"spectrum_id":"CCMSLIB00017318543","spectrum_index":52003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 394.0698 Da; putative annotation: N/A; putative formula: C22H18O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.13,"smiles":null,"spectrum_id":"CCMSLIB00017318544","spectrum_index":52004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxamide, 6-amino-N-[3-[4-(4-morpholinyl)pyrido[3',2':4,5]furo[3,2-d]pyrimidin-2-yl]phenyl]- (delta mass: 43.9816 Da; putative annotation: N/A; putative formula: CHP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":512.159,"smiles":null,"spectrum_id":"CCMSLIB00017318545","spectrum_index":52005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 132.0152 Da; putative annotation: N/A; putative formula: C7H4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.143,"smiles":null,"spectrum_id":"CCMSLIB00017318546","spectrum_index":52006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 55.042 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.107,"smiles":null,"spectrum_id":"CCMSLIB00017318547","spectrum_index":52007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 555.1807 Da; putative annotation: N/A; putative formula: C35H21N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":718.241,"smiles":null,"spectrum_id":"CCMSLIB00017318548","spectrum_index":52008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 330.1948 Da; putative annotation: N/A; putative formula: C12H26N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.26,"smiles":null,"spectrum_id":"CCMSLIB00017318549","spectrum_index":52009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 415.2577 Da; putative annotation: N/A; putative formula: C22H41NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":580.333,"smiles":null,"spectrum_id":"CCMSLIB00017318550","spectrum_index":52010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 138.0833 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.154,"smiles":null,"spectrum_id":"CCMSLIB00017318551","spectrum_index":52011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 26.9837 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.117,"smiles":null,"spectrum_id":"CCMSLIB00017318552","spectrum_index":52012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU110102 Terbutaline|5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol (delta mass: 81.0044 Da; putative annotation: N/A; putative formula: C4H3NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.148,"smiles":null,"spectrum_id":"CCMSLIB00017318553","spectrum_index":52013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Piperidin-4-yl)ethan-1-ol (delta mass: 55.0689 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.191,"smiles":null,"spectrum_id":"CCMSLIB00017318554","spectrum_index":52014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 233.0787 Da; putative annotation: N/A; putative formula: C13H16NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.201,"smiles":null,"spectrum_id":"CCMSLIB00017318555","spectrum_index":52015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 159.1263 Da; putative annotation: N/A; putative formula: C8H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.238,"smiles":null,"spectrum_id":"CCMSLIB00017318556","spectrum_index":52016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 141.0423 Da; putative annotation: N/A; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.16,"smiles":null,"spectrum_id":"CCMSLIB00017318557","spectrum_index":52017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 268.204 Da; putative annotation: N/A; putative formula: C16H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.316,"smiles":null,"spectrum_id":"CCMSLIB00017318558","spectrum_index":52018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 878.4918 Da; putative annotation: N/A; putative formula: C54H66N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1041.55,"smiles":null,"spectrum_id":"CCMSLIB00017318559","spectrum_index":52019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 9.9697 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.066,"smiles":null,"spectrum_id":"CCMSLIB00017318560","spectrum_index":52020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 110.0493 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.125,"smiles":null,"spectrum_id":"CCMSLIB00017318561","spectrum_index":52021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 133.0526 Da; putative annotation: N/A; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.123,"smiles":null,"spectrum_id":"CCMSLIB00017318562","spectrum_index":52022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 210.198 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.263,"smiles":null,"spectrum_id":"CCMSLIB00017318563","spectrum_index":52023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 46.0779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.133,"smiles":null,"spectrum_id":"CCMSLIB00017318564","spectrum_index":52024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 196.0725 Da; putative annotation: N/A; putative formula: C4H13N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.19,"smiles":null,"spectrum_id":"CCMSLIB00017318565","spectrum_index":52025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 128.0112 Da; putative annotation: N/A; putative formula: C5H4O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.076,"smiles":null,"spectrum_id":"CCMSLIB00017318566","spectrum_index":52026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 300.1306 Da; putative annotation: N/A; putative formula: C10H12N12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.212,"smiles":null,"spectrum_id":"CCMSLIB00017318567","spectrum_index":52027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250803 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 269.1175 Da; putative annotation: N/A; putative formula: C8H15N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.177,"smiles":null,"spectrum_id":"CCMSLIB00017318568","spectrum_index":52028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 79.958 Da; putative annotation: N/A; putative formula: H2OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.122,"smiles":null,"spectrum_id":"CCMSLIB00017318569","spectrum_index":52029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 56.0621 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.211,"smiles":null,"spectrum_id":"CCMSLIB00017318570","spectrum_index":52030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 71.0268 Da; putative annotation: N/A; putative formula: C3H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.134,"smiles":null,"spectrum_id":"CCMSLIB00017318571","spectrum_index":52031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 91.997 Da; putative annotation: N/A; putative formula: CH5N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.047,"smiles":null,"spectrum_id":"CCMSLIB00017318572","spectrum_index":52032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 102.0367 Da; putative annotation: N/A; putative formula: C2H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.123,"smiles":null,"spectrum_id":"CCMSLIB00017318573","spectrum_index":52033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU288005 Harman|1-methyl-9H-pyrido[3,4-b]indole (delta mass: 42.0516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.143,"smiles":null,"spectrum_id":"CCMSLIB00017318574","spectrum_index":52034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301132 L-Oxonoreleagnine (delta mass: 98.0373 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.124,"smiles":null,"spectrum_id":"CCMSLIB00017318575","spectrum_index":52035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 69.0575 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.117,"smiles":null,"spectrum_id":"CCMSLIB00017318576","spectrum_index":52036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 85.1801 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.26,"smiles":null,"spectrum_id":"CCMSLIB00017318577","spectrum_index":52037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 405.1475 Da; putative annotation: N/A; putative formula: C26H19N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.191,"smiles":null,"spectrum_id":"CCMSLIB00017318578","spectrum_index":52038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 469.2226 Da; putative annotation: N/A; putative formula: C26H27N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":784.382,"smiles":null,"spectrum_id":"CCMSLIB00017318579","spectrum_index":52039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 86.0376 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.113,"smiles":null,"spectrum_id":"CCMSLIB00017318580","spectrum_index":52040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 309.1774 Da; putative annotation: N/A; putative formula: C17H29NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.264,"smiles":null,"spectrum_id":"CCMSLIB00017318581","spectrum_index":52041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 80.0102 Da; putative annotation: N/A; putative formula: C5H4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017318582","spectrum_index":52042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SODIUM D-GLUCONATE (delta mass: 67.079 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.145,"smiles":null,"spectrum_id":"CCMSLIB00017318583","spectrum_index":52043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 110.0521 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.149,"smiles":null,"spectrum_id":"CCMSLIB00017318584","spectrum_index":52044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 12.973 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.033,"smiles":null,"spectrum_id":"CCMSLIB00017318585","spectrum_index":52045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU244306 2-Amino-9H-pyrido[2,3-b]indole (AalphaC)|2-Amino-9H-pyrido[2,3-b]indole|9H-pyrido[2,3-b]indol-2-amine (delta mass: 604.5302 Da; putative annotation: N/A; putative formula: C37H64N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":788.617,"smiles":null,"spectrum_id":"CCMSLIB00017318586","spectrum_index":52046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 326.1917 Da; putative annotation: N/A; putative formula: C18H30O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.294,"smiles":null,"spectrum_id":"CCMSLIB00017318587","spectrum_index":52047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 186.0289 Da; putative annotation: N/A; putative formula: C7H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.089,"smiles":null,"spectrum_id":"CCMSLIB00017318588","spectrum_index":52048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxy-1-naphthyl)ethanamine (delta mass: 274.1844 Da; putative annotation: N/A; putative formula: C12H28N4O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.307,"smiles":null,"spectrum_id":"CCMSLIB00017318589","spectrum_index":52049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 285.1216 Da; putative annotation: N/A; putative formula: C13H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.161,"smiles":null,"spectrum_id":"CCMSLIB00017318590","spectrum_index":52050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 258.0832 Da; putative annotation: N/A; putative formula: C10H14N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.186,"smiles":null,"spectrum_id":"CCMSLIB00017318591","spectrum_index":52051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 25.9114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.998,"smiles":null,"spectrum_id":"CCMSLIB00017318592","spectrum_index":52052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsoline (delta mass: 262.1669 Da; putative annotation: N/A; putative formula: C15H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.284,"smiles":null,"spectrum_id":"CCMSLIB00017318593","spectrum_index":52053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopentylacetic acid (delta mass: 100.016 Da; putative annotation: N/A; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.118,"smiles":null,"spectrum_id":"CCMSLIB00017318594","spectrum_index":52054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 17.0641 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.166,"smiles":null,"spectrum_id":"CCMSLIB00017318595","spectrum_index":52055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 176.0426 Da; putative annotation: N/A; putative formula: C7H13OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.015,"smiles":null,"spectrum_id":"CCMSLIB00017318596","spectrum_index":52056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 64.1794 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.191,"smiles":null,"spectrum_id":"CCMSLIB00017318597","spectrum_index":52057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 494.8491 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.909,"smiles":null,"spectrum_id":"CCMSLIB00017318598","spectrum_index":52058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 63.0322 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.059,"smiles":null,"spectrum_id":"CCMSLIB00017318599","spectrum_index":52059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 454.3278 Da; putative annotation: N/A; putative formula: C23H46N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.404,"smiles":null,"spectrum_id":"CCMSLIB00017318600","spectrum_index":52060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 141.1852 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.334,"smiles":null,"spectrum_id":"CCMSLIB00017318601","spectrum_index":52061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpyridin-4-ylamine (delta mass: 16.974 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":126.05,"smiles":null,"spectrum_id":"CCMSLIB00017318602","spectrum_index":52062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 84.0364 Da; putative annotation: N/A; putative formula: C8H4O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017318603","spectrum_index":52063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 315.1544 Da; putative annotation: N/A; putative formula: C18H22ClN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.257,"smiles":null,"spectrum_id":"CCMSLIB00017318604","spectrum_index":52064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 219.1623 Da; putative annotation: N/A; putative formula: C14H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.259,"smiles":null,"spectrum_id":"CCMSLIB00017318605","spectrum_index":52065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-Isopropoxy-5-(trifluoromethyl)phenyl]amine (delta mass: 8.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.104,"smiles":null,"spectrum_id":"CCMSLIB00017318606","spectrum_index":52066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 656.228 Da; putative annotation: N/A; putative formula: C39H36N4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":999.352,"smiles":null,"spectrum_id":"CCMSLIB00017318607","spectrum_index":52067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acaranoic acid (delta mass: 60.0346 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.256,"smiles":null,"spectrum_id":"CCMSLIB00017318608","spectrum_index":52068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 68.115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.206,"smiles":null,"spectrum_id":"CCMSLIB00017318609","spectrum_index":52069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 226.0989 Da; putative annotation: N/A; putative formula: C15H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.164,"smiles":null,"spectrum_id":"CCMSLIB00017318610","spectrum_index":52070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 85.052 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.154,"smiles":null,"spectrum_id":"CCMSLIB00017318611","spectrum_index":52071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 529.1702 Da; putative annotation: N/A; putative formula: C28H28N5O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.267,"smiles":null,"spectrum_id":"CCMSLIB00017318612","spectrum_index":52072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 361.9103 Da; putative annotation: N/A; putative formula: C9H16O-1P2S6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.034,"smiles":null,"spectrum_id":"CCMSLIB00017318613","spectrum_index":52073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,8-Quinolinediol (delta mass: 75.0321 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.087,"smiles":null,"spectrum_id":"CCMSLIB00017318614","spectrum_index":52074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 61.0113 Da; putative annotation: N/A; putative formula: H3N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.071,"smiles":null,"spectrum_id":"CCMSLIB00017318615","spectrum_index":52075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 27.9943 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.091,"smiles":null,"spectrum_id":"CCMSLIB00017318616","spectrum_index":52076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 69.0578 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.155,"smiles":null,"spectrum_id":"CCMSLIB00017318617","spectrum_index":52077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 150.087 Da; putative annotation: N/A; putative formula: C10H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.167,"smiles":null,"spectrum_id":"CCMSLIB00017318618","spectrum_index":52078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 156.1121 Da; putative annotation: N/A; putative formula: C5H12N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.193,"smiles":null,"spectrum_id":"CCMSLIB00017318619","spectrum_index":52079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 134.9229 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.046,"smiles":null,"spectrum_id":"CCMSLIB00017318620","spectrum_index":52080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 83.0209 Da; putative annotation: N/A; putative formula: C4H5NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.117,"smiles":null,"spectrum_id":"CCMSLIB00017318621","spectrum_index":52081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 33.0247 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.143,"smiles":null,"spectrum_id":"CCMSLIB00017318622","spectrum_index":52082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 146.0998 Da; putative annotation: N/A; putative formula: C5H14N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.212,"smiles":null,"spectrum_id":"CCMSLIB00017318623","spectrum_index":52083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 287.1449 Da; putative annotation: N/A; putative formula: C8H17N9O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.299,"smiles":null,"spectrum_id":"CCMSLIB00017318624","spectrum_index":52084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 42.0259 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.102,"smiles":null,"spectrum_id":"CCMSLIB00017318625","spectrum_index":52085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 154.0574 Da; putative annotation: N/A; putative formula: H2N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.16,"smiles":null,"spectrum_id":"CCMSLIB00017318626","spectrum_index":52086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 302.1368 Da; putative annotation: N/A; putative formula: C17H23N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.202,"smiles":null,"spectrum_id":"CCMSLIB00017318627","spectrum_index":52087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 469.3192 Da; putative annotation: N/A; putative formula: C29H43NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.39,"smiles":null,"spectrum_id":"CCMSLIB00017318628","spectrum_index":52088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 57.0005 Da; putative annotation: N/A; putative formula: C5H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.087,"smiles":null,"spectrum_id":"CCMSLIB00017318629","spectrum_index":52089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 156.0271 Da; putative annotation: N/A; putative formula: C6H9N2O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.118,"smiles":null,"spectrum_id":"CCMSLIB00017318630","spectrum_index":52090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 99.1323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.211,"smiles":null,"spectrum_id":"CCMSLIB00017318631","spectrum_index":52091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Difluorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (delta mass: 25.9773 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.04,"smiles":null,"spectrum_id":"CCMSLIB00017318632","spectrum_index":52092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Ala (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.207,"smiles":null,"spectrum_id":"CCMSLIB00017318633","spectrum_index":52093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 123.0092 Da; putative annotation: N/A; putative formula: C3H2N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.133,"smiles":null,"spectrum_id":"CCMSLIB00017318634","spectrum_index":52094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 62.0481 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.134,"smiles":null,"spectrum_id":"CCMSLIB00017318635","spectrum_index":52095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 11.0043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.111,"smiles":null,"spectrum_id":"CCMSLIB00017318636","spectrum_index":52096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 143.103 Da; putative annotation: N/A; putative formula: C2H9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.199,"smiles":null,"spectrum_id":"CCMSLIB00017318637","spectrum_index":52097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-2-(hydroxymethyl)pyridine (delta mass: 27.9943 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.049,"smiles":null,"spectrum_id":"CCMSLIB00017318638","spectrum_index":52098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 26.8599 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.967,"smiles":null,"spectrum_id":"CCMSLIB00017318639","spectrum_index":52099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl 1-methyl-9H-beta-carbolin-7-yl ether (delta mass: 85.0048 Da; putative annotation: N/A; putative formula: C5H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.107,"smiles":null,"spectrum_id":"CCMSLIB00017318640","spectrum_index":52100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 101.0574 Da; putative annotation: N/A; putative formula: C3H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.175,"smiles":null,"spectrum_id":"CCMSLIB00017318641","spectrum_index":52101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 96.0436 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.145,"smiles":null,"spectrum_id":"CCMSLIB00017318642","spectrum_index":52102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 88.0158 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.175,"smiles":null,"spectrum_id":"CCMSLIB00017318643","spectrum_index":52103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 22.8844 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.986,"smiles":null,"spectrum_id":"CCMSLIB00017318644","spectrum_index":52104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101901 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 100.0526 Da; putative annotation: N/A; putative formula: C5H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.139,"smiles":null,"spectrum_id":"CCMSLIB00017318645","spectrum_index":52105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Trifluoromethyl)-1H-indole-2-carboxylic acid (delta mass: 18.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.059,"smiles":null,"spectrum_id":"CCMSLIB00017318646","spectrum_index":52106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084604 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 113.0697 Da; putative annotation: N/A; putative formula: C3H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.124,"smiles":null,"spectrum_id":"CCMSLIB00017318647","spectrum_index":52107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 259.1407 Da; putative annotation: N/A; putative formula: C9H13N11O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.227,"smiles":null,"spectrum_id":"CCMSLIB00017318648","spectrum_index":52108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2-(4-propionyl-1-piperazinyl)aniline (delta mass: 185.2089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.33,"smiles":null,"spectrum_id":"CCMSLIB00017318649","spectrum_index":52109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[2-(3,4-dimethoxyphenyl)ethyl]-4-chlorobutanamide CollisionEnergy:205060\"\" (delta mass: 45.0322 Da; putative annotation: N/A; putative formula: H3N3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.153,"smiles":null,"spectrum_id":"CCMSLIB00017318650","spectrum_index":52110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 184.1002 Da; putative annotation: N/A; putative formula: C12H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.186,"smiles":null,"spectrum_id":"CCMSLIB00017318651","spectrum_index":52111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin Methyl Ester (delta mass: 176.0329 Da; putative annotation: N/A; putative formula: C7H12OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.116,"smiles":null,"spectrum_id":"CCMSLIB00017318652","spectrum_index":52112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 161.0837 Da; putative annotation: L-Phenylalanine, methyl ester; putative formula: C10H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.196,"smiles":null,"spectrum_id":"CCMSLIB00017318653","spectrum_index":52113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 148.0522 Da; putative annotation: Spectral Match to Tropic acid from NIST14; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.143,"smiles":null,"spectrum_id":"CCMSLIB00017318654","spectrum_index":52114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 208.1835 Da; putative annotation: Spectral Match to Myristoleic acid from NIST14; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.254,"smiles":null,"spectrum_id":"CCMSLIB00017318655","spectrum_index":52115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 193.1106 Da; putative annotation: Methoxamine; putative formula: C11H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.228,"smiles":null,"spectrum_id":"CCMSLIB00017318656","spectrum_index":52116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 314.2246 Da; putative annotation: 16.alpha.-Hydroxypregnenolone; putative formula: C21H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.295,"smiles":null,"spectrum_id":"CCMSLIB00017318657","spectrum_index":52117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 108.0209 Da; putative annotation: 4-Hydroxy-6-methyl-2-pyrone; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.144,"smiles":null,"spectrum_id":"CCMSLIB00017318658","spectrum_index":52118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 148.053 Da; putative annotation: 2'-Hydroxy-4'-methoxyacetophenone; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.15,"smiles":null,"spectrum_id":"CCMSLIB00017318659","spectrum_index":52119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 153.0785 Da; putative annotation: (1S,2R)-2-(Aminocarbonyl)cyclohexanecarboxylic acid; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.18,"smiles":null,"spectrum_id":"CCMSLIB00017318660","spectrum_index":52120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 281.1326 Da; putative annotation: N/A; putative formula: C10H24N3O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.271,"smiles":null,"spectrum_id":"CCMSLIB00017318661","spectrum_index":52121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 277.081 Da; putative annotation: N/A; putative formula: C11H11N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.193,"smiles":null,"spectrum_id":"CCMSLIB00017318662","spectrum_index":52122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 267.1834 Da; putative annotation: N/A; putative formula: C15H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.248,"smiles":null,"spectrum_id":"CCMSLIB00017318663","spectrum_index":52123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic TAN 1446A (delta mass: 68.0624 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.216,"smiles":null,"spectrum_id":"CCMSLIB00017318664","spectrum_index":52124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 106.0417 Da; putative annotation: N/A; putative formula: C7H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.154,"smiles":null,"spectrum_id":"CCMSLIB00017318665","spectrum_index":52125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 130.0786 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.139,"smiles":null,"spectrum_id":"CCMSLIB00017318666","spectrum_index":52126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Vibriobactin (delta mass: 706.2576 Da; putative annotation: N/A; putative formula: C46H42O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1412.53,"smiles":null,"spectrum_id":"CCMSLIB00017318667","spectrum_index":52127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE (delta mass: 166.2657 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.331,"smiles":null,"spectrum_id":"CCMSLIB00017318668","spectrum_index":52128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9,10,11,12-Tetrahydro-9,12-epoxy-1H-diindolo[1,2,3-fg:3',2',1'-kl]pyrrolo[3,4-i][1,6]benzodiazocine-1,3(2H)-dione (delta mass: 18.0214 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.14,"smiles":null,"spectrum_id":"CCMSLIB00017318669","spectrum_index":52129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 38.0257 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.18,"smiles":null,"spectrum_id":"CCMSLIB00017318670","spectrum_index":52130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 517.2527 Da; putative annotation: N/A; putative formula: C27H40N3O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.313,"smiles":null,"spectrum_id":"CCMSLIB00017318671","spectrum_index":52131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 791.3926 Da; putative annotation: N/A; putative formula: C34H53N11O11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.453,"smiles":null,"spectrum_id":"CCMSLIB00017318672","spectrum_index":52132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 727.3423 Da; putative annotation: N/A; putative formula: C49H41N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1058.5,"smiles":null,"spectrum_id":"CCMSLIB00017318673","spectrum_index":52133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 113.0709 Da; putative annotation: N/A; putative formula: C3H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.209,"smiles":null,"spectrum_id":"CCMSLIB00017318674","spectrum_index":52134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dideoxyuridine (delta mass: 25.0198 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017318675","spectrum_index":52135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 366.0735 Da; putative annotation: N/A; putative formula: C12H18N2O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.16,"smiles":null,"spectrum_id":"CCMSLIB00017318676","spectrum_index":52136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 238.2292 Da; putative annotation: N/A; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.389,"smiles":null,"spectrum_id":"CCMSLIB00017318677","spectrum_index":52137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 166.099 Da; putative annotation: N/A; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.164,"smiles":null,"spectrum_id":"CCMSLIB00017318678","spectrum_index":52138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mycophenolic acid IV (delta mass: 262.2324 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.428,"smiles":null,"spectrum_id":"CCMSLIB00017318679","spectrum_index":52139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-7-carboxaldehyde (delta mass: 90.0535 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.113,"smiles":null,"spectrum_id":"CCMSLIB00017318680","spectrum_index":52140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 280.2402 Da; putative annotation: N/A; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.316,"smiles":null,"spectrum_id":"CCMSLIB00017318681","spectrum_index":52141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 226.03 Da; putative annotation: N/A; putative formula: C10H10O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.132,"smiles":null,"spectrum_id":"CCMSLIB00017318682","spectrum_index":52142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 145.1469 Da; putative annotation: N/A; putative formula: C4H15N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.212,"smiles":null,"spectrum_id":"CCMSLIB00017318683","spectrum_index":52143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 418.2357 Da; putative annotation: N/A; putative formula: C24H34O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.301,"smiles":null,"spectrum_id":"CCMSLIB00017318684","spectrum_index":52144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371606 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 208.0566 Da; putative annotation: N/A; putative formula: C4H4N10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.127,"smiles":null,"spectrum_id":"CCMSLIB00017318685","spectrum_index":52145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 24.8713 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.963,"smiles":null,"spectrum_id":"CCMSLIB00017318686","spectrum_index":52146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 76.0258 Da; putative annotation: N/A; putative formula: CH4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.143,"smiles":null,"spectrum_id":"CCMSLIB00017318687","spectrum_index":52147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 11.041 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.127,"smiles":null,"spectrum_id":"CCMSLIB00017318688","spectrum_index":52148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 110.0723 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.184,"smiles":null,"spectrum_id":"CCMSLIB00017318689","spectrum_index":52149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 84.0228 Da; putative annotation: N/A; putative formula: C3H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.109,"smiles":null,"spectrum_id":"CCMSLIB00017318690","spectrum_index":52150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 41.977 Da; putative annotation: N/A; putative formula: H-1N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017318691","spectrum_index":52151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 507.2382 Da; putative annotation: N/A; putative formula: C29H29N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.3,"smiles":null,"spectrum_id":"CCMSLIB00017318692","spectrum_index":52152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 221.1064 Da; putative annotation: N/A; putative formula: C13H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.203,"smiles":null,"spectrum_id":"CCMSLIB00017318693","spectrum_index":52153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 306.18 Da; putative annotation: N/A; putative formula: C14H30N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.266,"smiles":null,"spectrum_id":"CCMSLIB00017318694","spectrum_index":52154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Trp-Ile (delta mass: 113.084 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.265,"smiles":null,"spectrum_id":"CCMSLIB00017318695","spectrum_index":52155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 91.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.249,"smiles":null,"spectrum_id":"CCMSLIB00017318696","spectrum_index":52156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_methyl_1H_indole_4_carboxylic_acid (delta mass: 274.1521 Da; putative annotation: N/A; putative formula: C14H27OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.223,"smiles":null,"spectrum_id":"CCMSLIB00017318697","spectrum_index":52157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1,2,3,4-tetrahydroquinoline (delta mass: 85.0412 Da; putative annotation: N/A; putative formula: CH3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.153,"smiles":null,"spectrum_id":"CCMSLIB00017318698","spectrum_index":52158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 597.3165 Da; putative annotation: N/A; putative formula: C31H43N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":924.57,"smiles":null,"spectrum_id":"CCMSLIB00017318699","spectrum_index":52159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 70.0 eV (delta mass: 179.152 Da; putative annotation: N/A; putative formula: C9H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017318700","spectrum_index":52160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C7:0 (delta mass: 42.0208 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.217,"smiles":null,"spectrum_id":"CCMSLIB00017318701","spectrum_index":52161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Chloro-2,3-dimethyl-1H-indole (delta mass: 17.021 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.079,"smiles":null,"spectrum_id":"CCMSLIB00017318702","spectrum_index":52162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 237.1206 Da; putative annotation: N/A; putative formula: C13H21NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":568.275,"smiles":null,"spectrum_id":"CCMSLIB00017318703","spectrum_index":52163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactose 1-phosphate - 40.0 eV (delta mass: 18.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.047,"smiles":null,"spectrum_id":"CCMSLIB00017318704","spectrum_index":52164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one [IIN-based: Match] (delta mass: 296.0868 Da; putative annotation: N/A; putative formula: C10H12N6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.189,"smiles":null,"spectrum_id":"CCMSLIB00017318705","spectrum_index":52165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00384529-01!5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one (delta mass: 240.0996 Da; putative annotation: N/A; putative formula: C12H16O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.202,"smiles":null,"spectrum_id":"CCMSLIB00017318706","spectrum_index":52166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 395.1375 Da; putative annotation: N/A; putative formula: C14H27N3O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.249,"smiles":null,"spectrum_id":"CCMSLIB00017318707","spectrum_index":52167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 181.0022 Da; putative annotation: N/A; putative formula: C8H-1N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.073,"smiles":null,"spectrum_id":"CCMSLIB00017318708","spectrum_index":52168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(1H-Benzimidazol-2-ylsulfanyl)furan--2-carbaldehyde (delta mass: 250.1121 Da; putative annotation: N/A; putative formula: C14H19O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.15,"smiles":null,"spectrum_id":"CCMSLIB00017318709","spectrum_index":52169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ureidoisobutyric acid; AIF; CE0; MS2Dec (delta mass: 154.1357 Da; putative annotation: N/A; putative formula: C10H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.212,"smiles":null,"spectrum_id":"CCMSLIB00017318710","spectrum_index":52170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 64.0134 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.084,"smiles":null,"spectrum_id":"CCMSLIB00017318711","spectrum_index":52171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 286.0478 Da; putative annotation: N/A; putative formula: C15H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.124,"smiles":null,"spectrum_id":"CCMSLIB00017318712","spectrum_index":52172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 29.0199 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.173,"smiles":null,"spectrum_id":"CCMSLIB00017318713","spectrum_index":52173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301104 L-Oxonoreleagnine (delta mass: 54.0289 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.115,"smiles":null,"spectrum_id":"CCMSLIB00017318714","spectrum_index":52174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 36.0348 Da; putative annotation: N/A; putative formula: C4H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.162,"smiles":null,"spectrum_id":"CCMSLIB00017318715","spectrum_index":52175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 489.2976 Da; putative annotation: N/A; putative formula: C32H44NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":701.349,"smiles":null,"spectrum_id":"CCMSLIB00017318716","spectrum_index":52176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 663.2217 Da; putative annotation: N/A; putative formula: C37H33N3O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1006.35,"smiles":null,"spectrum_id":"CCMSLIB00017318717","spectrum_index":52177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 64.0414 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.091,"smiles":null,"spectrum_id":"CCMSLIB00017318718","spectrum_index":52178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L_DOPA (delta mass: 40.0224 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.098,"smiles":null,"spectrum_id":"CCMSLIB00017318719","spectrum_index":52179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 486.1977 Da; putative annotation: N/A; putative formula: C29H30N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.284,"smiles":null,"spectrum_id":"CCMSLIB00017318720","spectrum_index":52180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 545.1731 Da; putative annotation: N/A; putative formula: C38H28NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.29,"smiles":null,"spectrum_id":"CCMSLIB00017318721","spectrum_index":52181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 58.0787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.191,"smiles":null,"spectrum_id":"CCMSLIB00017318722","spectrum_index":52182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 147.0259 Da; putative annotation: N/A; putative formula: C7H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.125,"smiles":null,"spectrum_id":"CCMSLIB00017318723","spectrum_index":52183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 91.0054 Da; putative annotation: N/A; putative formula: C5HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.092,"smiles":null,"spectrum_id":"CCMSLIB00017318724","spectrum_index":52184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 64.0179 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.12,"smiles":null,"spectrum_id":"CCMSLIB00017318725","spectrum_index":52185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 159.0895 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.191,"smiles":null,"spectrum_id":"CCMSLIB00017318726","spectrum_index":52186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methylbenzene-1,3-diamine (delta mass: 10.0091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.101,"smiles":null,"spectrum_id":"CCMSLIB00017318727","spectrum_index":52187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 204.0427 Da; putative annotation: N/A; putative formula: C6H5N8O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.131,"smiles":null,"spectrum_id":"CCMSLIB00017318728","spectrum_index":52188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 341.1485 Da; putative annotation: N/A; putative formula: C17H27NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.271,"smiles":null,"spectrum_id":"CCMSLIB00017318729","spectrum_index":52189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 66.0472 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.139,"smiles":null,"spectrum_id":"CCMSLIB00017318730","spectrum_index":52190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 269.1714 Da; putative annotation: N/A; putative formula: C9H19N9O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.326,"smiles":null,"spectrum_id":"CCMSLIB00017318731","spectrum_index":52191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 27.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.143,"smiles":null,"spectrum_id":"CCMSLIB00017318732","spectrum_index":52192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 8.9828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.059,"smiles":null,"spectrum_id":"CCMSLIB00017318733","spectrum_index":52193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dulcitol (delta mass: 85.0833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.17,"smiles":null,"spectrum_id":"CCMSLIB00017318734","spectrum_index":52194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 296.13 Da; putative annotation: N/A; putative formula: C15H17N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.218,"smiles":null,"spectrum_id":"CCMSLIB00017318735","spectrum_index":52195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-4-yl)-N-(3-methoxypropyl)-1,2,4-oxadiazole-5-carboxamide (delta mass: 32.0395 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.169,"smiles":null,"spectrum_id":"CCMSLIB00017318736","spectrum_index":52196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCURONOLACTONE (delta mass: 9.9736 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.023,"smiles":null,"spectrum_id":"CCMSLIB00017318737","spectrum_index":52197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 63.0176 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.104,"smiles":null,"spectrum_id":"CCMSLIB00017318738","spectrum_index":52198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 262.0848 Da; putative annotation: N/A; putative formula: C7H14N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.15,"smiles":null,"spectrum_id":"CCMSLIB00017318739","spectrum_index":52199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of E-N-Deoxyfructosyllysine (delta mass: 128.0868 Da; putative annotation: N/A; putative formula: C6H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.252,"smiles":null,"spectrum_id":"CCMSLIB00017318740","spectrum_index":52200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.18,"smiles":null,"spectrum_id":"CCMSLIB00017318741","spectrum_index":52201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 125.9033 Da; putative annotation: N/A; putative formula: H-1O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.995,"smiles":null,"spectrum_id":"CCMSLIB00017318742","spectrum_index":52202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300243 Calycanthine (delta mass: 17.0609 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.284,"smiles":null,"spectrum_id":"CCMSLIB00017318743","spectrum_index":52203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 329.1954 Da; putative annotation: N/A; putative formula: C17H34NO-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.313,"smiles":null,"spectrum_id":"CCMSLIB00017318744","spectrum_index":52204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCOSAMINE 6-SULFATE - 70.0 eV (delta mass: 51.0405 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.084,"smiles":null,"spectrum_id":"CCMSLIB00017318745","spectrum_index":52205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.118,"smiles":null,"spectrum_id":"CCMSLIB00017318746","spectrum_index":52206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 100.0674 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.133,"smiles":null,"spectrum_id":"CCMSLIB00017318747","spectrum_index":52207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 22.0578 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.123,"smiles":null,"spectrum_id":"CCMSLIB00017318748","spectrum_index":52208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 243.2957 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.354,"smiles":null,"spectrum_id":"CCMSLIB00017318749","spectrum_index":52209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 84.0575 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.111,"smiles":null,"spectrum_id":"CCMSLIB00017318750","spectrum_index":52210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 129.0423 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.113,"smiles":null,"spectrum_id":"CCMSLIB00017318751","spectrum_index":52211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 298.132 Da; putative annotation: N/A; putative formula: C17H18N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.245,"smiles":null,"spectrum_id":"CCMSLIB00017318752","spectrum_index":52212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 86.0419 Da; putative annotation: N/A; putative formula: C3H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.153,"smiles":null,"spectrum_id":"CCMSLIB00017318753","spectrum_index":52213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 147.0169 Da; putative annotation: N/A; putative formula: C4H5NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.114,"smiles":null,"spectrum_id":"CCMSLIB00017318754","spectrum_index":52214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 300.1555 Da; putative annotation: N/A; putative formula: C12H24N6O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.315,"smiles":null,"spectrum_id":"CCMSLIB00017318755","spectrum_index":52215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eseroline (delta mass: 96.0435 Da; putative annotation: N/A; putative formula: C3H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.193,"smiles":null,"spectrum_id":"CCMSLIB00017318756","spectrum_index":52216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 264.0419 Da; putative annotation: N/A; putative formula: C8H12N2O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.118,"smiles":null,"spectrum_id":"CCMSLIB00017318757","spectrum_index":52217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 22.1147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.3,"smiles":null,"spectrum_id":"CCMSLIB00017318758","spectrum_index":52218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-serine (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.128,"smiles":null,"spectrum_id":"CCMSLIB00017318759","spectrum_index":52219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 165.0788 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.155,"smiles":null,"spectrum_id":"CCMSLIB00017318760","spectrum_index":52220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 449.1533 Da; putative annotation: N/A; putative formula: C18H27NO12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.265,"smiles":null,"spectrum_id":"CCMSLIB00017318761","spectrum_index":52221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluorotryptamine (delta mass: 72.032 Da; putative annotation: N/A; putative formula: C2H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.13,"smiles":null,"spectrum_id":"CCMSLIB00017318762","spectrum_index":52222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 225.0488 Da; putative annotation: N/A; putative formula: C9H12N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.109,"smiles":null,"spectrum_id":"CCMSLIB00017318763","spectrum_index":52223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 115.0892 Da; putative annotation: N/A; putative formula: C6H14NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.101,"smiles":null,"spectrum_id":"CCMSLIB00017318764","spectrum_index":52224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 13.0579 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.128,"smiles":null,"spectrum_id":"CCMSLIB00017318765","spectrum_index":52225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 124.0815 Da; putative annotation: N/A; putative formula: C8H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.13,"smiles":null,"spectrum_id":"CCMSLIB00017318766","spectrum_index":52226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 104.0613 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.137,"smiles":null,"spectrum_id":"CCMSLIB00017318767","spectrum_index":52227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 314.0639 Da; putative annotation: N/A; putative formula: C13H14O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.176,"smiles":null,"spectrum_id":"CCMSLIB00017318768","spectrum_index":52228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinine (delta mass: 96.064 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.255,"smiles":null,"spectrum_id":"CCMSLIB00017318769","spectrum_index":52229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510501 Tyramine|4-(2-aminoethyl)phenol (delta mass: 231.09 Da; putative annotation: N/A; putative formula: C6H13N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.181,"smiles":null,"spectrum_id":"CCMSLIB00017318770","spectrum_index":52230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100335 D-Mannose-6-phosphate|Man-6P|6-phosphono-D-mannopyranose (delta mass: 61.0769 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.114,"smiles":null,"spectrum_id":"CCMSLIB00017318771","spectrum_index":52231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-(5-fluoropentyl)- (delta mass: 27.0026 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.126,"smiles":null,"spectrum_id":"CCMSLIB00017318772","spectrum_index":52232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 129.0427 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.101,"smiles":null,"spectrum_id":"CCMSLIB00017318773","spectrum_index":52233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 116.1561 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.325,"smiles":null,"spectrum_id":"CCMSLIB00017318774","spectrum_index":52234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 145.0672 Da; putative annotation: N/A; putative formula: C5H11N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.148,"smiles":null,"spectrum_id":"CCMSLIB00017318775","spectrum_index":52235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 66.0471 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.201,"smiles":null,"spectrum_id":"CCMSLIB00017318776","spectrum_index":52236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 220.1926 Da; putative annotation: N/A; putative formula: C14H24N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.279,"smiles":null,"spectrum_id":"CCMSLIB00017318777","spectrum_index":52237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 148.0934 Da; putative annotation: N/A; putative formula: C4H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.258,"smiles":null,"spectrum_id":"CCMSLIB00017318778","spectrum_index":52238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 63.1555 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.331,"smiles":null,"spectrum_id":"CCMSLIB00017318779","spectrum_index":52239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 105.0943 Da; putative annotation: N/A; putative formula: C8H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.16,"smiles":null,"spectrum_id":"CCMSLIB00017318780","spectrum_index":52240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 18.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.05,"smiles":null,"spectrum_id":"CCMSLIB00017318781","spectrum_index":52241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 113.0477 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.145,"smiles":null,"spectrum_id":"CCMSLIB00017318782","spectrum_index":52242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 485.1377 Da; putative annotation: N/A; putative formula: C23H27N5OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.177,"smiles":null,"spectrum_id":"CCMSLIB00017318783","spectrum_index":52243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin F (delta mass: 36.0212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.3,"smiles":null,"spectrum_id":"CCMSLIB00017318784","spectrum_index":52244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 538.3122 Da; putative annotation: N/A; putative formula: C34H50O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.409,"smiles":null,"spectrum_id":"CCMSLIB00017318785","spectrum_index":52245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Subsessiline (delta mass: 30.0473 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.15,"smiles":null,"spectrum_id":"CCMSLIB00017318786","spectrum_index":52246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 55.0441 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.13,"smiles":null,"spectrum_id":"CCMSLIB00017318787","spectrum_index":52247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 280.0771 Da; putative annotation: N/A; putative formula: C14H16O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.231,"smiles":null,"spectrum_id":"CCMSLIB00017318788","spectrum_index":52248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 212.0685 Da; putative annotation: N/A; putative formula: C10H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.207,"smiles":null,"spectrum_id":"CCMSLIB00017318789","spectrum_index":52249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 78.0455 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.106,"smiles":null,"spectrum_id":"CCMSLIB00017318790","spectrum_index":52250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Turanose from NIST14 (delta mass: 163.0633 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.187,"smiles":null,"spectrum_id":"CCMSLIB00017318791","spectrum_index":52251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300067 Kopsinoline (delta mass: 382.1443 Da; putative annotation: N/A; putative formula: C21H23N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.346,"smiles":null,"spectrum_id":"CCMSLIB00017318792","spectrum_index":52252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 143.0792 Da; putative annotation: N/A; putative formula: H5N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.254,"smiles":null,"spectrum_id":"CCMSLIB00017318793","spectrum_index":52253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 647.5484 Da; putative annotation: N/A; putative formula: C40H73NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.619,"smiles":null,"spectrum_id":"CCMSLIB00017318794","spectrum_index":52254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Lys (delta mass: 101.048 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.214,"smiles":null,"spectrum_id":"CCMSLIB00017318795","spectrum_index":52255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 124.0633 Da; putative annotation: N/A; putative formula: C6H8N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.16,"smiles":null,"spectrum_id":"CCMSLIB00017318796","spectrum_index":52256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 186.089 Da; putative annotation: N/A; putative formula: C9H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.144,"smiles":null,"spectrum_id":"CCMSLIB00017318797","spectrum_index":52257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 174.0794 Da; putative annotation: N/A; putative formula: C10H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.129,"smiles":null,"spectrum_id":"CCMSLIB00017318798","spectrum_index":52258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[2-(3,4-dimethoxyphenyl)ethyl]-4-chlorobutanamide CollisionEnergy:102040\"\" (delta mass: 285.0941 Da; putative annotation: N/A; putative formula: C23H11NO-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":571.214,"smiles":null,"spectrum_id":"CCMSLIB00017318799","spectrum_index":52259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 106.0671 Da; putative annotation: N/A; putative formula: C5H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.164,"smiles":null,"spectrum_id":"CCMSLIB00017318800","spectrum_index":52260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 130.172 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.274,"smiles":null,"spectrum_id":"CCMSLIB00017318801","spectrum_index":52261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 336.108 Da; putative annotation: N/A; putative formula: C15H20N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.184,"smiles":null,"spectrum_id":"CCMSLIB00017318802","spectrum_index":52262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 200.0683 Da; putative annotation: N/A; putative formula: C9H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.149,"smiles":null,"spectrum_id":"CCMSLIB00017318803","spectrum_index":52263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 27.038 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.083,"smiles":null,"spectrum_id":"CCMSLIB00017318804","spectrum_index":52264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 113.0472 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.118,"smiles":null,"spectrum_id":"CCMSLIB00017318805","spectrum_index":52265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 181.0738 Da; putative annotation: N/A; putative formula: C9H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.171,"smiles":null,"spectrum_id":"CCMSLIB00017318806","spectrum_index":52266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 68.0223 Da; putative annotation: N/A; putative formula: N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.192,"smiles":null,"spectrum_id":"CCMSLIB00017318807","spectrum_index":52267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 355.2101 Da; putative annotation: N/A; putative formula: C17H29N3O5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.297,"smiles":null,"spectrum_id":"CCMSLIB00017318808","spectrum_index":52268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 88.0679 Da; putative annotation: N/A; putative formula: C8H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.227,"smiles":null,"spectrum_id":"CCMSLIB00017318809","spectrum_index":52269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 43.9852 Da; putative annotation: N/A; putative formula: N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.109,"smiles":null,"spectrum_id":"CCMSLIB00017318810","spectrum_index":52270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 122.9323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.035,"smiles":null,"spectrum_id":"CCMSLIB00017318811","spectrum_index":52271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 26.0886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.169,"smiles":null,"spectrum_id":"CCMSLIB00017318812","spectrum_index":52272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 339.3484 Da; putative annotation: N/A; putative formula: C18H41N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.43,"smiles":null,"spectrum_id":"CCMSLIB00017318813","spectrum_index":52273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 104.011 Da; putative annotation: N/A; putative formula: C3H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.097,"smiles":null,"spectrum_id":"CCMSLIB00017318814","spectrum_index":52274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Thr-Leu (delta mass: 226.1691 Da; putative annotation: Leu-Leu; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.319,"smiles":null,"spectrum_id":"CCMSLIB00017318815","spectrum_index":52275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Pro from NIST14 (delta mass: 97.0531 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.192,"smiles":null,"spectrum_id":"CCMSLIB00017318816","spectrum_index":52276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 412.2974 Da; putative annotation: Hecogenin; putative formula: C27H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.373,"smiles":null,"spectrum_id":"CCMSLIB00017318817","spectrum_index":52277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-sec-Butylphenyl)isonicotinamide (delta mass: 188.0683 Da; putative annotation: Ethyl 7-aminopyrazolo[1,5-a]pyrimidine-6-carboxylate; putative formula: C9H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.217,"smiles":null,"spectrum_id":"CCMSLIB00017318818","spectrum_index":52278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 131.0591 Da; putative annotation: 7-Methyladenine; putative formula: C6H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.119,"smiles":null,"spectrum_id":"CCMSLIB00017318819","spectrum_index":52279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 108.0212 Da; putative annotation: 4-Hydroxy-6-methyl-2-pyrone; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017318820","spectrum_index":52280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 172.1122 Da; putative annotation: 2-Hydrazino-1-propyl-1H-benzimidazole; putative formula: C10H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.24,"smiles":null,"spectrum_id":"CCMSLIB00017318821","spectrum_index":52281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 108.0209 Da; putative annotation: Maltol; putative formula: C6H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.081,"smiles":null,"spectrum_id":"CCMSLIB00017318822","spectrum_index":52282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 268.0373 Da; putative annotation: 7,8,3',4'-Tetrahydroxyflavone; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.161,"smiles":null,"spectrum_id":"CCMSLIB00017318823","spectrum_index":52283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 176.0308 Da; putative annotation: 2-Keto-L-gulonic acid; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.102,"smiles":null,"spectrum_id":"CCMSLIB00017318824","spectrum_index":52284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 321.9849 Da; putative annotation: D-myo-Inositol-4,5-diphosphate; putative formula: C6H12O11P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.045,"smiles":null,"spectrum_id":"CCMSLIB00017318825","spectrum_index":52285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE20 (delta mass: 243.2053 Da; putative annotation: N/A; putative formula: C11H25N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.302,"smiles":null,"spectrum_id":"CCMSLIB00017318826","spectrum_index":52286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Threonine methyl ester (delta mass: 129.0424 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.124,"smiles":null,"spectrum_id":"CCMSLIB00017318827","spectrum_index":52287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 73.0163 Da; putative annotation: N/A; putative formula: C2H3NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.098,"smiles":null,"spectrum_id":"CCMSLIB00017318828","spectrum_index":52288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 65.0363 Da; putative annotation: N/A; putative formula: C3H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.154,"smiles":null,"spectrum_id":"CCMSLIB00017318829","spectrum_index":52289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Hydroxybutorphanol (delta mass: 18.8448 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.067,"smiles":null,"spectrum_id":"CCMSLIB00017318830","spectrum_index":52290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-2-carboxylic acid (delta mass: 26.0284 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.083,"smiles":null,"spectrum_id":"CCMSLIB00017318831","spectrum_index":52291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 123.0559 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.189,"smiles":null,"spectrum_id":"CCMSLIB00017318832","spectrum_index":52292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 240.0746 Da; putative annotation: N/A; putative formula: C15H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.178,"smiles":null,"spectrum_id":"CCMSLIB00017318833","spectrum_index":52293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 351.1166 Da; putative annotation: N/A; putative formula: C20H17NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.187,"smiles":null,"spectrum_id":"CCMSLIB00017318834","spectrum_index":52294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 54.0571 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.155,"smiles":null,"spectrum_id":"CCMSLIB00017318835","spectrum_index":52295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 32.099 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.133,"smiles":null,"spectrum_id":"CCMSLIB00017318836","spectrum_index":52296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 180.0937 Da; putative annotation: N/A; putative formula: C14H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.149,"smiles":null,"spectrum_id":"CCMSLIB00017318837","spectrum_index":52297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoroindoline (delta mass: 42.0154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.087,"smiles":null,"spectrum_id":"CCMSLIB00017318838","spectrum_index":52298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 113.0479 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.203,"smiles":null,"spectrum_id":"CCMSLIB00017318839","spectrum_index":52299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 86.0514 Da; putative annotation: N/A; putative formula: C8H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.117,"smiles":null,"spectrum_id":"CCMSLIB00017318840","spectrum_index":52300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 330.1218 Da; putative annotation: N/A; putative formula: C19H25O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.266,"smiles":null,"spectrum_id":"CCMSLIB00017318841","spectrum_index":52301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 280.1532 Da; putative annotation: N/A; putative formula: C13H20N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.224,"smiles":null,"spectrum_id":"CCMSLIB00017318842","spectrum_index":52302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 68.0328 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.112,"smiles":null,"spectrum_id":"CCMSLIB00017318843","spectrum_index":52303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Corypalmine (delta mass: 18.0666 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.237,"smiles":null,"spectrum_id":"CCMSLIB00017318844","spectrum_index":52304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 94.1643 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.24,"smiles":null,"spectrum_id":"CCMSLIB00017318845","spectrum_index":52305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 40.0396 Da; putative annotation: N/A; putative formula: C2H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.226,"smiles":null,"spectrum_id":"CCMSLIB00017318846","spectrum_index":52306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 100.0967 Da; putative annotation: N/A; putative formula: C5H12N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.266,"smiles":null,"spectrum_id":"CCMSLIB00017318847","spectrum_index":52307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 465.3713 Da; putative annotation: N/A; putative formula: C30H47N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":651.443,"smiles":null,"spectrum_id":"CCMSLIB00017318848","spectrum_index":52308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 11.99 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.102,"smiles":null,"spectrum_id":"CCMSLIB00017318849","spectrum_index":52309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 155.0661 Da; putative annotation: N/A; putative formula: C2H5N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.137,"smiles":null,"spectrum_id":"CCMSLIB00017318850","spectrum_index":52310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole (delta mass: 27.9474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.007,"smiles":null,"spectrum_id":"CCMSLIB00017318851","spectrum_index":52311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 156.1286 Da; putative annotation: N/A; putative formula: C13H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.403,"smiles":null,"spectrum_id":"CCMSLIB00017318852","spectrum_index":52312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 176.0827 Da; putative annotation: N/A; putative formula: C5H13N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.127,"smiles":null,"spectrum_id":"CCMSLIB00017318853","spectrum_index":52313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 60.0389 Da; putative annotation: N/A; putative formula: C6H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.162,"smiles":null,"spectrum_id":"CCMSLIB00017318854","spectrum_index":52314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 58.0495 Da; putative annotation: N/A; putative formula: C2H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.173,"smiles":null,"spectrum_id":"CCMSLIB00017318855","spectrum_index":52315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 330.1316 Da; putative annotation: N/A; putative formula: C15H22O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.301,"smiles":null,"spectrum_id":"CCMSLIB00017318856","spectrum_index":52316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bicine - 40.0 eV (delta mass: 17.0284 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.12,"smiles":null,"spectrum_id":"CCMSLIB00017318857","spectrum_index":52317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 73.0411 Da; putative annotation: N/A; putative formula: H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.138,"smiles":null,"spectrum_id":"CCMSLIB00017318858","spectrum_index":52318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-exo)-3-[3-Methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octane (delta mass: 74.0503 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.242,"smiles":null,"spectrum_id":"CCMSLIB00017318859","spectrum_index":52319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 44.0297 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.088,"smiles":null,"spectrum_id":"CCMSLIB00017318860","spectrum_index":52320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Val-Ile (delta mass: 112.5185 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.689,"smiles":null,"spectrum_id":"CCMSLIB00017318861","spectrum_index":52321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 249.0836 Da; putative annotation: N/A; putative formula: C13H17NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.207,"smiles":null,"spectrum_id":"CCMSLIB00017318862","spectrum_index":52322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of dopamine CollisionEnergy:102040 (delta mass: 526.3116 Da; putative annotation: N/A; putative formula: C32H46O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.398,"smiles":null,"spectrum_id":"CCMSLIB00017318863","spectrum_index":52323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 231.1765 Da; putative annotation: N/A; putative formula: C11H25N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.257,"smiles":null,"spectrum_id":"CCMSLIB00017318864","spectrum_index":52324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 135.0539 Da; putative annotation: N/A; putative formula: C5H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.156,"smiles":null,"spectrum_id":"CCMSLIB00017318865","spectrum_index":52325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muronic acid (delta mass: 92.0626 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.31,"smiles":null,"spectrum_id":"CCMSLIB00017318866","spectrum_index":52326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 57.0413 Da; putative annotation: N/A; putative formula: H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.1,"smiles":null,"spectrum_id":"CCMSLIB00017318867","spectrum_index":52327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-5-hydroxytryptamine (delta mass: 115.0988 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.212,"smiles":null,"spectrum_id":"CCMSLIB00017318868","spectrum_index":52328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 1061.076 Da; putative annotation: N/A; putative formula: C39H35N9O17S5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1283.17,"smiles":null,"spectrum_id":"CCMSLIB00017318869","spectrum_index":52329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin (delta mass: 154.0729 Da; putative annotation: N/A; putative formula: C7H10N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.154,"smiles":null,"spectrum_id":"CCMSLIB00017318870","spectrum_index":52330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 35.61 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.681,"smiles":null,"spectrum_id":"CCMSLIB00017318871","spectrum_index":52331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 420.3542 Da; putative annotation: N/A; putative formula: C26H48N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.43,"smiles":null,"spectrum_id":"CCMSLIB00017318872","spectrum_index":52332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 254.1144 Da; putative annotation: N/A; putative formula: C13H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.284,"smiles":null,"spectrum_id":"CCMSLIB00017318873","spectrum_index":52333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 379.2263 Da; putative annotation: N/A; putative formula: C16H37N5O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.318,"smiles":null,"spectrum_id":"CCMSLIB00017318874","spectrum_index":52334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 396.3241 Da; putative annotation: N/A; putative formula: C24H44O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.361,"smiles":null,"spectrum_id":"CCMSLIB00017318875","spectrum_index":52335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 98.044 Da; putative annotation: N/A; putative formula: H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.103,"smiles":null,"spectrum_id":"CCMSLIB00017318876","spectrum_index":52336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 413.1723 Da; putative annotation: N/A; putative formula: C17H35NO4S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.285,"smiles":null,"spectrum_id":"CCMSLIB00017318877","spectrum_index":52337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 146.0733 Da; putative annotation: N/A; putative formula: C10H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.185,"smiles":null,"spectrum_id":"CCMSLIB00017318878","spectrum_index":52338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metaproterenol (delta mass: 364.0124 Da; putative annotation: N/A; putative formula: C23H11O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.141,"smiles":null,"spectrum_id":"CCMSLIB00017318879","spectrum_index":52339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 229.0662 Da; putative annotation: N/A; putative formula: C13H12NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.168,"smiles":null,"spectrum_id":"CCMSLIB00017318880","spectrum_index":52340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 17.0265 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.144,"smiles":null,"spectrum_id":"CCMSLIB00017318881","spectrum_index":52341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 36.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017318882","spectrum_index":52342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 263.9892 Da; putative annotation: N/A; putative formula: C8H4N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.03,"smiles":null,"spectrum_id":"CCMSLIB00017318883","spectrum_index":52343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 104.0625 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017318884","spectrum_index":52344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 162.0526 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.113,"smiles":null,"spectrum_id":"CCMSLIB00017318885","spectrum_index":52345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 392.0338 Da; putative annotation: N/A; putative formula: C18H12N6O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":731.156,"smiles":null,"spectrum_id":"CCMSLIB00017318886","spectrum_index":52346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 10.0212 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":151.149,"smiles":null,"spectrum_id":"CCMSLIB00017318887","spectrum_index":52347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Butorphanol (delta mass: 16.7465 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.974,"smiles":null,"spectrum_id":"CCMSLIB00017318888","spectrum_index":52348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 108.0572 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017318889","spectrum_index":52349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-[Acetyl(hydroxy)amino]propyl]acetamide (delta mass: 105.0469 Da; putative annotation: N/A; putative formula: CH7N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.155,"smiles":null,"spectrum_id":"CCMSLIB00017318890","spectrum_index":52350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 145.0201 Da; putative annotation: N/A; putative formula: C5H7NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.112,"smiles":null,"spectrum_id":"CCMSLIB00017318891","spectrum_index":52351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 113.0359 Da; putative annotation: N/A; putative formula: C7H3N3O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.117,"smiles":null,"spectrum_id":"CCMSLIB00017318892","spectrum_index":52352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 147.0679 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.123,"smiles":null,"spectrum_id":"CCMSLIB00017318893","spectrum_index":52353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 5.0458 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.126,"smiles":null,"spectrum_id":"CCMSLIB00017318894","spectrum_index":52354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 48.015 Da; putative annotation: N/A; putative formula: C3N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.076,"smiles":null,"spectrum_id":"CCMSLIB00017318895","spectrum_index":52355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 16.0316 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.091,"smiles":null,"spectrum_id":"CCMSLIB00017318896","spectrum_index":52356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 248.0658 Da; putative annotation: N/A; putative formula: C9H8N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.137,"smiles":null,"spectrum_id":"CCMSLIB00017318897","spectrum_index":52357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 184.2188 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.324,"smiles":null,"spectrum_id":"CCMSLIB00017318898","spectrum_index":52358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 298.2508 Da; putative annotation: N/A; putative formula: C18H34O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.311,"smiles":null,"spectrum_id":"CCMSLIB00017318899","spectrum_index":52359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 239.2663 Da; putative annotation: N/A; putative formula: C16H33N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.363,"smiles":null,"spectrum_id":"CCMSLIB00017318900","spectrum_index":52360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 61.9462 Da; putative annotation: N/A; putative formula: H-2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.006,"smiles":null,"spectrum_id":"CCMSLIB00017318901","spectrum_index":52361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 183.169 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.292,"smiles":null,"spectrum_id":"CCMSLIB00017318902","spectrum_index":52362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.,.beta.-Trehalose (delta mass: 448.2437 Da; putative annotation: N/A; putative formula: C22H44N2O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":791.367,"smiles":null,"spectrum_id":"CCMSLIB00017318903","spectrum_index":52363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 16.8845 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.987,"smiles":null,"spectrum_id":"CCMSLIB00017318904","spectrum_index":52364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 158.9946 Da; putative annotation: N/A; putative formula: C8HNO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.06,"smiles":null,"spectrum_id":"CCMSLIB00017318905","spectrum_index":52365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU155510 8-OH-Mirtazapine|8-Hydroxymirtazapine (delta mass: 210.0987 Da; putative annotation: N/A; putative formula: C12H19O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.259,"smiles":null,"spectrum_id":"CCMSLIB00017318906","spectrum_index":52366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 145.0375 Da; putative annotation: N/A; putative formula: C5H7NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.118,"smiles":null,"spectrum_id":"CCMSLIB00017318907","spectrum_index":52367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 140.1207 Da; putative annotation: N/A; putative formula: C9H16O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.207,"smiles":null,"spectrum_id":"CCMSLIB00017318908","spectrum_index":52368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 204.1656 Da; putative annotation: N/A; putative formula: C3H16N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.273,"smiles":null,"spectrum_id":"CCMSLIB00017318909","spectrum_index":52369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid (delta mass: 18.9294 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.0,"smiles":null,"spectrum_id":"CCMSLIB00017318910","spectrum_index":52370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of tabersonine (delta mass: 70.5803 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.771,"smiles":null,"spectrum_id":"CCMSLIB00017318911","spectrum_index":52371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 6-PHOSPHATE (delta mass: 74.0533 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.09,"smiles":null,"spectrum_id":"CCMSLIB00017318912","spectrum_index":52372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 32.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.144,"smiles":null,"spectrum_id":"CCMSLIB00017318913","spectrum_index":52373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 170.1506 Da; putative annotation: N/A; putative formula: C11H22O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.25,"smiles":null,"spectrum_id":"CCMSLIB00017318914","spectrum_index":52374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 373.1672 Da; putative annotation: N/A; putative formula: C16H27N3O5S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.254,"smiles":null,"spectrum_id":"CCMSLIB00017318915","spectrum_index":52375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 326.2052 Da; putative annotation: N/A; putative formula: C14H26N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":687.37,"smiles":null,"spectrum_id":"CCMSLIB00017318916","spectrum_index":52376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 90.0681 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.181,"smiles":null,"spectrum_id":"CCMSLIB00017318917","spectrum_index":52377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 156.1254 Da; putative annotation: N/A; putative formula: C8H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.16,"smiles":null,"spectrum_id":"CCMSLIB00017318918","spectrum_index":52378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 396.3025 Da; putative annotation: N/A; putative formula: C27H40O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.426,"smiles":null,"spectrum_id":"CCMSLIB00017318919","spectrum_index":52379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 305.22 Da; putative annotation: N/A; putative formula: C15H31NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.332,"smiles":null,"spectrum_id":"CCMSLIB00017318920","spectrum_index":52380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylpyridin-4-ylamine (delta mass: 18.0297 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":127.106,"smiles":null,"spectrum_id":"CCMSLIB00017318921","spectrum_index":52381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopentylacetic acid (delta mass: 21.9844 Da; putative annotation: N/A; putative formula: C2H-2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.086,"smiles":null,"spectrum_id":"CCMSLIB00017318922","spectrum_index":52382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 79.9292 Da; putative annotation: N/A; putative formula: HO-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.026,"smiles":null,"spectrum_id":"CCMSLIB00017318923","spectrum_index":52383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 853.5762 Da; putative annotation: N/A; putative formula: C56H75N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1016.64,"smiles":null,"spectrum_id":"CCMSLIB00017318924","spectrum_index":52384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 234.1029 Da; putative annotation: N/A; putative formula: C11H23O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.179,"smiles":null,"spectrum_id":"CCMSLIB00017318925","spectrum_index":52385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 109.0425 Da; putative annotation: N/A; putative formula: C6H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.134,"smiles":null,"spectrum_id":"CCMSLIB00017318926","spectrum_index":52386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glucose-1-phosphate (delta mass: 53.0552 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.092,"smiles":null,"spectrum_id":"CCMSLIB00017318927","spectrum_index":52387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301104 L-Oxonoreleagnine (delta mass: 43.0158 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.102,"smiles":null,"spectrum_id":"CCMSLIB00017318928","spectrum_index":52388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 6.3515 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.5,"smiles":null,"spectrum_id":"CCMSLIB00017318929","spectrum_index":52389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 100.0713 Da; putative annotation: N/A; putative formula: C6H12O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.183,"smiles":null,"spectrum_id":"CCMSLIB00017318930","spectrum_index":52390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 68.0601 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.209,"smiles":null,"spectrum_id":"CCMSLIB00017318931","spectrum_index":52391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3H-Benzo[e]indole-2-carboxylic acid (delta mass: 17.0305 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.101,"smiles":null,"spectrum_id":"CCMSLIB00017318932","spectrum_index":52392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA000492 Retrorsine|beta-Longilobine|(1R,4Z,6R,7S,17R)-4-ethylidene-7-hydroxy-7-(hydroxymethyl)-6-methyl-2,9-dioxa-14-azatricyclo[9.5.1.0^{14,17}]heptadec-11-ene-3,8-dione (delta mass: 18.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.202,"smiles":null,"spectrum_id":"CCMSLIB00017318933","spectrum_index":52393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indirubin-3'-monoxime (delta mass: 74.0831 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.176,"smiles":null,"spectrum_id":"CCMSLIB00017318934","spectrum_index":52394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pertusaric acid (delta mass: 136.0894 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.337,"smiles":null,"spectrum_id":"CCMSLIB00017318935","spectrum_index":52395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 934.4757 Da; putative annotation: N/A; putative formula: C42H74N6O13S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1097.54,"smiles":null,"spectrum_id":"CCMSLIB00017318936","spectrum_index":52396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Glycolylneuraminic acid (delta mass: 122.1975 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.306,"smiles":null,"spectrum_id":"CCMSLIB00017318937","spectrum_index":52397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 22.0036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.168,"smiles":null,"spectrum_id":"CCMSLIB00017318938","spectrum_index":52398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 90.0526 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.154,"smiles":null,"spectrum_id":"CCMSLIB00017318939","spectrum_index":52399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 68.0738 Da; putative annotation: N/A; putative formula: C4H8N2O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.139,"smiles":null,"spectrum_id":"CCMSLIB00017318940","spectrum_index":52400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 215.1079 Da; putative annotation: N/A; putative formula: C10H18NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.235,"smiles":null,"spectrum_id":"CCMSLIB00017318941","spectrum_index":52401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 56.0625 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.148,"smiles":null,"spectrum_id":"CCMSLIB00017318942","spectrum_index":52402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 80.0736 Da; putative annotation: N/A; putative formula: C5H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.145,"smiles":null,"spectrum_id":"CCMSLIB00017318943","spectrum_index":52403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 113.1204 Da; putative annotation: N/A; putative formula: C7H15N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.185,"smiles":null,"spectrum_id":"CCMSLIB00017318944","spectrum_index":52404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 114.0832 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.31,"smiles":null,"spectrum_id":"CCMSLIB00017318945","spectrum_index":52405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 224.047 Da; putative annotation: N/A; putative formula: C14H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.118,"smiles":null,"spectrum_id":"CCMSLIB00017318946","spectrum_index":52406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 247.1428 Da; putative annotation: N/A; putative formula: C12H25NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.219,"smiles":null,"spectrum_id":"CCMSLIB00017318947","spectrum_index":52407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-O-methyltyrosine (delta mass: 113.0845 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.192,"smiles":null,"spectrum_id":"CCMSLIB00017318948","spectrum_index":52408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide a (delta mass: 82.0791 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":675.355,"smiles":null,"spectrum_id":"CCMSLIB00017318949","spectrum_index":52409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 233.0654 Da; putative annotation: N/A; putative formula: C8H15N3OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.146,"smiles":null,"spectrum_id":"CCMSLIB00017318950","spectrum_index":52410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyphenyl)-1H-benzimidazole (delta mass: 116.0349 Da; putative annotation: N/A; putative formula: C2H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.121,"smiles":null,"spectrum_id":"CCMSLIB00017318951","spectrum_index":52411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 40.031 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.258,"smiles":null,"spectrum_id":"CCMSLIB00017318952","spectrum_index":52412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 39.0589 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.13,"smiles":null,"spectrum_id":"CCMSLIB00017318953","spectrum_index":52413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 402.204 Da; putative annotation: N/A; putative formula: C23H30O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":592.273,"smiles":null,"spectrum_id":"CCMSLIB00017318954","spectrum_index":52414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU249103 2-Hydroxyquinoline|1H-quinolin-2-one (delta mass: 99.14 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.2,"smiles":null,"spectrum_id":"CCMSLIB00017318955","spectrum_index":52415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 643.3183 Da; putative annotation: N/A; putative formula: C35H49NO8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":938.421,"smiles":null,"spectrum_id":"CCMSLIB00017318956","spectrum_index":52416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 54.0321 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.191,"smiles":null,"spectrum_id":"CCMSLIB00017318957","spectrum_index":52417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 104.0586 Da; putative annotation: N/A; putative formula: C3H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.13,"smiles":null,"spectrum_id":"CCMSLIB00017318958","spectrum_index":52418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 101.0475 Da; putative annotation: L-Threonine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.097,"smiles":null,"spectrum_id":"CCMSLIB00017318959","spectrum_index":52419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 71.037 Da; putative annotation: beta-Alanine; AIF; CE30; MS2Dec; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.113,"smiles":null,"spectrum_id":"CCMSLIB00017318960","spectrum_index":52420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 159.0681 Da; putative annotation: 4-(Allylamino)benzoic acid; putative formula: C10H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.191,"smiles":null,"spectrum_id":"CCMSLIB00017318961","spectrum_index":52421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 238.2288 Da; putative annotation: 2-Hexyldecanoic acid; putative formula: C16H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.289,"smiles":null,"spectrum_id":"CCMSLIB00017318962","spectrum_index":52422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 296.1761 Da; putative annotation: 1,4a-dimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid; putative formula: C20H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.288,"smiles":null,"spectrum_id":"CCMSLIB00017318963","spectrum_index":52423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 378.2042 Da; putative annotation: N/A; putative formula: C21H30O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":723.374,"smiles":null,"spectrum_id":"CCMSLIB00017318964","spectrum_index":52424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 124.0736 Da; putative annotation: N/A; putative formula: C5H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.212,"smiles":null,"spectrum_id":"CCMSLIB00017318965","spectrum_index":52425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GE-20372-A/B (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.325,"smiles":null,"spectrum_id":"CCMSLIB00017318966","spectrum_index":52426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 246.0659 Da; putative annotation: N/A; putative formula: C10H15O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.152,"smiles":null,"spectrum_id":"CCMSLIB00017318967","spectrum_index":52427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 110.0408 Da; putative annotation: N/A; putative formula: C5H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.164,"smiles":null,"spectrum_id":"CCMSLIB00017318968","spectrum_index":52428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 80.9071 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.004,"smiles":null,"spectrum_id":"CCMSLIB00017318969","spectrum_index":52429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 208.0737 Da; putative annotation: N/A; putative formula: C11H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.186,"smiles":null,"spectrum_id":"CCMSLIB00017318970","spectrum_index":52430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 152.0913 Da; putative annotation: N/A; putative formula: C4H8N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.25,"smiles":null,"spectrum_id":"CCMSLIB00017318971","spectrum_index":52431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 299.1372 Da; putative annotation: N/A; putative formula: C9H18N9OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.213,"smiles":null,"spectrum_id":"CCMSLIB00017318972","spectrum_index":52432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 839.3217 Da; putative annotation: N/A; putative formula: C45H45N9O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1046.41,"smiles":null,"spectrum_id":"CCMSLIB00017318973","spectrum_index":52433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 667.317 Da; putative annotation: N/A; putative formula: C42H45N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":962.419,"smiles":null,"spectrum_id":"CCMSLIB00017318974","spectrum_index":52434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 431.2826 Da; putative annotation: N/A; putative formula: C29H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.359,"smiles":null,"spectrum_id":"CCMSLIB00017318975","spectrum_index":52435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 26.9835 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.107,"smiles":null,"spectrum_id":"CCMSLIB00017318976","spectrum_index":52436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 32.0263 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.133,"smiles":null,"spectrum_id":"CCMSLIB00017318977","spectrum_index":52437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5S,6R)-2-[(3R)-1,7-bis(3,4-dihydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 120.0186 Da; putative annotation: N/A; putative formula: C3N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.241,"smiles":null,"spectrum_id":"CCMSLIB00017318978","spectrum_index":52438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 40.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.217,"smiles":null,"spectrum_id":"CCMSLIB00017318979","spectrum_index":52439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-(Dimethylamino)propyl]piperidine-4-carboxamide (delta mass: 56.0596 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.251,"smiles":null,"spectrum_id":"CCMSLIB00017318980","spectrum_index":52440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 120.9981 Da; putative annotation: N/A; putative formula: C6H3NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.084,"smiles":null,"spectrum_id":"CCMSLIB00017318981","spectrum_index":52441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 330.3667 Da; putative annotation: N/A; putative formula: C25H46O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.5,"smiles":null,"spectrum_id":"CCMSLIB00017318982","spectrum_index":52442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ365701 Cimaterol|2-amino-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile (delta mass: 36.0208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.165,"smiles":null,"spectrum_id":"CCMSLIB00017318983","spectrum_index":52443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 147.105 Da; putative annotation: N/A; putative formula: C10H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.217,"smiles":null,"spectrum_id":"CCMSLIB00017318984","spectrum_index":52444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 87.0259 Da; putative annotation: N/A; putative formula: C2H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.139,"smiles":null,"spectrum_id":"CCMSLIB00017318985","spectrum_index":52445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methylquinolin-8-amine (delta mass: 190.0263 Da; putative annotation: N/A; putative formula: C10H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.118,"smiles":null,"spectrum_id":"CCMSLIB00017318986","spectrum_index":52446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 228.1559 Da; putative annotation: N/A; putative formula: C13H26O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.216,"smiles":null,"spectrum_id":"CCMSLIB00017318987","spectrum_index":52447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 51.9356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.996,"smiles":null,"spectrum_id":"CCMSLIB00017318988","spectrum_index":52448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benz[a]anthracen-1-ol, 8-methoxy-3-methyl- (delta mass: 94.0478 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.17,"smiles":null,"spectrum_id":"CCMSLIB00017318989","spectrum_index":52449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 136.0528 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.097,"smiles":null,"spectrum_id":"CCMSLIB00017318990","spectrum_index":52450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 196.1614 Da; putative annotation: N/A; putative formula: C16H20O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.227,"smiles":null,"spectrum_id":"CCMSLIB00017318991","spectrum_index":52451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 12.0604 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.23,"smiles":null,"spectrum_id":"CCMSLIB00017318992","spectrum_index":52452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 918.2845 Da; putative annotation: N/A; putative formula: C54H52N2O4P2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1099.36,"smiles":null,"spectrum_id":"CCMSLIB00017318993","spectrum_index":52453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 70.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.171,"smiles":null,"spectrum_id":"CCMSLIB00017318994","spectrum_index":52454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 1H-indol-3-ylacetate (delta mass: 27.9944 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.081,"smiles":null,"spectrum_id":"CCMSLIB00017318995","spectrum_index":52455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNITOL - 60.0 eV (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.149,"smiles":null,"spectrum_id":"CCMSLIB00017318996","spectrum_index":52456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 745.6966 Da; putative annotation: N/A; putative formula: C49H87N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":950.782,"smiles":null,"spectrum_id":"CCMSLIB00017318997","spectrum_index":52457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 261.2012 Da; putative annotation: N/A; putative formula: C17H28NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":590.34,"smiles":null,"spectrum_id":"CCMSLIB00017318998","spectrum_index":52458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 206.1543 Da; putative annotation: N/A; putative formula: C11H18N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.313,"smiles":null,"spectrum_id":"CCMSLIB00017318999","spectrum_index":52459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 56.0358 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.123,"smiles":null,"spectrum_id":"CCMSLIB00017319000","spectrum_index":52460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 147.0208 Da; putative annotation: N/A; putative formula: C2H5N5OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.107,"smiles":null,"spectrum_id":"CCMSLIB00017319001","spectrum_index":52461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Desmethylquinidine (delta mass: 256.1029 Da; putative annotation: N/A; putative formula: C7H12N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.278,"smiles":null,"spectrum_id":"CCMSLIB00017319002","spectrum_index":52462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 71.0144 Da; putative annotation: N/A; putative formula: C6HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.252,"smiles":null,"spectrum_id":"CCMSLIB00017319003","spectrum_index":52463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 182.0652 Da; putative annotation: N/A; putative formula: C3H10N4O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.13,"smiles":null,"spectrum_id":"CCMSLIB00017319004","spectrum_index":52464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 279.2572 Da; putative annotation: N/A; putative formula: C18H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":622.381,"smiles":null,"spectrum_id":"CCMSLIB00017319005","spectrum_index":52465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 166.0783 Da; putative annotation: N/A; putative formula: C13H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.144,"smiles":null,"spectrum_id":"CCMSLIB00017319006","spectrum_index":52466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 94.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.374,"smiles":null,"spectrum_id":"CCMSLIB00017319007","spectrum_index":52467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 168.0777 Da; putative annotation: N/A; putative formula: C9H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.19,"smiles":null,"spectrum_id":"CCMSLIB00017319008","spectrum_index":52468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 102.0353 Da; putative annotation: N/A; putative formula: C3H7N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.169,"smiles":null,"spectrum_id":"CCMSLIB00017319009","spectrum_index":52469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 70.0411 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.133,"smiles":null,"spectrum_id":"CCMSLIB00017319010","spectrum_index":52470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 283.2883 Da; putative annotation: N/A; putative formula: C18H37NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.359,"smiles":null,"spectrum_id":"CCMSLIB00017319011","spectrum_index":52471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 76.0163 Da; putative annotation: N/A; putative formula: C2H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.191,"smiles":null,"spectrum_id":"CCMSLIB00017319012","spectrum_index":52472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Phe (delta mass: 99.0683 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.239,"smiles":null,"spectrum_id":"CCMSLIB00017319013","spectrum_index":52473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 56.0716 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.169,"smiles":null,"spectrum_id":"CCMSLIB00017319014","spectrum_index":52474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 143.0977 Da; putative annotation: N/A; putative formula: C6H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.137,"smiles":null,"spectrum_id":"CCMSLIB00017319015","spectrum_index":52475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galantamine (delta mass: 18.0123 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.172,"smiles":null,"spectrum_id":"CCMSLIB00017319016","spectrum_index":52476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]-2-furamide (delta mass: 18.0091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.133,"smiles":null,"spectrum_id":"CCMSLIB00017319017","spectrum_index":52477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00160283-01!1-(8-Quinolinyl)-beta-carboline (delta mass: 17.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.144,"smiles":null,"spectrum_id":"CCMSLIB00017319018","spectrum_index":52478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 75.0321 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.144,"smiles":null,"spectrum_id":"CCMSLIB00017319019","spectrum_index":52479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 680.592 Da; putative annotation: N/A; putative formula: C38H76N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":866.663,"smiles":null,"spectrum_id":"CCMSLIB00017319020","spectrum_index":52480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 22.0353 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.116,"smiles":null,"spectrum_id":"CCMSLIB00017319021","spectrum_index":52481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 83.0374 Da; putative annotation: N/A; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.119,"smiles":null,"spectrum_id":"CCMSLIB00017319022","spectrum_index":52482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 14.0154 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.086,"smiles":null,"spectrum_id":"CCMSLIB00017319023","spectrum_index":52483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 59.045 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.11,"smiles":null,"spectrum_id":"CCMSLIB00017319024","spectrum_index":52484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 132.029 Da; putative annotation: N/A; putative formula: C2H4N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.084,"smiles":null,"spectrum_id":"CCMSLIB00017319025","spectrum_index":52485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 176.0685 Da; putative annotation: N/A; putative formula: C7H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.154,"smiles":null,"spectrum_id":"CCMSLIB00017319026","spectrum_index":52486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephromopsic acid (delta mass: 106.0786 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.332,"smiles":null,"spectrum_id":"CCMSLIB00017319027","spectrum_index":52487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 266.0632 Da; putative annotation: N/A; putative formula: C14H10N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.248,"smiles":null,"spectrum_id":"CCMSLIB00017319028","spectrum_index":52488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acaranoic acid (delta mass: 78.083 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.305,"smiles":null,"spectrum_id":"CCMSLIB00017319029","spectrum_index":52489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 644.3553 Da; putative annotation: N/A; putative formula: C49H44N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.426,"smiles":null,"spectrum_id":"CCMSLIB00017319030","spectrum_index":52490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 173.9742 Da; putative annotation: N/A; putative formula: C12H-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.04,"smiles":null,"spectrum_id":"CCMSLIB00017319031","spectrum_index":52491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 132.0415 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.128,"smiles":null,"spectrum_id":"CCMSLIB00017319032","spectrum_index":52492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 304.1203 Da; putative annotation: N/A; putative formula: C13H17N6OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.185,"smiles":null,"spectrum_id":"CCMSLIB00017319033","spectrum_index":52493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 16.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017319034","spectrum_index":52494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Met (delta mass: 71.0365 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.137,"smiles":null,"spectrum_id":"CCMSLIB00017319035","spectrum_index":52495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 383.2676 Da; putative annotation: N/A; putative formula: C21H37NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.328,"smiles":null,"spectrum_id":"CCMSLIB00017319036","spectrum_index":52496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 329.2118 Da; putative annotation: N/A; putative formula: C17H32NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.398,"smiles":null,"spectrum_id":"CCMSLIB00017319037","spectrum_index":52497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin F (delta mass: 40.0312 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.31,"smiles":null,"spectrum_id":"CCMSLIB00017319038","spectrum_index":52498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 40.0676 Da; putative annotation: N/A; putative formula: C4H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.18,"smiles":null,"spectrum_id":"CCMSLIB00017319039","spectrum_index":52499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 105.1155 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.228,"smiles":null,"spectrum_id":"CCMSLIB00017319040","spectrum_index":52500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meropenem (delta mass: 109.0712 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.23,"smiles":null,"spectrum_id":"CCMSLIB00017319041","spectrum_index":52501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 399.2972 Da; putative annotation: N/A; putative formula: C19H33N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.394,"smiles":null,"spectrum_id":"CCMSLIB00017319042","spectrum_index":52502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 191.0945 Da; putative annotation: N/A; putative formula: C11H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.181,"smiles":null,"spectrum_id":"CCMSLIB00017319043","spectrum_index":52503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 255.2598 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.315,"smiles":null,"spectrum_id":"CCMSLIB00017319044","spectrum_index":52504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 210.9465 Da; putative annotation: N/A; putative formula: CHN5O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.101,"smiles":null,"spectrum_id":"CCMSLIB00017319045","spectrum_index":52505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 283.0906 Da; putative annotation: N/A; putative formula: C12H18N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.177,"smiles":null,"spectrum_id":"CCMSLIB00017319046","spectrum_index":52506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 131.0777 Da; putative annotation: N/A; putative formula: C6H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.154,"smiles":null,"spectrum_id":"CCMSLIB00017319047","spectrum_index":52507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(4-Methoxyphenyl)ethyl]-3-methyl-2-butenamide (delta mass: 119.0807 Da; putative annotation: N/A; putative formula: C2H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.23,"smiles":null,"spectrum_id":"CCMSLIB00017319048","spectrum_index":52508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 64.0156 Da; putative annotation: N/A; putative formula: C2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.102,"smiles":null,"spectrum_id":"CCMSLIB00017319049","spectrum_index":52509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 449.3138 Da; putative annotation: N/A; putative formula: C26H43NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":614.39,"smiles":null,"spectrum_id":"CCMSLIB00017319050","spectrum_index":52510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[2-(Dimethylamino)ethoxy]aniline (delta mass: 36.0456 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.179,"smiles":null,"spectrum_id":"CCMSLIB00017319051","spectrum_index":52511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 570.2699 Da; putative annotation: N/A; putative formula: C30H42N4O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":929.455,"smiles":null,"spectrum_id":"CCMSLIB00017319052","spectrum_index":52512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-L-proline (delta mass: 101.0578 Da; putative annotation: N/A; putative formula: C3H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.144,"smiles":null,"spectrum_id":"CCMSLIB00017319053","spectrum_index":52513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 36.0241 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.11,"smiles":null,"spectrum_id":"CCMSLIB00017319054","spectrum_index":52514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 97.1137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.221,"smiles":null,"spectrum_id":"CCMSLIB00017319055","spectrum_index":52515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 68.061 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.179,"smiles":null,"spectrum_id":"CCMSLIB00017319056","spectrum_index":52516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 936.3256 Da; putative annotation: N/A; putative formula: C36H60N2O24S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1603.55,"smiles":null,"spectrum_id":"CCMSLIB00017319057","spectrum_index":52517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 113.0484 Da; putative annotation: N/A; putative formula: C5H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.108,"smiles":null,"spectrum_id":"CCMSLIB00017319058","spectrum_index":52518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 51.0144 Da; putative annotation: N/A; putative formula: C3HN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.155,"smiles":null,"spectrum_id":"CCMSLIB00017319059","spectrum_index":52519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 88.0162 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.118,"smiles":null,"spectrum_id":"CCMSLIB00017319060","spectrum_index":52520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 622.5103 Da; putative annotation: N/A; putative formula: C37H70N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":808.582,"smiles":null,"spectrum_id":"CCMSLIB00017319061","spectrum_index":52521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 26.0676 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.089,"smiles":null,"spectrum_id":"CCMSLIB00017319062","spectrum_index":52522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-chloro-1H-indole-2-carboxylate (delta mass: 23.0082 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.055,"smiles":null,"spectrum_id":"CCMSLIB00017319063","spectrum_index":52523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 229.095 Da; putative annotation: N/A; putative formula: C10H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.192,"smiles":null,"spectrum_id":"CCMSLIB00017319064","spectrum_index":52524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 162.0627 Da; putative annotation: N/A; putative formula: C7H15PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.171,"smiles":null,"spectrum_id":"CCMSLIB00017319065","spectrum_index":52525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal alkyne (delta mass: 375.3709 Da; putative annotation: N/A; putative formula: C23H45N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.462,"smiles":null,"spectrum_id":"CCMSLIB00017319066","spectrum_index":52526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Ile (delta mass: 224.1161 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.277,"smiles":null,"spectrum_id":"CCMSLIB00017319067","spectrum_index":52527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 55.0875 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.133,"smiles":null,"spectrum_id":"CCMSLIB00017319068","spectrum_index":52528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380167-01!3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015] (delta mass: 128.0683 Da; putative annotation: N/A; putative formula: H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.222,"smiles":null,"spectrum_id":"CCMSLIB00017319069","spectrum_index":52529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 75.0279 Da; putative annotation: N/A; putative formula: CH5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.136,"smiles":null,"spectrum_id":"CCMSLIB00017319070","spectrum_index":52530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Formyltryptophan (delta mass: 26.0159 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.108,"smiles":null,"spectrum_id":"CCMSLIB00017319071","spectrum_index":52531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 197.1484 Da; putative annotation: N/A; putative formula: C6H15N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.207,"smiles":null,"spectrum_id":"CCMSLIB00017319072","spectrum_index":52532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl(4-methoxyphenyl)methanamine (delta mass: 131.0686 Da; putative annotation: N/A; putative formula: C4H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.207,"smiles":null,"spectrum_id":"CCMSLIB00017319073","spectrum_index":52533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 182.0289 Da; putative annotation: N/A; putative formula: C12H7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.126,"smiles":null,"spectrum_id":"CCMSLIB00017319074","spectrum_index":52534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 385.3918 Da; putative annotation: N/A; putative formula: C20H47N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.452,"smiles":null,"spectrum_id":"CCMSLIB00017319075","spectrum_index":52535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 70.0 eV (delta mass: 28.8988 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.985,"smiles":null,"spectrum_id":"CCMSLIB00017319076","spectrum_index":52536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 839.8903 Da; putative annotation: N/A; putative formula: C57H113N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1061.99,"smiles":null,"spectrum_id":"CCMSLIB00017319077","spectrum_index":52537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 64.0519 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.222,"smiles":null,"spectrum_id":"CCMSLIB00017319078","spectrum_index":52538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxy-3-(7-hydroxyheptyl)-6-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 42.0467 Da; putative annotation: N/A; putative formula: C3H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017319079","spectrum_index":52539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 143.0831 Da; putative annotation: N/A; putative formula: C9H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.201,"smiles":null,"spectrum_id":"CCMSLIB00017319080","spectrum_index":52540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 536.1733 Da; putative annotation: N/A; putative formula: C20H36N6O3S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.271,"smiles":null,"spectrum_id":"CCMSLIB00017319081","spectrum_index":52541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 74.052 Da; putative annotation: N/A; putative formula: C7H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.294,"smiles":null,"spectrum_id":"CCMSLIB00017319082","spectrum_index":52542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 224.1163 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.203,"smiles":null,"spectrum_id":"CCMSLIB00017319083","spectrum_index":52543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chanoclavine-I (delta mass: 125.0243 Da; putative annotation: N/A; putative formula: C3H4N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.189,"smiles":null,"spectrum_id":"CCMSLIB00017319084","spectrum_index":52544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 654.5804 Da; putative annotation: N/A; putative formula: C40H78O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":832.667,"smiles":null,"spectrum_id":"CCMSLIB00017319085","spectrum_index":52545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 766.7111 Da; putative annotation: N/A; putative formula: C49H90N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.797,"smiles":null,"spectrum_id":"CCMSLIB00017319086","spectrum_index":52546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 629.3531 Da; putative annotation: N/A; putative formula: C31H55N3O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":810.424,"smiles":null,"spectrum_id":"CCMSLIB00017319087","spectrum_index":52547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 34.1005 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.244,"smiles":null,"spectrum_id":"CCMSLIB00017319088","spectrum_index":52548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 33.989 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.043,"smiles":null,"spectrum_id":"CCMSLIB00017319089","spectrum_index":52549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 35.036 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.118,"smiles":null,"spectrum_id":"CCMSLIB00017319090","spectrum_index":52550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-7-hydroxy-8-(2-hydroxyethyl)-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 56.0628 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.17,"smiles":null,"spectrum_id":"CCMSLIB00017319091","spectrum_index":52551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 70.062 Da; putative annotation: N/A; putative formula: C2H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.227,"smiles":null,"spectrum_id":"CCMSLIB00017319092","spectrum_index":52552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU160501 Levetiracetam|LEVITIRACETAM|(2R)-2-(2-oxopyrrolidin-1-yl)butanamide (delta mass: 27.9885 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.101,"smiles":null,"spectrum_id":"CCMSLIB00017319093","spectrum_index":52553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 180.0289 Da; putative annotation: N/A; putative formula: C6H4N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.131,"smiles":null,"spectrum_id":"CCMSLIB00017319094","spectrum_index":52554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-tetrahydro-6-methoxy-1-oxo-beta-carboline (delta mass: 152.9919 Da; putative annotation: N/A; putative formula: C3H7NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.089,"smiles":null,"spectrum_id":"CCMSLIB00017319095","spectrum_index":52555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 66.0585 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.124,"smiles":null,"spectrum_id":"CCMSLIB00017319096","spectrum_index":52556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 6.4348 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017319097","spectrum_index":52557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 77.0297 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.057,"smiles":null,"spectrum_id":"CCMSLIB00017319098","spectrum_index":52558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 135.0355 Da; putative annotation: N/A; putative formula: C4H9NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.057,"smiles":null,"spectrum_id":"CCMSLIB00017319099","spectrum_index":52559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 40.0358 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.132,"smiles":null,"spectrum_id":"CCMSLIB00017319100","spectrum_index":52560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 248.1051 Da; putative annotation: N/A; putative formula: C14H16O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.228,"smiles":null,"spectrum_id":"CCMSLIB00017319101","spectrum_index":52561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 182.1096 Da; putative annotation: N/A; putative formula: C14H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.18,"smiles":null,"spectrum_id":"CCMSLIB00017319102","spectrum_index":52562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 841.2828 Da; putative annotation: N/A; putative formula: C44H43N9O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":992.343,"smiles":null,"spectrum_id":"CCMSLIB00017319103","spectrum_index":52563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 89.0411 Da; putative annotation: N/A; putative formula: C2H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.127,"smiles":null,"spectrum_id":"CCMSLIB00017319104","spectrum_index":52564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Methoxy-5H-dibenzo[b,f]azepine (delta mass: 188.1165 Da; putative annotation: N/A; putative formula: C8H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.224,"smiles":null,"spectrum_id":"CCMSLIB00017319105","spectrum_index":52565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 512.1776 Da; putative annotation: N/A; putative formula: C38H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":807.31,"smiles":null,"spectrum_id":"CCMSLIB00017319106","spectrum_index":52566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-6H-thieno[2,3-b]pyrrole-5-carboxylic acid (delta mass: 47.9534 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.926,"smiles":null,"spectrum_id":"CCMSLIB00017319107","spectrum_index":52567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Methoxy-5H-dibenzo[b,f]azepine (delta mass: 16.0149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.122,"smiles":null,"spectrum_id":"CCMSLIB00017319108","spectrum_index":52568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N2-Formyl Lysine (delta mass: 134.037 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017319109","spectrum_index":52569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 318.001 Da; putative annotation: N/A; putative formula: C14H6O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.072,"smiles":null,"spectrum_id":"CCMSLIB00017319110","spectrum_index":52570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 268.0377 Da; putative annotation: N/A; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.108,"smiles":null,"spectrum_id":"CCMSLIB00017319111","spectrum_index":52571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 251.1144 Da; putative annotation: N/A; putative formula: C7H18N5O3P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.201,"smiles":null,"spectrum_id":"CCMSLIB00017319112","spectrum_index":52572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 317.1648 Da; putative annotation: N/A; putative formula: C19H19N5)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.251,"smiles":null,"spectrum_id":"CCMSLIB00017319113","spectrum_index":52573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 206.0579 Da; putative annotation: 3,5-Dimethoxy-4-hydroxycinnamic acid; putative formula: C11H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.118,"smiles":null,"spectrum_id":"CCMSLIB00017319114","spectrum_index":52574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 376.2617 Da; putative annotation: (R)-Butaprost (free acid); putative formula: C23H36O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.322,"smiles":null,"spectrum_id":"CCMSLIB00017319115","spectrum_index":52575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 261.1125 Da; putative annotation: Phe-Gly-Gly; putative formula: C13H15N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.209,"smiles":null,"spectrum_id":"CCMSLIB00017319116","spectrum_index":52576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 113.0841 Da; putative annotation: L-(+)-Leucine - 40.0 eV; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.139,"smiles":null,"spectrum_id":"CCMSLIB00017319117","spectrum_index":52577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 312.2661 Da; putative annotation: NCGC00178646-02!2,4-dihydroxyheptadecyl acetate [IIN-based: Match]; putative formula: C19H36O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.326,"smiles":null,"spectrum_id":"CCMSLIB00017319118","spectrum_index":52578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 134.0731 Da; putative annotation: 4-Hydroxynonenal alkyne; putative formula: C9H10O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.149,"smiles":null,"spectrum_id":"CCMSLIB00017319119","spectrum_index":52579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 194.0947 Da; putative annotation: (2E,4E)-3,5,7-Trimethylocta-2,4-dienedioic acid; putative formula: C11H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.207,"smiles":null,"spectrum_id":"CCMSLIB00017319120","spectrum_index":52580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 130.0884 Da; putative annotation: 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine; putative formula: C9H10N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.188,"smiles":null,"spectrum_id":"CCMSLIB00017319121","spectrum_index":52581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 192.078 Da; putative annotation: Sinapyl alcohol; putative formula: C11H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.185,"smiles":null,"spectrum_id":"CCMSLIB00017319122","spectrum_index":52582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine - 40.0 eV (delta mass: 222.1257 Da; putative annotation: (Z)-2-Oct-7-enylpent-2-enedioic acid; putative formula: C13H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.217,"smiles":null,"spectrum_id":"CCMSLIB00017319123","spectrum_index":52583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (delta mass: 70.0286 Da; putative annotation: N/A; putative formula: CH2N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.118,"smiles":null,"spectrum_id":"CCMSLIB00017319124","spectrum_index":52584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 113.0699 Da; putative annotation: N/A; putative formula: C3H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.177,"smiles":null,"spectrum_id":"CCMSLIB00017319125","spectrum_index":52585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 53.0334 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.148,"smiles":null,"spectrum_id":"CCMSLIB00017319126","spectrum_index":52586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 251.2097 Da; putative annotation: N/A; putative formula: C13H25N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.296,"smiles":null,"spectrum_id":"CCMSLIB00017319127","spectrum_index":52587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 55.0783 Da; putative annotation: N/A; putative formula: C4H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.143,"smiles":null,"spectrum_id":"CCMSLIB00017319128","spectrum_index":52588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 28.907 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.999,"smiles":null,"spectrum_id":"CCMSLIB00017319129","spectrum_index":52589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 39.0466 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.091,"smiles":null,"spectrum_id":"CCMSLIB00017319130","spectrum_index":52590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 163.0719 Da; putative annotation: N/A; putative formula: C4H5N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.113,"smiles":null,"spectrum_id":"CCMSLIB00017319131","spectrum_index":52591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 144.0395 Da; putative annotation: N/A; putative formula: C2H4N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.142,"smiles":null,"spectrum_id":"CCMSLIB00017319132","spectrum_index":52592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 71.045 Da; putative annotation: N/A; putative formula: C2H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.126,"smiles":null,"spectrum_id":"CCMSLIB00017319133","spectrum_index":52593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU510509 Tyramine|4-(2-aminoethyl)phenol (delta mass: 283.2478 Da; putative annotation: N/A; putative formula: C13H29N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.339,"smiles":null,"spectrum_id":"CCMSLIB00017319134","spectrum_index":52594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 235.1422 Da; putative annotation: N/A; putative formula: C10H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.228,"smiles":null,"spectrum_id":"CCMSLIB00017319135","spectrum_index":52595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 131.0372 Da; putative annotation: N/A; putative formula: C8H5NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.102,"smiles":null,"spectrum_id":"CCMSLIB00017319136","spectrum_index":52596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-dihydroxy-3-(2-methoxyphenyl)-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidin-4(3H)-one (delta mass: 69.1386 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.31,"smiles":null,"spectrum_id":"CCMSLIB00017319137","spectrum_index":52597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 205.1083 Da; putative annotation: N/A; putative formula: C8H11N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.285,"smiles":null,"spectrum_id":"CCMSLIB00017319138","spectrum_index":52598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00381375-01!(6E)-heptadeca-6,16-diene-1,2,4-triol [IIN-based: Match] (delta mass: 92.0618 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.304,"smiles":null,"spectrum_id":"CCMSLIB00017319139","spectrum_index":52599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 250.1199 Da; putative annotation: N/A; putative formula: C14H18O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.159,"smiles":null,"spectrum_id":"CCMSLIB00017319140","spectrum_index":52600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 54.0544 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.135,"smiles":null,"spectrum_id":"CCMSLIB00017319141","spectrum_index":52601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 114.0389 Da; putative annotation: N/A; putative formula: C3H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.12,"smiles":null,"spectrum_id":"CCMSLIB00017319142","spectrum_index":52602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbazole (delta mass: 116.2137 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.294,"smiles":null,"spectrum_id":"CCMSLIB00017319143","spectrum_index":52603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 41.0329 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.06,"smiles":null,"spectrum_id":"CCMSLIB00017319144","spectrum_index":52604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-, (2R,3S)-rel- (delta mass: 156.0942 Da; putative annotation: N/A; putative formula: C12H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.253,"smiles":null,"spectrum_id":"CCMSLIB00017319145","spectrum_index":52605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methylquinoline-3-carbaldehyde (delta mass: 17.9694 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017319146","spectrum_index":52606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 135.9768 Da; putative annotation: N/A; putative formula: C2H4N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.084,"smiles":null,"spectrum_id":"CCMSLIB00017319147","spectrum_index":52607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 159.0515 Da; putative annotation: N/A; putative formula: C10H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.148,"smiles":null,"spectrum_id":"CCMSLIB00017319148","spectrum_index":52608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.beta.-Homoglutamine (delta mass: 208.183 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.275,"smiles":null,"spectrum_id":"CCMSLIB00017319149","spectrum_index":52609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 51.047 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.128,"smiles":null,"spectrum_id":"CCMSLIB00017319150","spectrum_index":52610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 246.1214 Da; putative annotation: N/A; putative formula: C10H18N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.271,"smiles":null,"spectrum_id":"CCMSLIB00017319151","spectrum_index":52611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 111.0328 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.109,"smiles":null,"spectrum_id":"CCMSLIB00017319152","spectrum_index":52612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 165.0769 Da; putative annotation: N/A; putative formula: C5H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.147,"smiles":null,"spectrum_id":"CCMSLIB00017319153","spectrum_index":52613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 62.0519 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.227,"smiles":null,"spectrum_id":"CCMSLIB00017319154","spectrum_index":52614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z)-3-(1H-Pyrrol-2-ylmethylene)-1,3-dihydro-2H-indol-2-one (delta mass: 251.9325 Da; putative annotation: N/A; putative formula: C7H9PS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.019,"smiles":null,"spectrum_id":"CCMSLIB00017319155","spectrum_index":52615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Phenylindole (delta mass: 385.0808 Da; putative annotation: N/A; putative formula: C20H19NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.177,"smiles":null,"spectrum_id":"CCMSLIB00017319156","spectrum_index":52616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 47.0545 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.12,"smiles":null,"spectrum_id":"CCMSLIB00017319157","spectrum_index":52617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 21.0617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.153,"smiles":null,"spectrum_id":"CCMSLIB00017319158","spectrum_index":52618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 429.3048 Da; putative annotation: N/A; putative formula: C23H39N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":562.381,"smiles":null,"spectrum_id":"CCMSLIB00017319159","spectrum_index":52619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 100.0679 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.321,"smiles":null,"spectrum_id":"CCMSLIB00017319160","spectrum_index":52620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 46.0778 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.164,"smiles":null,"spectrum_id":"CCMSLIB00017319161","spectrum_index":52621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 271.1901 Da; putative annotation: N/A; putative formula: C13H25N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.313,"smiles":null,"spectrum_id":"CCMSLIB00017319162","spectrum_index":52622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 298.1272 Da; putative annotation: N/A; putative formula: C22H19O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.203,"smiles":null,"spectrum_id":"CCMSLIB00017319163","spectrum_index":52623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 15.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.123,"smiles":null,"spectrum_id":"CCMSLIB00017319164","spectrum_index":52624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 230.1415 Da; putative annotation: N/A; putative formula: C14H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.244,"smiles":null,"spectrum_id":"CCMSLIB00017319165","spectrum_index":52625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 112.0658 Da; putative annotation: N/A; putative formula: C10H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.142,"smiles":null,"spectrum_id":"CCMSLIB00017319166","spectrum_index":52626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphylloside (delta mass: 126.032 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.244,"smiles":null,"spectrum_id":"CCMSLIB00017319167","spectrum_index":52627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pheophorbide A (delta mass: 72.0598 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":665.336,"smiles":null,"spectrum_id":"CCMSLIB00017319168","spectrum_index":52628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 115.0464 Da; putative annotation: N/A; putative formula: C5H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.133,"smiles":null,"spectrum_id":"CCMSLIB00017319169","spectrum_index":52629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pindolol (delta mass: 46.0419 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.202,"smiles":null,"spectrum_id":"CCMSLIB00017319170","spectrum_index":52630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 30.0046 Da; putative annotation: N/A; putative formula: CH3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.128,"smiles":null,"spectrum_id":"CCMSLIB00017319171","spectrum_index":52631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 104.0333 Da; putative annotation: N/A; putative formula: CH4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.214,"smiles":null,"spectrum_id":"CCMSLIB00017319172","spectrum_index":52632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 131.0741 Da; putative annotation: N/A; putative formula: C9H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.129,"smiles":null,"spectrum_id":"CCMSLIB00017319173","spectrum_index":52633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H-Pyrazino[1,2-a]indole (delta mass: 43.0157 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017319174","spectrum_index":52634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Pro (delta mass: 43.0061 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.178,"smiles":null,"spectrum_id":"CCMSLIB00017319175","spectrum_index":52635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 231.1277 Da; putative annotation: N/A; putative formula: C7H17N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.188,"smiles":null,"spectrum_id":"CCMSLIB00017319176","spectrum_index":52636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desomorphine (delta mass: 487.3179 Da; putative annotation: N/A; putative formula: C24H46N3O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.482,"smiles":null,"spectrum_id":"CCMSLIB00017319177","spectrum_index":52637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chrysogine (delta mass: 2.0625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.144,"smiles":null,"spectrum_id":"CCMSLIB00017319178","spectrum_index":52638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 210.1994 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.275,"smiles":null,"spectrum_id":"CCMSLIB00017319179","spectrum_index":52639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 486.5504 Da; putative annotation: N/A; putative formula: C36H70O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.637,"smiles":null,"spectrum_id":"CCMSLIB00017319180","spectrum_index":52640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 10.0245 Da; putative annotation: N/A; putative formula: C2H2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.116,"smiles":null,"spectrum_id":"CCMSLIB00017319181","spectrum_index":52641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxyphenethylamine (delta mass: 29.0147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.132,"smiles":null,"spectrum_id":"CCMSLIB00017319182","spectrum_index":52642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopycnarrhine (delta mass: 19.0039 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.106,"smiles":null,"spectrum_id":"CCMSLIB00017319183","spectrum_index":52643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 98.112 Da; putative annotation: N/A; putative formula: C7H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.193,"smiles":null,"spectrum_id":"CCMSLIB00017319184","spectrum_index":52644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 228.0422 Da; putative annotation: N/A; putative formula: C13H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.129,"smiles":null,"spectrum_id":"CCMSLIB00017319185","spectrum_index":52645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 34.0619 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.143,"smiles":null,"spectrum_id":"CCMSLIB00017319186","spectrum_index":52646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 182.1142 Da; putative annotation: N/A; putative formula: C4H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.201,"smiles":null,"spectrum_id":"CCMSLIB00017319187","spectrum_index":52647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-tert-Butyl-2,3,4,9-tetrahydro-1H-carbazol-1-one (delta mass: 45.0507 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.205,"smiles":null,"spectrum_id":"CCMSLIB00017319188","spectrum_index":52648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Phenethylacetamide (delta mass: 86.0369 Da; putative annotation: N/A; putative formula: C4H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017319189","spectrum_index":52649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactulose (delta mass: 241.1761 Da; putative annotation: N/A; putative formula: C8H19N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.3,"smiles":null,"spectrum_id":"CCMSLIB00017319190","spectrum_index":52650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 64.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.212,"smiles":null,"spectrum_id":"CCMSLIB00017319191","spectrum_index":52651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00918 Demethoxycurcumin (delta mass: 120.0413 Da; putative annotation: N/A; putative formula: C4H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.164,"smiles":null,"spectrum_id":"CCMSLIB00017319192","spectrum_index":52652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 152.1206 Da; putative annotation: N/A; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.223,"smiles":null,"spectrum_id":"CCMSLIB00017319193","spectrum_index":52653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000025 Cinchonine (delta mass: 32.0395 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.22,"smiles":null,"spectrum_id":"CCMSLIB00017319194","spectrum_index":52654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 611.3309 Da; putative annotation: N/A; putative formula: C31H49NO11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":954.454,"smiles":null,"spectrum_id":"CCMSLIB00017319195","spectrum_index":52655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 41.0326 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.134,"smiles":null,"spectrum_id":"CCMSLIB00017319196","spectrum_index":52656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2-methyl-.beta.-alanine (delta mass: 101.0338 Da; putative annotation: N/A; putative formula: CH3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.151,"smiles":null,"spectrum_id":"CCMSLIB00017319197","spectrum_index":52657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 61.0029 Da; putative annotation: N/A; putative formula: C3H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.068,"smiles":null,"spectrum_id":"CCMSLIB00017319198","spectrum_index":52658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 50.0155 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.086,"smiles":null,"spectrum_id":"CCMSLIB00017319199","spectrum_index":52659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 334.1785 Da; putative annotation: N/A; putative formula: C12H26N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.27,"smiles":null,"spectrum_id":"CCMSLIB00017319200","spectrum_index":52660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 209.0189 Da; putative annotation: N/A; putative formula: C6H3N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":540.173,"smiles":null,"spectrum_id":"CCMSLIB00017319201","spectrum_index":52661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 268.0372 Da; putative annotation: N/A; putative formula: C15H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.097,"smiles":null,"spectrum_id":"CCMSLIB00017319202","spectrum_index":52662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 172.0486 Da; putative annotation: N/A; putative formula: C6H8N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.219,"smiles":null,"spectrum_id":"CCMSLIB00017319203","spectrum_index":52663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(1H)-Quinolinone, 3,4-dihydro-4-hydroxy-3-methoxy-4-(4-methoxyphenyl)- (delta mass: 9.9958 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.119,"smiles":null,"spectrum_id":"CCMSLIB00017319204","spectrum_index":52664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 184.2028 Da; putative annotation: N/A; putative formula: C10H24N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.299,"smiles":null,"spectrum_id":"CCMSLIB00017319205","spectrum_index":52665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Thr-Ile from NIST14 (delta mass: 113.0737 Da; putative annotation: N/A; putative formula: C6H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.223,"smiles":null,"spectrum_id":"CCMSLIB00017319206","spectrum_index":52666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 83.9766 Da; putative annotation: N/A; putative formula: C3HOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.052,"smiles":null,"spectrum_id":"CCMSLIB00017319207","spectrum_index":52667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 18.007 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.15,"smiles":null,"spectrum_id":"CCMSLIB00017319208","spectrum_index":52668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 52.0314 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.149,"smiles":null,"spectrum_id":"CCMSLIB00017319209","spectrum_index":52669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 161.1418 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.228,"smiles":null,"spectrum_id":"CCMSLIB00017319210","spectrum_index":52670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 516.1271 Da; putative annotation: N/A; putative formula: C20H21N8O7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":855.25,"smiles":null,"spectrum_id":"CCMSLIB00017319211","spectrum_index":52671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 455.2381 Da; putative annotation: N/A; putative formula: C20H33N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.329,"smiles":null,"spectrum_id":"CCMSLIB00017319212","spectrum_index":52672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 457.1807 Da; putative annotation: N/A; putative formula: C28H28NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.267,"smiles":null,"spectrum_id":"CCMSLIB00017319213","spectrum_index":52673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Garcinoic acid (delta mass: 180.0638 Da; putative annotation: N/A; putative formula: C6H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.348,"smiles":null,"spectrum_id":"CCMSLIB00017319214","spectrum_index":52674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 222.0232 Da; putative annotation: N/A; putative formula: C14H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.12,"smiles":null,"spectrum_id":"CCMSLIB00017319215","spectrum_index":52675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 1.9643 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.04,"smiles":null,"spectrum_id":"CCMSLIB00017319216","spectrum_index":52676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 90.0564 Da; putative annotation: N/A; putative formula: C6H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.179,"smiles":null,"spectrum_id":"CCMSLIB00017319217","spectrum_index":52677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 190.1357 Da; putative annotation: N/A; putative formula: C13H18O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.248,"smiles":null,"spectrum_id":"CCMSLIB00017319218","spectrum_index":52678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 18.01 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.175,"smiles":null,"spectrum_id":"CCMSLIB00017319219","spectrum_index":52679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 624.6941 Da; putative annotation: N/A; putative formula: C46H88O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1291.92,"smiles":null,"spectrum_id":"CCMSLIB00017319220","spectrum_index":52680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 413.1471 Da; putative annotation: N/A; putative formula: C14H27N3O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":756.271,"smiles":null,"spectrum_id":"CCMSLIB00017319221","spectrum_index":52681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 70.0414 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.216,"smiles":null,"spectrum_id":"CCMSLIB00017319222","spectrum_index":52682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 213.1008 Da; putative annotation: N/A; putative formula: C11H19NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.161,"smiles":null,"spectrum_id":"CCMSLIB00017319223","spectrum_index":52683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-O-Methylvisamminol (delta mass: 30.0462 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.169,"smiles":null,"spectrum_id":"CCMSLIB00017319224","spectrum_index":52684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 276.1066 Da; putative annotation: N/A; putative formula: C19H17P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":575.271,"smiles":null,"spectrum_id":"CCMSLIB00017319225","spectrum_index":52685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 129.0734 Da; putative annotation: N/A; putative formula: C5H11N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.133,"smiles":null,"spectrum_id":"CCMSLIB00017319226","spectrum_index":52686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 44.026 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.113,"smiles":null,"spectrum_id":"CCMSLIB00017319227","spectrum_index":52687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methylbenzene-1,3-diamine (delta mass: 46.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.122,"smiles":null,"spectrum_id":"CCMSLIB00017319228","spectrum_index":52688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ritodrine (delta mass: 40.0366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.196,"smiles":null,"spectrum_id":"CCMSLIB00017319229","spectrum_index":52689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 518.1214 Da; putative annotation: N/A; putative formula: C21H30N2O7S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":662.169,"smiles":null,"spectrum_id":"CCMSLIB00017319230","spectrum_index":52690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 31.4192 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":163.5,"smiles":null,"spectrum_id":"CCMSLIB00017319231","spectrum_index":52691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 478.1645 Da; putative annotation: N/A; putative formula: C21H30N6OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":659.235,"smiles":null,"spectrum_id":"CCMSLIB00017319232","spectrum_index":52692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 628.1849 Da; putative annotation: N/A; putative formula: C30H36N4O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":850.282,"smiles":null,"spectrum_id":"CCMSLIB00017319233","spectrum_index":52693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 152.0431 Da; putative annotation: N/A; putative formula: C3H8N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.145,"smiles":null,"spectrum_id":"CCMSLIB00017319234","spectrum_index":52694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 778.6282 Da; putative annotation: N/A; putative formula: C55H78N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":959.699,"smiles":null,"spectrum_id":"CCMSLIB00017319235","spectrum_index":52695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 123.1014 Da; putative annotation: N/A; putative formula: C8H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.276,"smiles":null,"spectrum_id":"CCMSLIB00017319236","spectrum_index":52696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of His-Glu (delta mass: 98.0849 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.204,"smiles":null,"spectrum_id":"CCMSLIB00017319237","spectrum_index":52697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[2-(5-methoxy-2-methylindol-3-yl)ethyl](3,4,5-trimethoxyphenyl)carboxamide CollisionEnergy:102040\"\" (delta mass: 76.0308 Da; putative annotation: N/A; putative formula: H5N4O-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.222,"smiles":null,"spectrum_id":"CCMSLIB00017319238","spectrum_index":52698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385769-01!4-[3,5-dihydroxy-7-(4-hydroxyphenyl)heptyl]benzene-1,2-diol (delta mass: 278.1303 Da; putative annotation: N/A; putative formula: C19H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.3,"smiles":null,"spectrum_id":"CCMSLIB00017319239","spectrum_index":52699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 173.08 Da; putative annotation: N/A; putative formula: C6H11N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.156,"smiles":null,"spectrum_id":"CCMSLIB00017319240","spectrum_index":52700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 62.1093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.227,"smiles":null,"spectrum_id":"CCMSLIB00017319241","spectrum_index":52701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.091,"smiles":null,"spectrum_id":"CCMSLIB00017319242","spectrum_index":52702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 129.043 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.103,"smiles":null,"spectrum_id":"CCMSLIB00017319243","spectrum_index":52703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 384.2116 Da; putative annotation: N/A; putative formula: C26H29N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":565.282,"smiles":null,"spectrum_id":"CCMSLIB00017319244","spectrum_index":52704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 314.0851 Da; putative annotation: N/A; putative formula: C17H14O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.156,"smiles":null,"spectrum_id":"CCMSLIB00017319245","spectrum_index":52705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 200.1204 Da; putative annotation: N/A; putative formula: C14H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.181,"smiles":null,"spectrum_id":"CCMSLIB00017319246","spectrum_index":52706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 200.0073 Da; putative annotation: N/A; putative formula: C8H11P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.029,"smiles":null,"spectrum_id":"CCMSLIB00017319247","spectrum_index":52707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 135.1039 Da; putative annotation: N/A; putative formula: C9H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.164,"smiles":null,"spectrum_id":"CCMSLIB00017319248","spectrum_index":52708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 71.0377 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.097,"smiles":null,"spectrum_id":"CCMSLIB00017319249","spectrum_index":52709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 18.0833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.247,"smiles":null,"spectrum_id":"CCMSLIB00017319250","spectrum_index":52710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 276.2456 Da; putative annotation: N/A; putative formula: C19H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.379,"smiles":null,"spectrum_id":"CCMSLIB00017319251","spectrum_index":52711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 225.0519 Da; putative annotation: N/A; putative formula: C7H19NO-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.138,"smiles":null,"spectrum_id":"CCMSLIB00017319252","spectrum_index":52712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 2.0104 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.137,"smiles":null,"spectrum_id":"CCMSLIB00017319253","spectrum_index":52713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00865 alpha-Codeimethine (delta mass: 56.0738 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.249,"smiles":null,"spectrum_id":"CCMSLIB00017319254","spectrum_index":52714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Ile (delta mass: 226.1682 Da; putative annotation: Leu-Ile; putative formula: C12H22N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.302,"smiles":null,"spectrum_id":"CCMSLIB00017319255","spectrum_index":52715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 144.0212 Da; putative annotation: Massbank:AU231203 4-Hydroxycoumarin|4-hydroxychromen-2-one; putative formula: C9H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.118,"smiles":null,"spectrum_id":"CCMSLIB00017319256","spectrum_index":52716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 87.0323 Da; putative annotation: SERINE; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.082,"smiles":null,"spectrum_id":"CCMSLIB00017319257","spectrum_index":52717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 139.0997 Da; putative annotation: 3-Piperidin-4-ylpropanoic acid; putative formula: C8H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.17,"smiles":null,"spectrum_id":"CCMSLIB00017319258","spectrum_index":52718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 176.0322 Da; putative annotation: D-Glucuronic acid; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.113,"smiles":null,"spectrum_id":"CCMSLIB00017319259","spectrum_index":52719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 156.1073 Da; putative annotation: Massbank:BML01293 5-Methyltryptamine; putative formula: C11H12N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.188,"smiles":null,"spectrum_id":"CCMSLIB00017319260","spectrum_index":52720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 99.0687 Da; putative annotation: Massbank:PR100327 5-Aminovaleric acid|5-Aminopentanoate|delta-Aminovalerate|5-Aminopentanoic acid|Homopiperidinic acid; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017319261","spectrum_index":52721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE - 20.0 eV (delta mass: 145.0715 Da; putative annotation: 1-Deoxynojirimycin; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.173,"smiles":null,"spectrum_id":"CCMSLIB00017319262","spectrum_index":52722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 138.1043 Da; putative annotation: (2-Hydroxymethylbicyclo[2.2.1]hept-2-yl)methanol; putative formula: C9H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.191,"smiles":null,"spectrum_id":"CCMSLIB00017319263","spectrum_index":52723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 166.0987 Da; putative annotation: cis-Pinonic acid; putative formula: C10H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.211,"smiles":null,"spectrum_id":"CCMSLIB00017319264","spectrum_index":52724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 270.0788 Da; putative annotation: N/A; putative formula: C13H10N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.16,"smiles":null,"spectrum_id":"CCMSLIB00017319265","spectrum_index":52725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Homatropin (delta mass: 53.0263 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.186,"smiles":null,"spectrum_id":"CCMSLIB00017319266","spectrum_index":52726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 429.2153 Da; putative annotation: N/A; putative formula: C24H31NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":774.385,"smiles":null,"spectrum_id":"CCMSLIB00017319267","spectrum_index":52727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Ser-Leu from NIST14 (delta mass: 114.0883 Da; putative annotation: N/A; putative formula: C7H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.222,"smiles":null,"spectrum_id":"CCMSLIB00017319268","spectrum_index":52728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 15.9946 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.045,"smiles":null,"spectrum_id":"CCMSLIB00017319269","spectrum_index":52729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Asp (delta mass: 478.1192 Da; putative annotation: N/A; putative formula: C17H26N4O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":727.191,"smiles":null,"spectrum_id":"CCMSLIB00017319270","spectrum_index":52730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 187.0996 Da; putative annotation: N/A; putative formula: C12H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.223,"smiles":null,"spectrum_id":"CCMSLIB00017319271","spectrum_index":52731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 161.0402 Da; putative annotation: N/A; putative formula: H3N9O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.116,"smiles":null,"spectrum_id":"CCMSLIB00017319272","spectrum_index":52732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 57.0556 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.147,"smiles":null,"spectrum_id":"CCMSLIB00017319273","spectrum_index":52733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 96.094 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":264.196,"smiles":null,"spectrum_id":"CCMSLIB00017319274","spectrum_index":52734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Amino-1H-benzimidazol-2-yl)-1-propanol (delta mass: 219.2126 Da; putative annotation: N/A; putative formula: C14H25N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.326,"smiles":null,"spectrum_id":"CCMSLIB00017319275","spectrum_index":52735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 39.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.139,"smiles":null,"spectrum_id":"CCMSLIB00017319276","spectrum_index":52736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 18.0829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.206,"smiles":null,"spectrum_id":"CCMSLIB00017319277","spectrum_index":52737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 471.2009 Da; putative annotation: N/A; putative formula: C27H30N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.292,"smiles":null,"spectrum_id":"CCMSLIB00017319278","spectrum_index":52738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 580.5682 Da; putative annotation: N/A; putative formula: C40H72N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.665,"smiles":null,"spectrum_id":"CCMSLIB00017319279","spectrum_index":52739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 188.1203 Da; putative annotation: N/A; putative formula: C13H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.165,"smiles":null,"spectrum_id":"CCMSLIB00017319280","spectrum_index":52740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinidine 1'-oxide (delta mass: 14.023 Da; putative annotation: N/A; putative formula: H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.209,"smiles":null,"spectrum_id":"CCMSLIB00017319281","spectrum_index":52741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 179.0926 Da; putative annotation: N/A; putative formula: C10H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.205,"smiles":null,"spectrum_id":"CCMSLIB00017319282","spectrum_index":52742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 72.0205 Da; putative annotation: N/A; putative formula: C3H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":577.197,"smiles":null,"spectrum_id":"CCMSLIB00017319283","spectrum_index":52743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 206.0427 Da; putative annotation: N/A; putative formula: C7H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.129,"smiles":null,"spectrum_id":"CCMSLIB00017319284","spectrum_index":52744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 10.0351 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.132,"smiles":null,"spectrum_id":"CCMSLIB00017319285","spectrum_index":52745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin F (delta mass: 98.0408 Da; putative annotation: N/A; putative formula: C4H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.32,"smiles":null,"spectrum_id":"CCMSLIB00017319286","spectrum_index":52746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 56.0657 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.147,"smiles":null,"spectrum_id":"CCMSLIB00017319287","spectrum_index":52747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 58.013 Da; putative annotation: N/A; putative formula: CH2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.084,"smiles":null,"spectrum_id":"CCMSLIB00017319288","spectrum_index":52748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 219.1507 Da; putative annotation: N/A; putative formula: C9H22N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.221,"smiles":null,"spectrum_id":"CCMSLIB00017319289","spectrum_index":52749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Maltotetraose from NIST14 (delta mass: 344.2195 Da; putative annotation: N/A; putative formula: C18H32O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1011.45,"smiles":null,"spectrum_id":"CCMSLIB00017319290","spectrum_index":52750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 710.3058 Da; putative annotation: N/A; putative formula: C30H46N8O10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":890.371,"smiles":null,"spectrum_id":"CCMSLIB00017319291","spectrum_index":52751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piericidin A (delta mass: 40.9393 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.219,"smiles":null,"spectrum_id":"CCMSLIB00017319292","spectrum_index":52752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 135.0319 Da; putative annotation: N/A; putative formula: C7H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.129,"smiles":null,"spectrum_id":"CCMSLIB00017319293","spectrum_index":52753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 460.4631 Da; putative annotation: N/A; putative formula: C28H56N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.555,"smiles":null,"spectrum_id":"CCMSLIB00017319294","spectrum_index":52754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin D (delta mass: 86.0586 Da; putative annotation: N/A; putative formula: C2H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":515.322,"smiles":null,"spectrum_id":"CCMSLIB00017319295","spectrum_index":52755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 23.1098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.269,"smiles":null,"spectrum_id":"CCMSLIB00017319296","spectrum_index":52756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 64.0679 Da; putative annotation: N/A; putative formula: C6H8O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.144,"smiles":null,"spectrum_id":"CCMSLIB00017319297","spectrum_index":52757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 67.0786 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.18,"smiles":null,"spectrum_id":"CCMSLIB00017319298","spectrum_index":52758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 239.0897 Da; putative annotation: N/A; putative formula: C12H18NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.151,"smiles":null,"spectrum_id":"CCMSLIB00017319299","spectrum_index":52759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 94.1351 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.195,"smiles":null,"spectrum_id":"CCMSLIB00017319300","spectrum_index":52760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 197.0897 Da; putative annotation: N/A; putative formula: C10H17NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.155,"smiles":null,"spectrum_id":"CCMSLIB00017319301","spectrum_index":52761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Benzenediol, 5-methyl-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]- (delta mass: 821.4697 Da; putative annotation: N/A; putative formula: C52H71NOS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1080.64,"smiles":null,"spectrum_id":"CCMSLIB00017319302","spectrum_index":52762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14 (delta mass: 146.9806 Da; putative annotation: N/A; putative formula: C3HNO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.041,"smiles":null,"spectrum_id":"CCMSLIB00017319303","spectrum_index":52763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 86.186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.34,"smiles":null,"spectrum_id":"CCMSLIB00017319304","spectrum_index":52764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 38.0184 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.12,"smiles":null,"spectrum_id":"CCMSLIB00017319305","spectrum_index":52765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 128.0464 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.143,"smiles":null,"spectrum_id":"CCMSLIB00017319306","spectrum_index":52766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 287.3187 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.389,"smiles":null,"spectrum_id":"CCMSLIB00017319307","spectrum_index":52767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methyl indole CollisionEnergy:102040 (delta mass: 196.0412 Da; putative annotation: N/A; putative formula: C6H14O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.122,"smiles":null,"spectrum_id":"CCMSLIB00017319308","spectrum_index":52768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Tyr (delta mass: 113.0808 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.189,"smiles":null,"spectrum_id":"CCMSLIB00017319309","spectrum_index":52769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 168.0424 Da; putative annotation: N/A; putative formula: C8H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.16,"smiles":null,"spectrum_id":"CCMSLIB00017319310","spectrum_index":52770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA270108 10,11-trans-Dihydroxy-10,11-dihydrocarbamazepine|(5S,6S)-5,6-bis(oxidanyl)-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 132.0788 Da; putative annotation: N/A; putative formula: C6H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.186,"smiles":null,"spectrum_id":"CCMSLIB00017319311","spectrum_index":52771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R)-7-Aminocephalosporanic acid (delta mass: 391.1748 Da; putative annotation: N/A; putative formula: C12H25N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.229,"smiles":null,"spectrum_id":"CCMSLIB00017319312","spectrum_index":52772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 116.0113 Da; putative annotation: N/A; putative formula: C4H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.097,"smiles":null,"spectrum_id":"CCMSLIB00017319313","spectrum_index":52773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 92.0496 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.155,"smiles":null,"spectrum_id":"CCMSLIB00017319314","spectrum_index":52774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[(3,4,5-Trimethoxyphenyl)methyl]pyridin-2-amine (delta mass: 50.0365 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.176,"smiles":null,"spectrum_id":"CCMSLIB00017319315","spectrum_index":52775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 109.1254 Da; putative annotation: N/A; putative formula: C8H15NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.191,"smiles":null,"spectrum_id":"CCMSLIB00017319316","spectrum_index":52776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 228.2202 Da; putative annotation: N/A; putative formula: C13H28N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.26,"smiles":null,"spectrum_id":"CCMSLIB00017319317","spectrum_index":52777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 423.357 Da; putative annotation: N/A; putative formula: C23H45N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":586.417,"smiles":null,"spectrum_id":"CCMSLIB00017319318","spectrum_index":52778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2-dihydroquinoline (delta mass: 119.0365 Da; putative annotation: N/A; putative formula: CH6N5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.164,"smiles":null,"spectrum_id":"CCMSLIB00017319319","spectrum_index":52779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087704 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 169.1108 Da; putative annotation: N/A; putative formula: C9H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.176,"smiles":null,"spectrum_id":"CCMSLIB00017319320","spectrum_index":52780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO00512 Isatin (delta mass: 203.1088 Da; putative annotation: N/A; putative formula: C8H17N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.148,"smiles":null,"spectrum_id":"CCMSLIB00017319321","spectrum_index":52781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"GLUCONO-1,5-LACTONE\"\" (delta mass: 135.0683 Da; putative annotation: N/A; putative formula: C8H9NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.123,"smiles":null,"spectrum_id":"CCMSLIB00017319322","spectrum_index":52782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbamazepine 10,11-epoxide (delta mass: 60.0748 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.172,"smiles":null,"spectrum_id":"CCMSLIB00017319323","spectrum_index":52783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 110.109 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.18,"smiles":null,"spectrum_id":"CCMSLIB00017319324","spectrum_index":52784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Aminobutyl)urea (delta mass: 171.1013 Da; putative annotation: N/A; putative formula: C7H13N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.214,"smiles":null,"spectrum_id":"CCMSLIB00017319325","spectrum_index":52785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 69.0575 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.16,"smiles":null,"spectrum_id":"CCMSLIB00017319326","spectrum_index":52786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 330.0573 Da; putative annotation: N/A; putative formula: C18H18S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.133,"smiles":null,"spectrum_id":"CCMSLIB00017319327","spectrum_index":52787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 90.043 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.207,"smiles":null,"spectrum_id":"CCMSLIB00017319328","spectrum_index":52788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 114.031 Da; putative annotation: N/A; putative formula: C5H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.206,"smiles":null,"spectrum_id":"CCMSLIB00017319329","spectrum_index":52789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 126.0839 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.259,"smiles":null,"spectrum_id":"CCMSLIB00017319330","spectrum_index":52790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.alpha.-L-fucopyranosyl)-D-glucopyranose (delta mass: 185.0649 Da; putative annotation: N/A; putative formula: C4H7N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.22,"smiles":null,"spectrum_id":"CCMSLIB00017319331","spectrum_index":52791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 171.0686 Da; putative annotation: N/A; putative formula: C11H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":514.192,"smiles":null,"spectrum_id":"CCMSLIB00017319332","spectrum_index":52792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 144.0575 Da; putative annotation: N/A; putative formula: C10H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.144,"smiles":null,"spectrum_id":"CCMSLIB00017319333","spectrum_index":52793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 172.9239 Da; putative annotation: N/A; putative formula: C4H-1NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.036,"smiles":null,"spectrum_id":"CCMSLIB00017319334","spectrum_index":52794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 69.0397 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.089,"smiles":null,"spectrum_id":"CCMSLIB00017319335","spectrum_index":52795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 1119.6666 Da; putative annotation: N/A; putative formula: C53H85N17O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1344.78,"smiles":null,"spectrum_id":"CCMSLIB00017319336","spectrum_index":52796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 111.0565 Da; putative annotation: N/A; putative formula: C3H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.147,"smiles":null,"spectrum_id":"CCMSLIB00017319337","spectrum_index":52797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 135.0456 Da; putative annotation: N/A; putative formula: C4H10NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.105,"smiles":null,"spectrum_id":"CCMSLIB00017319338","spectrum_index":52798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Monoacetylmorphine (delta mass: 97.0602 Da; putative annotation: N/A; putative formula: C4H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.215,"smiles":null,"spectrum_id":"CCMSLIB00017319339","spectrum_index":52799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 193.0613 Da; putative annotation: N/A; putative formula: C5H12N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.2,"smiles":null,"spectrum_id":"CCMSLIB00017319340","spectrum_index":52800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 370.6936 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.817,"smiles":null,"spectrum_id":"CCMSLIB00017319341","spectrum_index":52801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 127.1348 Da; putative annotation: N/A; putative formula: C8H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.263,"smiles":null,"spectrum_id":"CCMSLIB00017319342","spectrum_index":52802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-methylquinoline-2-carboxylic acid CollisionEnergy:205060 (delta mass: 175.0633 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.134,"smiles":null,"spectrum_id":"CCMSLIB00017319343","spectrum_index":52803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Hydroxyethyl)-2-imidazolidinethione (delta mass: 26.0145 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.073,"smiles":null,"spectrum_id":"CCMSLIB00017319344","spectrum_index":52804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 172.9523 Da; putative annotation: N/A; putative formula: C5H4NPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.038,"smiles":null,"spectrum_id":"CCMSLIB00017319345","spectrum_index":52805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 97.1827 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.263,"smiles":null,"spectrum_id":"CCMSLIB00017319346","spectrum_index":52806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 48.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.122,"smiles":null,"spectrum_id":"CCMSLIB00017319347","spectrum_index":52807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,7-Dimethoxy-2-naphthoic acid (delta mass: 30.0464 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.127,"smiles":null,"spectrum_id":"CCMSLIB00017319348","spectrum_index":52808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 65.0631 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.187,"smiles":null,"spectrum_id":"CCMSLIB00017319349","spectrum_index":52809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 74.0359 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.128,"smiles":null,"spectrum_id":"CCMSLIB00017319350","spectrum_index":52810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin D (delta mass: 58.0417 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.305,"smiles":null,"spectrum_id":"CCMSLIB00017319351","spectrum_index":52811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Pro (delta mass: 57.021 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.176,"smiles":null,"spectrum_id":"CCMSLIB00017319352","spectrum_index":52812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 194.0427 Da; putative annotation: N/A; putative formula: C6H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.207,"smiles":null,"spectrum_id":"CCMSLIB00017319353","spectrum_index":52813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 156.1276 Da; putative annotation: N/A; putative formula: C8H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.37,"smiles":null,"spectrum_id":"CCMSLIB00017319354","spectrum_index":52814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 23.1211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.121,"smiles":null,"spectrum_id":"CCMSLIB00017319355","spectrum_index":52815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-3-indoleacetic acid (delta mass: 41.0117 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.093,"smiles":null,"spectrum_id":"CCMSLIB00017319356","spectrum_index":52816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 59.0372 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.165,"smiles":null,"spectrum_id":"CCMSLIB00017319357","spectrum_index":52817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 677.2846 Da; putative annotation: N/A; putative formula: C38H47NO6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":884.371,"smiles":null,"spectrum_id":"CCMSLIB00017319358","spectrum_index":52818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 100.0749 Da; putative annotation: N/A; putative formula: C3H8N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.25,"smiles":null,"spectrum_id":"CCMSLIB00017319359","spectrum_index":52819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 457.4508 Da; putative annotation: N/A; putative formula: C29H55N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.6,"smiles":null,"spectrum_id":"CCMSLIB00017319360","spectrum_index":52820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:FIO01040 Hexahydrocurcumin (delta mass: 58.1512 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.331,"smiles":null,"spectrum_id":"CCMSLIB00017319361","spectrum_index":52821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Piperidinyl)benzamide (delta mass: 32.0148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017319362","spectrum_index":52822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 779.3061 Da; putative annotation: N/A; putative formula: C44H49N3O6S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1122.43,"smiles":null,"spectrum_id":"CCMSLIB00017319363","spectrum_index":52823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6,8-Trimethylquinolin-2-ol (delta mass: 25.0577 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.165,"smiles":null,"spectrum_id":"CCMSLIB00017319364","spectrum_index":52824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 130.0606 Da; putative annotation: N/A; putative formula: C2H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.184,"smiles":null,"spectrum_id":"CCMSLIB00017319365","spectrum_index":52825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 119.0394 Da; putative annotation: N/A; putative formula: C4H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.216,"smiles":null,"spectrum_id":"CCMSLIB00017319366","spectrum_index":52826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LNnT (delta mass: 202.0942 Da; putative annotation: N/A; putative formula: C10H19PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":910.35,"smiles":null,"spectrum_id":"CCMSLIB00017319367","spectrum_index":52827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 127.0631 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.165,"smiles":null,"spectrum_id":"CCMSLIB00017319368","spectrum_index":52828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 61.9581 Da; putative annotation: N/A; putative formula: H-1O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.98,"smiles":null,"spectrum_id":"CCMSLIB00017319369","spectrum_index":52829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Viridicatol (delta mass: 95.0583 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.139,"smiles":null,"spectrum_id":"CCMSLIB00017319370","spectrum_index":52830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 164.1468 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.223,"smiles":null,"spectrum_id":"CCMSLIB00017319371","spectrum_index":52831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 80.0286 Da; putative annotation: N/A; putative formula: C5H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.157,"smiles":null,"spectrum_id":"CCMSLIB00017319372","spectrum_index":52832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-isoleucine (delta mass: 40.0314 Da; putative annotation: N/A; putative formula: C3H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.128,"smiles":null,"spectrum_id":"CCMSLIB00017319373","spectrum_index":52833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydrospiro[indole-3,3'-pyrrolidine]-2-one (delta mass: 179.0873 Da; putative annotation: N/A; putative formula: C9H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.19,"smiles":null,"spectrum_id":"CCMSLIB00017319374","spectrum_index":52834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 323.1846 Da; putative annotation: N/A; putative formula: C16H25N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.244,"smiles":null,"spectrum_id":"CCMSLIB00017319375","spectrum_index":52835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 79.9953 Da; putative annotation: N/A; putative formula: C3HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.092,"smiles":null,"spectrum_id":"CCMSLIB00017319376","spectrum_index":52836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 92.0262 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.139,"smiles":null,"spectrum_id":"CCMSLIB00017319377","spectrum_index":52837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 214.0632 Da; putative annotation: N/A; putative formula: C8H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.144,"smiles":null,"spectrum_id":"CCMSLIB00017319378","spectrum_index":52838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ359201 Clenbuterol|1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethanol (delta mass: 53.1771 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.264,"smiles":null,"spectrum_id":"CCMSLIB00017319379","spectrum_index":52839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 1058.5503 Da; putative annotation: N/A; putative formula: C60H66N16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1239.62,"smiles":null,"spectrum_id":"CCMSLIB00017319380","spectrum_index":52840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 329.9196 Da; putative annotation: N/A; putative formula: C9H14O-1S7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.0,"smiles":null,"spectrum_id":"CCMSLIB00017319381","spectrum_index":52841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 102.0544 Da; putative annotation: N/A; putative formula: C2H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.12,"smiles":null,"spectrum_id":"CCMSLIB00017319382","spectrum_index":52842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 92.0629 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.112,"smiles":null,"spectrum_id":"CCMSLIB00017319383","spectrum_index":52843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 200.0815 Da; putative annotation: N/A; putative formula: C8H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.163,"smiles":null,"spectrum_id":"CCMSLIB00017319384","spectrum_index":52844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 114.0837 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.17,"smiles":null,"spectrum_id":"CCMSLIB00017319385","spectrum_index":52845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-L-isoleucine (delta mass: 168.117 Da; putative annotation: N/A; putative formula: C10H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.214,"smiles":null,"spectrum_id":"CCMSLIB00017319386","spectrum_index":52846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 209.1262 Da; putative annotation: N/A; putative formula: C5H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.166,"smiles":null,"spectrum_id":"CCMSLIB00017319387","spectrum_index":52847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 263.2309 Da; putative annotation: N/A; putative formula: C16H29N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.4,"smiles":null,"spectrum_id":"CCMSLIB00017319388","spectrum_index":52848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.139,"smiles":null,"spectrum_id":"CCMSLIB00017319389","spectrum_index":52849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE (delta mass: 170.1428 Da; putative annotation: N/A; putative formula: C9H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.245,"smiles":null,"spectrum_id":"CCMSLIB00017319390","spectrum_index":52850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 43.0152 Da; putative annotation: N/A; putative formula: HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.12,"smiles":null,"spectrum_id":"CCMSLIB00017319391","spectrum_index":52851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 56.9891 Da; putative annotation: N/A; putative formula: N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.07,"smiles":null,"spectrum_id":"CCMSLIB00017319392","spectrum_index":52852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydropyran-4-one (delta mass: 85.0757 Da; putative annotation: N/A; putative formula: C2H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.188,"smiles":null,"spectrum_id":"CCMSLIB00017319393","spectrum_index":52853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 124.1253 Da; putative annotation: N/A; putative formula: C9H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.222,"smiles":null,"spectrum_id":"CCMSLIB00017319394","spectrum_index":52854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 203.0371 Da; putative annotation: N/A; putative formula: C14H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.092,"smiles":null,"spectrum_id":"CCMSLIB00017319395","spectrum_index":52855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 269.1265 Da; putative annotation: N/A; putative formula: C13H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.213,"smiles":null,"spectrum_id":"CCMSLIB00017319396","spectrum_index":52856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-3-hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one (delta mass: 81.0779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.15,"smiles":null,"spectrum_id":"CCMSLIB00017319397","spectrum_index":52857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 325.153 Da; putative annotation: N/A; putative formula: C16H23NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.229,"smiles":null,"spectrum_id":"CCMSLIB00017319398","spectrum_index":52858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 65.0474 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":396.201,"smiles":null,"spectrum_id":"CCMSLIB00017319399","spectrum_index":52859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 93.0787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.233,"smiles":null,"spectrum_id":"CCMSLIB00017319400","spectrum_index":52860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 478.1478 Da; putative annotation: N/A; putative formula: C18H23N8O6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":700.245,"smiles":null,"spectrum_id":"CCMSLIB00017319401","spectrum_index":52861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENETHYLAMINE (delta mass: 402.2242 Da; putative annotation: N/A; putative formula: C25H30N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.321,"smiles":null,"spectrum_id":"CCMSLIB00017319402","spectrum_index":52862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 180.1152 Da; putative annotation: N/A; putative formula: C11H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.212,"smiles":null,"spectrum_id":"CCMSLIB00017319403","spectrum_index":52863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-3-methoxyamphetamine (delta mass: 97.0413 Da; putative annotation: N/A; putative formula: C2H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.159,"smiles":null,"spectrum_id":"CCMSLIB00017319404","spectrum_index":52864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 49.1024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.277,"smiles":null,"spectrum_id":"CCMSLIB00017319405","spectrum_index":52865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 92.0487 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.15,"smiles":null,"spectrum_id":"CCMSLIB00017319406","spectrum_index":52866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 120.0651 Da; putative annotation: N/A; putative formula: C2H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.146,"smiles":null,"spectrum_id":"CCMSLIB00017319407","spectrum_index":52867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-{4,5-dimethoxy-2-[2-(methoxycarbonylamino)ethyl]phenyl}(3,4-dimethoxyphenyl) carboxamide CollisionEnergy:205060\"\" (delta mass: 62.0618 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.243,"smiles":null,"spectrum_id":"CCMSLIB00017319408","spectrum_index":52868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 271.1051 Da; putative annotation: N/A; putative formula: C12H17NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.153,"smiles":null,"spectrum_id":"CCMSLIB00017319409","spectrum_index":52869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-nitro-1H-indole-2-carboxylate (delta mass: 56.0293 Da; putative annotation: N/A; putative formula: C3H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.101,"smiles":null,"spectrum_id":"CCMSLIB00017319410","spectrum_index":52870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 30.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.118,"smiles":null,"spectrum_id":"CCMSLIB00017319411","spectrum_index":52871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 41.1928 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.294,"smiles":null,"spectrum_id":"CCMSLIB00017319412","spectrum_index":52872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 94.0782 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.164,"smiles":null,"spectrum_id":"CCMSLIB00017319413","spectrum_index":52873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 96.0209 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.107,"smiles":null,"spectrum_id":"CCMSLIB00017319414","spectrum_index":52874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 204.0636 Da; putative annotation: N/A; putative formula: C8H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.187,"smiles":null,"spectrum_id":"CCMSLIB00017319415","spectrum_index":52875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [1]Benzothiopyrano[4,3-b]indole, 6,11-dihydro- (delta mass: 85.0896 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.158,"smiles":null,"spectrum_id":"CCMSLIB00017319416","spectrum_index":52876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 35.0734 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.175,"smiles":null,"spectrum_id":"CCMSLIB00017319417","spectrum_index":52877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 23.0485 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.129,"smiles":null,"spectrum_id":"CCMSLIB00017319418","spectrum_index":52878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU161803 Ecgonine-methyl-ester (EME)|AC1L9FBF|methyl (3S,4R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate (delta mass: 165.0791 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.207,"smiles":null,"spectrum_id":"CCMSLIB00017319419","spectrum_index":52879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 314.1519 Da; putative annotation: Gibberellin A4; putative formula: C19H22O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.311,"smiles":null,"spectrum_id":"CCMSLIB00017319420","spectrum_index":52880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 83.0367 Da; putative annotation: L-Homoserine lactone; putative formula: C4H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.134,"smiles":null,"spectrum_id":"CCMSLIB00017319421","spectrum_index":52881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 188.0961 Da; putative annotation: Phenylethylmalonamide; putative formula: C11H12N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.203,"smiles":null,"spectrum_id":"CCMSLIB00017319422","spectrum_index":52882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 87.0324 Da; putative annotation: Massbank:RP000701 L-Serine|(2S)-2-amino-3-hydroxypropanoic acid; putative formula: C3H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.103,"smiles":null,"spectrum_id":"CCMSLIB00017319423","spectrum_index":52883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 112.0526 Da; putative annotation: DL-Mevalonic acid lactone; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.144,"smiles":null,"spectrum_id":"CCMSLIB00017319424","spectrum_index":52884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Cellobiose from NIST14 (delta mass: 152.1217 Da; putative annotation: (R)-(+)-Citronellic acid; putative formula: C10H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.245,"smiles":null,"spectrum_id":"CCMSLIB00017319425","spectrum_index":52885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5E)-Heptadeca-5,16-diene-1,2,4-triol (delta mass: 94.042 Da; putative annotation: SORBATE; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.284,"smiles":null,"spectrum_id":"CCMSLIB00017319426","spectrum_index":52886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 99.0688 Da; putative annotation: L-Valine; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.139,"smiles":null,"spectrum_id":"CCMSLIB00017319427","spectrum_index":52887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 30.0 eV (delta mass: 281.2713 Da; putative annotation: Palmitoyl Ethanolamide; putative formula: C18H35NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.347,"smiles":null,"spectrum_id":"CCMSLIB00017319428","spectrum_index":52888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 244.1143 Da; putative annotation: 1-Dehydroperuvinine; putative formula: C15H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.19,"smiles":null,"spectrum_id":"CCMSLIB00017319429","spectrum_index":52889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 144.0425 Da; putative annotation: Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017319430","spectrum_index":52890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 111.0376 Da; putative annotation: N/A; putative formula: C4H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.06,"smiles":null,"spectrum_id":"CCMSLIB00017319431","spectrum_index":52891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-His (delta mass: 113.0842 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.188,"smiles":null,"spectrum_id":"CCMSLIB00017319432","spectrum_index":52892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 287.2213 Da; putative annotation: N/A; putative formula: C14H29N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.37,"smiles":null,"spectrum_id":"CCMSLIB00017319433","spectrum_index":52893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 185.1052 Da; putative annotation: N/A; putative formula: C9H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.207,"smiles":null,"spectrum_id":"CCMSLIB00017319434","spectrum_index":52894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-8a-hydroxy-1-methoxy-7-methyl-6,8-dioxo-1H-isochromen-7-yl] acetate (delta mass: 127.0607 Da; putative annotation: N/A; putative formula: C2H5N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.213,"smiles":null,"spectrum_id":"CCMSLIB00017319435","spectrum_index":52895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 64.0311 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.102,"smiles":null,"spectrum_id":"CCMSLIB00017319436","spectrum_index":52896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 29.0265 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.102,"smiles":null,"spectrum_id":"CCMSLIB00017319437","spectrum_index":52897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 671.2783 Da; putative annotation: N/A; putative formula: C44H37N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1002.43,"smiles":null,"spectrum_id":"CCMSLIB00017319438","spectrum_index":52898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 24.0816 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.122,"smiles":null,"spectrum_id":"CCMSLIB00017319439","spectrum_index":52899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 192.6168 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.714,"smiles":null,"spectrum_id":"CCMSLIB00017319440","spectrum_index":52900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0,.0?,?.0?,?]octadeca-7(18),8,10,15-tetraen-14-ol (delta mass: 220.0877 Da; putative annotation: N/A; putative formula: C10H13N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.247,"smiles":null,"spectrum_id":"CCMSLIB00017319441","spectrum_index":52901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 266.261 Da; putative annotation: N/A; putative formula: C18H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.42,"smiles":null,"spectrum_id":"CCMSLIB00017319442","spectrum_index":52902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Glu (delta mass: 163.0889 Da; putative annotation: N/A; putative formula: C5H14N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.176,"smiles":null,"spectrum_id":"CCMSLIB00017319443","spectrum_index":52903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-2-carbohydrazide (delta mass: 44.0359 Da; putative annotation: N/A; putative formula: CH4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017319444","spectrum_index":52904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385642-01!1,4-dihydroxyheptadec-16-en-2-yl acetate [IIN-based: Match] (delta mass: 345.2414 Da; putative annotation: N/A; putative formula: C20H31N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.51,"smiles":null,"spectrum_id":"CCMSLIB00017319445","spectrum_index":52905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lewis B Tetrasaccharide (delta mass: 167.0546 Da; putative annotation: N/A; putative formula: C3H9N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":843.32,"smiles":null,"spectrum_id":"CCMSLIB00017319446","spectrum_index":52906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 290.1727 Da; putative annotation: N/A; putative formula: C14H26O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.342,"smiles":null,"spectrum_id":"CCMSLIB00017319447","spectrum_index":52907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-3-deazaadenosine (delta mass: 308.1135 Da; putative annotation: N/A; putative formula: C14H12N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.183,"smiles":null,"spectrum_id":"CCMSLIB00017319448","spectrum_index":52908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 104.0705 Da; putative annotation: N/A; putative formula: C2H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.193,"smiles":null,"spectrum_id":"CCMSLIB00017319449","spectrum_index":52909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Threonine methyl ester (delta mass: 67.9901 Da; putative annotation: N/A; putative formula: C3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.071,"smiles":null,"spectrum_id":"CCMSLIB00017319450","spectrum_index":52910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Piracetam (delta mass: 38.0157 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.097,"smiles":null,"spectrum_id":"CCMSLIB00017319451","spectrum_index":52911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 133.0561 Da; putative annotation: N/A; putative formula: C5H11NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.164,"smiles":null,"spectrum_id":"CCMSLIB00017319452","spectrum_index":52912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 403.4026 Da; putative annotation: N/A; putative formula: C25H49N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.552,"smiles":null,"spectrum_id":"CCMSLIB00017319453","spectrum_index":52913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 635.3316 Da; putative annotation: N/A; putative formula: C44H46NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":816.402,"smiles":null,"spectrum_id":"CCMSLIB00017319454","spectrum_index":52914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 538.162 Da; putative annotation: N/A; putative formula: C16H26N8O13)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":703.238,"smiles":null,"spectrum_id":"CCMSLIB00017319455","spectrum_index":52915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 224.1151 Da; putative annotation: N/A; putative formula: C13H21O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.196,"smiles":null,"spectrum_id":"CCMSLIB00017319456","spectrum_index":52916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 156.0941 Da; putative annotation: N/A; putative formula: C12H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.138,"smiles":null,"spectrum_id":"CCMSLIB00017319457","spectrum_index":52917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 109.0042 Da; putative annotation: N/A; putative formula: H4N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.169,"smiles":null,"spectrum_id":"CCMSLIB00017319458","spectrum_index":52918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 137.0784 Da; putative annotation: N/A; putative formula: C8H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.181,"smiles":null,"spectrum_id":"CCMSLIB00017319459","spectrum_index":52919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 104.0628 Da; putative annotation: N/A; putative formula: C8H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.16,"smiles":null,"spectrum_id":"CCMSLIB00017319460","spectrum_index":52920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotriose (delta mass: 147.0681 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.244,"smiles":null,"spectrum_id":"CCMSLIB00017319461","spectrum_index":52921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 228.1109 Da; putative annotation: N/A; putative formula: C15H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.198,"smiles":null,"spectrum_id":"CCMSLIB00017319462","spectrum_index":52922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 709.6525 Da; putative annotation: N/A; putative formula: C51H83N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1052.78,"smiles":null,"spectrum_id":"CCMSLIB00017319463","spectrum_index":52923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 147.0556 Da; putative annotation: N/A; putative formula: C4H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.1,"smiles":null,"spectrum_id":"CCMSLIB00017319464","spectrum_index":52924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 318.1784 Da; putative annotation: N/A; putative formula: C20H27ClO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.238,"smiles":null,"spectrum_id":"CCMSLIB00017319465","spectrum_index":52925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 326.0315 Da; putative annotation: N/A; putative formula: C11H18O5S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.201,"smiles":null,"spectrum_id":"CCMSLIB00017319466","spectrum_index":52926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 373.0327 Da; putative annotation: N/A; putative formula: C10H17NO10P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.119,"smiles":null,"spectrum_id":"CCMSLIB00017319467","spectrum_index":52927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 30.0 eV (delta mass: 219.1062 Da; putative annotation: N/A; putative formula: C7H18N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":528.218,"smiles":null,"spectrum_id":"CCMSLIB00017319468","spectrum_index":52928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 725.2347 Da; putative annotation: N/A; putative formula: C46H35N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":931.313,"smiles":null,"spectrum_id":"CCMSLIB00017319469","spectrum_index":52929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 141.0668 Da; putative annotation: N/A; putative formula: C4H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.127,"smiles":null,"spectrum_id":"CCMSLIB00017319470","spectrum_index":52930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 418.2205 Da; putative annotation: N/A; putative formula: C20H34O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.317,"smiles":null,"spectrum_id":"CCMSLIB00017319471","spectrum_index":52931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 647.7193 Da; putative annotation: N/A; putative formula: C42H89N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.843,"smiles":null,"spectrum_id":"CCMSLIB00017319472","spectrum_index":52932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 330.0116 Da; putative annotation: N/A; putative formula: C16H11O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.072,"smiles":null,"spectrum_id":"CCMSLIB00017319473","spectrum_index":52933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 25.0356 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017319474","spectrum_index":52934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 569.4586 Da; putative annotation: N/A; putative formula: C32H63N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":746.561,"smiles":null,"spectrum_id":"CCMSLIB00017319475","spectrum_index":52935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 695.4401 Da; putative annotation: N/A; putative formula: C34H61N7O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.516,"smiles":null,"spectrum_id":"CCMSLIB00017319476","spectrum_index":52936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Capsazepine (delta mass: 60.0875 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.196,"smiles":null,"spectrum_id":"CCMSLIB00017319477","spectrum_index":52937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 136.0528 Da; putative annotation: N/A; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.186,"smiles":null,"spectrum_id":"CCMSLIB00017319478","spectrum_index":52938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1,1-Tris(hydroxymethyl)propane (delta mass: 50.0524 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.154,"smiles":null,"spectrum_id":"CCMSLIB00017319479","spectrum_index":52939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 30.9596 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.04,"smiles":null,"spectrum_id":"CCMSLIB00017319480","spectrum_index":52940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 120.061 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.149,"smiles":null,"spectrum_id":"CCMSLIB00017319481","spectrum_index":52941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-O-Methylvisamminol (delta mass: 32.0166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.139,"smiles":null,"spectrum_id":"CCMSLIB00017319482","spectrum_index":52942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 147.0612 Da; putative annotation: N/A; putative formula: C9H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.188,"smiles":null,"spectrum_id":"CCMSLIB00017319483","spectrum_index":52943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7-Chloro-1H-indol-3-yl)acetic acid (delta mass: 149.0749 Da; putative annotation: N/A; putative formula: C9H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.107,"smiles":null,"spectrum_id":"CCMSLIB00017319484","spectrum_index":52944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 96.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.164,"smiles":null,"spectrum_id":"CCMSLIB00017319485","spectrum_index":52945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-2-phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 113.163 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017319486","spectrum_index":52946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dichloro-1H-indole-2-carboxylic acid (delta mass: 82.1333 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.11,"smiles":null,"spectrum_id":"CCMSLIB00017319487","spectrum_index":52947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 13.0401 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":150.075,"smiles":null,"spectrum_id":"CCMSLIB00017319488","spectrum_index":52948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1H-indole-3-carbaldehyde (delta mass: 15.0153 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.091,"smiles":null,"spectrum_id":"CCMSLIB00017319489","spectrum_index":52949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-6-ol (delta mass: 11.9993 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.059,"smiles":null,"spectrum_id":"CCMSLIB00017319490","spectrum_index":52950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 119.0257 Da; putative annotation: N/A; putative formula: C2H6N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.128,"smiles":null,"spectrum_id":"CCMSLIB00017319491","spectrum_index":52951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 44.0625 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.165,"smiles":null,"spectrum_id":"CCMSLIB00017319492","spectrum_index":52952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 559.2124 Da; putative annotation: N/A; putative formula: C32H34NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.273,"smiles":null,"spectrum_id":"CCMSLIB00017319493","spectrum_index":52953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fusarochromanone (delta mass: 17.088 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.238,"smiles":null,"spectrum_id":"CCMSLIB00017319494","spectrum_index":52954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 397.1948 Da; putative annotation: N/A; putative formula: C16H31NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.318,"smiles":null,"spectrum_id":"CCMSLIB00017319495","spectrum_index":52955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 139.0423 Da; putative annotation: N/A; putative formula: C10H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.129,"smiles":null,"spectrum_id":"CCMSLIB00017319496","spectrum_index":52956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000823 Andrastin D|methyl (5S,8S,9S,10R,13R,14R)-17-hydroxy-4,4,8,10,12,13,16-heptamethyl-3,15-dioxo-1,2,5,6,7,9-hexahydrocyclopenta[a]phenanthrene-14-carboxylate (delta mass: 126.0815 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":555.345,"smiles":null,"spectrum_id":"CCMSLIB00017319497","spectrum_index":52957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 99.069 Da; putative annotation: N/A; putative formula: C5H9NO)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.151,"smiles":null,"spectrum_id":"CCMSLIB00017319498","spectrum_index":52958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 35.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.026,"smiles":null,"spectrum_id":"CCMSLIB00017319499","spectrum_index":52959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 139.0997 Da; putative annotation: N/A; putative formula: C8H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.197,"smiles":null,"spectrum_id":"CCMSLIB00017319500","spectrum_index":52960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 324.1021 Da; putative annotation: N/A; putative formula: C10H21N4O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":663.225,"smiles":null,"spectrum_id":"CCMSLIB00017319501","spectrum_index":52961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Indol-3-yl)-N-(4-methoxyphenyl)acetamide (delta mass: 41.0296 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.158,"smiles":null,"spectrum_id":"CCMSLIB00017319502","spectrum_index":52962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 117.0635 Da; putative annotation: N/A; putative formula: C2H7N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.144,"smiles":null,"spectrum_id":"CCMSLIB00017319503","spectrum_index":52963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 176.0822 Da; putative annotation: N/A; putative formula: C11H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.335,"smiles":null,"spectrum_id":"CCMSLIB00017319504","spectrum_index":52964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 153.1161 Da; putative annotation: N/A; putative formula: C9H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.24,"smiles":null,"spectrum_id":"CCMSLIB00017319505","spectrum_index":52965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-serine; AIF; CE10; CorrDec (delta mass: 69.058 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.118,"smiles":null,"spectrum_id":"CCMSLIB00017319506","spectrum_index":52966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 225.2177 Da; putative annotation: N/A; putative formula: C13H27N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.325,"smiles":null,"spectrum_id":"CCMSLIB00017319507","spectrum_index":52967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 171.0962 Da; putative annotation: N/A; putative formula: C3H9N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.276,"smiles":null,"spectrum_id":"CCMSLIB00017319508","spectrum_index":52968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Hydroxyquinoline-5-carboxylic acid (delta mass: 77.0457 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.096,"smiles":null,"spectrum_id":"CCMSLIB00017319509","spectrum_index":52969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.alpha.-L-fucopyranosyl)-D-glucopyranose (delta mass: 101.0632 Da; putative annotation: N/A; putative formula: C8H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.218,"smiles":null,"spectrum_id":"CCMSLIB00017319510","spectrum_index":52970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311158 Methoxytyramine (delta mass: 119.9851 Da; putative annotation: N/A; putative formula: C6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.087,"smiles":null,"spectrum_id":"CCMSLIB00017319511","spectrum_index":52971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 158.1049 Da; putative annotation: N/A; putative formula: C7H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.269,"smiles":null,"spectrum_id":"CCMSLIB00017319512","spectrum_index":52972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 293.1731 Da; putative annotation: N/A; putative formula: C15H23N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.185,"smiles":null,"spectrum_id":"CCMSLIB00017319513","spectrum_index":52973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 123.0787 Da; putative annotation: N/A; putative formula: C6H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.196,"smiles":null,"spectrum_id":"CCMSLIB00017319514","spectrum_index":52974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 11.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.155,"smiles":null,"spectrum_id":"CCMSLIB00017319515","spectrum_index":52975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 658.2807 Da; putative annotation: N/A; putative formula: C48H38N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":883.393,"smiles":null,"spectrum_id":"CCMSLIB00017319516","spectrum_index":52976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SODIUM D-GLUCONATE (delta mass: 53.0632 Da; putative annotation: N/A; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.129,"smiles":null,"spectrum_id":"CCMSLIB00017319517","spectrum_index":52977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 39.0377 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.192,"smiles":null,"spectrum_id":"CCMSLIB00017319518","spectrum_index":52978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-carboxypropanoylamino)hexanoic acid CollisionEnergy:205060 (delta mass: 142.1107 Da; putative annotation: N/A; putative formula: C7H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017319519","spectrum_index":52979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 515.9518 Da; putative annotation: N/A; putative formula: C18H4N4O13S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":679.012,"smiles":null,"spectrum_id":"CCMSLIB00017319520","spectrum_index":52980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 116.0335 Da; putative annotation: N/A; putative formula: C2H4N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.074,"smiles":null,"spectrum_id":"CCMSLIB00017319521","spectrum_index":52981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 262.1584 Da; putative annotation: N/A; putative formula: C17H18N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.25,"smiles":null,"spectrum_id":"CCMSLIB00017319522","spectrum_index":52982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084605 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 158.0799 Da; putative annotation: N/A; putative formula: C5H10N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.134,"smiles":null,"spectrum_id":"CCMSLIB00017319523","spectrum_index":52983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 72.0359 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.117,"smiles":null,"spectrum_id":"CCMSLIB00017319524","spectrum_index":52984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 63.0473 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.16,"smiles":null,"spectrum_id":"CCMSLIB00017319525","spectrum_index":52985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 85.0524 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.123,"smiles":null,"spectrum_id":"CCMSLIB00017319526","spectrum_index":52986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 496.2654 Da; putative annotation: N/A; putative formula: C23H40N6O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":721.378,"smiles":null,"spectrum_id":"CCMSLIB00017319527","spectrum_index":52987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 388.0773 Da; putative annotation: N/A; putative formula: C16H24N2OS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.137,"smiles":null,"spectrum_id":"CCMSLIB00017319528","spectrum_index":52988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 119.038 Da; putative annotation: N/A; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.214,"smiles":null,"spectrum_id":"CCMSLIB00017319529","spectrum_index":52989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 325.1167 Da; putative annotation: N/A; putative formula: C18H20N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.24,"smiles":null,"spectrum_id":"CCMSLIB00017319530","spectrum_index":52990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 120.0575 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.123,"smiles":null,"spectrum_id":"CCMSLIB00017319531","spectrum_index":52991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 185.3045 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":468.474,"smiles":null,"spectrum_id":"CCMSLIB00017319532","spectrum_index":52992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 116.0196 Da; putative annotation: N/A; putative formula: C8H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.1,"smiles":null,"spectrum_id":"CCMSLIB00017319533","spectrum_index":52993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR301108 L-Oxonoreleagnine (delta mass: 70.0409 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.128,"smiles":null,"spectrum_id":"CCMSLIB00017319534","spectrum_index":52994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 172.0426 Da; putative annotation: N/A; putative formula: C13H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.096,"smiles":null,"spectrum_id":"CCMSLIB00017319535","spectrum_index":52995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 98.072 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.185,"smiles":null,"spectrum_id":"CCMSLIB00017319536","spectrum_index":52996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl .alpha.-D-mannopyranoside (delta mass: 98.0288 Da; putative annotation: N/A; putative formula: C5H7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.115,"smiles":null,"spectrum_id":"CCMSLIB00017319537","spectrum_index":52997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,6a-dihydrodemethoxyguadiscine (delta mass: 45.0011 Da; putative annotation: N/A; putative formula: C4H-1NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.15,"smiles":null,"spectrum_id":"CCMSLIB00017319538","spectrum_index":52998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 251.0464 Da; putative annotation: N/A; putative formula: C8H13NO6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.159,"smiles":null,"spectrum_id":"CCMSLIB00017319539","spectrum_index":52999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1070.2957 Da; putative annotation: N/A; putative formula: C78H42N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1413.42,"smiles":null,"spectrum_id":"CCMSLIB00017319540","spectrum_index":53000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU288303 Norharmane|9H-pyrido[3,4-b]indole (delta mass: 17.0252 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.101,"smiles":null,"spectrum_id":"CCMSLIB00017319541","spectrum_index":53001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 116.0303 Da; putative annotation: N/A; putative formula: C5H10O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.127,"smiles":null,"spectrum_id":"CCMSLIB00017319542","spectrum_index":53002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-HYDROXYINDOLE (delta mass: 28.02 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.08,"smiles":null,"spectrum_id":"CCMSLIB00017319543","spectrum_index":53003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 277.261 Da; putative annotation: N/A; putative formula: C16H31N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.373,"smiles":null,"spectrum_id":"CCMSLIB00017319544","spectrum_index":53004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 265.228 Da; putative annotation: N/A; putative formula: C14H27N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.383,"smiles":null,"spectrum_id":"CCMSLIB00017319545","spectrum_index":53005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 35.9998 Da; putative annotation: N/A; putative formula: C3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.097,"smiles":null,"spectrum_id":"CCMSLIB00017319546","spectrum_index":53006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 895.4937 Da; putative annotation: N/A; putative formula: C60H61N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1058.55,"smiles":null,"spectrum_id":"CCMSLIB00017319547","spectrum_index":53007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gln (delta mass: 244.0684 Da; putative annotation: N/A; putative formula: C9H12N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.229,"smiles":null,"spectrum_id":"CCMSLIB00017319548","spectrum_index":53008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 276.2459 Da; putative annotation: N/A; putative formula: C19H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.338,"smiles":null,"spectrum_id":"CCMSLIB00017319549","spectrum_index":53009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385769-01!4-[3,5-dihydroxy-7-(4-hydroxyphenyl)heptyl]benzene-1,2-diol (delta mass: 118.0146 Da; putative annotation: N/A; putative formula: C2H-2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.184,"smiles":null,"spectrum_id":"CCMSLIB00017319550","spectrum_index":53010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 387.2556 Da; putative annotation: N/A; putative formula: C19H37N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":520.332,"smiles":null,"spectrum_id":"CCMSLIB00017319551","spectrum_index":53011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 166.1201 Da; putative annotation: N/A; putative formula: C8H14N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":534.291,"smiles":null,"spectrum_id":"CCMSLIB00017319552","spectrum_index":53012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 476.5332 Da; putative annotation: N/A; putative formula: C34H68)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":654.62,"smiles":null,"spectrum_id":"CCMSLIB00017319553","spectrum_index":53013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 583.2853 Da; putative annotation: N/A; putative formula: C26H41N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":737.372,"smiles":null,"spectrum_id":"CCMSLIB00017319554","spectrum_index":53014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-6-Aminopenicillanic acid (delta mass: 197.0704 Da; putative annotation: N/A; putative formula: C10H7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.134,"smiles":null,"spectrum_id":"CCMSLIB00017319555","spectrum_index":53015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 123.0936 Da; putative annotation: N/A; putative formula: C5H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017319556","spectrum_index":53016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 88.0161 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.107,"smiles":null,"spectrum_id":"CCMSLIB00017319557","spectrum_index":53017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 80.0623 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.133,"smiles":null,"spectrum_id":"CCMSLIB00017319558","spectrum_index":53018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ365709 Cimaterol|2-amino-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile (delta mass: 32.0041 Da; putative annotation: N/A; putative formula: C4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.148,"smiles":null,"spectrum_id":"CCMSLIB00017319559","spectrum_index":53019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 212.0766 Da; putative annotation: N/A; putative formula: C5H8N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.2,"smiles":null,"spectrum_id":"CCMSLIB00017319560","spectrum_index":53020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 543.1954 Da; putative annotation: N/A; putative formula: C19H30N9O8P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.282,"smiles":null,"spectrum_id":"CCMSLIB00017319561","spectrum_index":53021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 122.0205 Da; putative annotation: N/A; putative formula: H-2N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.101,"smiles":null,"spectrum_id":"CCMSLIB00017319562","spectrum_index":53022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1-Piperazinyl)-1H-indole (delta mass: 140.078 Da; putative annotation: N/A; putative formula: C7H12N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.212,"smiles":null,"spectrum_id":"CCMSLIB00017319563","spectrum_index":53023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucoheptose (delta mass: 136.0157 Da; putative annotation: N/A; putative formula: C7H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.097,"smiles":null,"spectrum_id":"CCMSLIB00017319564","spectrum_index":53024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 27.0525 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.222,"smiles":null,"spectrum_id":"CCMSLIB00017319565","spectrum_index":53025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 332.0494 Da; putative annotation: N/A; putative formula: C14H21OPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.115,"smiles":null,"spectrum_id":"CCMSLIB00017319566","spectrum_index":53026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Bromoquinolin-8-ol (delta mass: 27.2113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.182,"smiles":null,"spectrum_id":"CCMSLIB00017319567","spectrum_index":53027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 727.9816 Da; putative annotation: N/A; putative formula: C19H24N2O20S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":950.079,"smiles":null,"spectrum_id":"CCMSLIB00017319568","spectrum_index":53028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyochelin (delta mass: 371.9799 Da; putative annotation: N/A; putative formula: C14H12O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.047,"smiles":null,"spectrum_id":"CCMSLIB00017319569","spectrum_index":53029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 221.0897 Da; putative annotation: N/A; putative formula: C8H15NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.181,"smiles":null,"spectrum_id":"CCMSLIB00017319570","spectrum_index":53030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 326.1744 Da; putative annotation: N/A; putative formula: C18H22N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.36,"smiles":null,"spectrum_id":"CCMSLIB00017319571","spectrum_index":53031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide (delta mass: 100.0226 Da; putative annotation: N/A; putative formula: C2H4N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.112,"smiles":null,"spectrum_id":"CCMSLIB00017319572","spectrum_index":53032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 127.0172 Da; putative annotation: N/A; putative formula: C7HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.13,"smiles":null,"spectrum_id":"CCMSLIB00017319573","spectrum_index":53033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 157.1834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.259,"smiles":null,"spectrum_id":"CCMSLIB00017319574","spectrum_index":53034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 85.0566 Da; putative annotation: N/A; putative formula: C4H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.128,"smiles":null,"spectrum_id":"CCMSLIB00017319575","spectrum_index":53035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 108.13 Da; putative annotation: N/A; putative formula: C9H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.216,"smiles":null,"spectrum_id":"CCMSLIB00017319576","spectrum_index":53036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 158.2213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.264,"smiles":null,"spectrum_id":"CCMSLIB00017319577","spectrum_index":53037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 87.0364 Da; putative annotation: N/A; putative formula: C2H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.139,"smiles":null,"spectrum_id":"CCMSLIB00017319578","spectrum_index":53038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 102.0303 Da; putative annotation: N/A; putative formula: H2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.111,"smiles":null,"spectrum_id":"CCMSLIB00017319579","spectrum_index":53039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxytryptamine (delta mass: 41.9997 Da; putative annotation: N/A; putative formula: C2H3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.118,"smiles":null,"spectrum_id":"CCMSLIB00017319580","spectrum_index":53040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 50.0267 Da; putative annotation: N/A; putative formula: C3H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.155,"smiles":null,"spectrum_id":"CCMSLIB00017319581","spectrum_index":53041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 374.1484 Da; putative annotation: N/A; putative formula: C12H22N8O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.256,"smiles":null,"spectrum_id":"CCMSLIB00017319582","spectrum_index":53042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 25.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.134,"smiles":null,"spectrum_id":"CCMSLIB00017319583","spectrum_index":53043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Monoacetylmorphine (delta mass: 129.0433 Da; putative annotation: N/A; putative formula: C6H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.198,"smiles":null,"spectrum_id":"CCMSLIB00017319584","spectrum_index":53044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 294.3398 Da; putative annotation: N/A; putative formula: C20H42N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.426,"smiles":null,"spectrum_id":"CCMSLIB00017319585","spectrum_index":53045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 73.0227 Da; putative annotation: N/A; putative formula: CH4N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.103,"smiles":null,"spectrum_id":"CCMSLIB00017319586","spectrum_index":53046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Quinazolinamine, 2-cyclohexyl-6-methoxy-N-[1-(1-methylethyl)-4-piperidinyl]-7-[3-(1-pyrrolidinyl)propoxy]- (delta mass: 51.0497 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":561.43,"smiles":null,"spectrum_id":"CCMSLIB00017319587","spectrum_index":53047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melezitose (delta mass: 119.0373 Da; putative annotation: Anthranilic acid; putative formula: C7H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.214,"smiles":null,"spectrum_id":"CCMSLIB00017319588","spectrum_index":53048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Pro (delta mass: 97.0527 Da; putative annotation: 1-Amino-1-cyclobutanecarboxylic acid; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.207,"smiles":null,"spectrum_id":"CCMSLIB00017319589","spectrum_index":53049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 322.047 Da; putative annotation: Austocystin I; putative formula: C18H10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.107,"smiles":null,"spectrum_id":"CCMSLIB00017319590","spectrum_index":53050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 134.1102 Da; putative annotation: 1-Adamantanol; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.4,"smiles":null,"spectrum_id":"CCMSLIB00017319591","spectrum_index":53051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pentaethylenehexamine (delta mass: 55.0445 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.289,"smiles":null,"spectrum_id":"CCMSLIB00017319592","spectrum_index":53052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2,3-Dimethylphenyl)-7-methyl-1,2,4-triazaspiro[4.5]decane-3-thione (delta mass: 39.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.185,"smiles":null,"spectrum_id":"CCMSLIB00017319593","spectrum_index":53053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 25.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017319594","spectrum_index":53054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 108.0353 Da; putative annotation: N/A; putative formula: C10H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.159,"smiles":null,"spectrum_id":"CCMSLIB00017319595","spectrum_index":53055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 88.1077 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.223,"smiles":null,"spectrum_id":"CCMSLIB00017319596","spectrum_index":53056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SUCROSE (delta mass: 229.1098 Da; putative annotation: N/A; putative formula: C14H15NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.233,"smiles":null,"spectrum_id":"CCMSLIB00017319597","spectrum_index":53057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2E)-3,4,7-Trimethylocta-2,6-dien-1-ol (delta mass: 50.0517 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.21,"smiles":null,"spectrum_id":"CCMSLIB00017319598","spectrum_index":53058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Amino-2-methylbutanoic acid (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.092,"smiles":null,"spectrum_id":"CCMSLIB00017319599","spectrum_index":53059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 413.232 Da; putative annotation: N/A; putative formula: C24H35N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.344,"smiles":null,"spectrum_id":"CCMSLIB00017319600","spectrum_index":53060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 702.3632 Da; putative annotation: N/A; putative formula: C39H50N4O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":895.434,"smiles":null,"spectrum_id":"CCMSLIB00017319601","spectrum_index":53061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 895.3464 Da; putative annotation: N/A; putative formula: C47H53N5O11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1102.43,"smiles":null,"spectrum_id":"CCMSLIB00017319602","spectrum_index":53062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 107.074 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.15,"smiles":null,"spectrum_id":"CCMSLIB00017319603","spectrum_index":53063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine (delta mass: 79.9655 Da; putative annotation: N/A; putative formula: HO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.069,"smiles":null,"spectrum_id":"CCMSLIB00017319604","spectrum_index":53064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 175.0844 Da; putative annotation: N/A; putative formula: C7H13NO4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.171,"smiles":null,"spectrum_id":"CCMSLIB00017319605","spectrum_index":53065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 190.084 Da; putative annotation: N/A; putative formula: C8H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.181,"smiles":null,"spectrum_id":"CCMSLIB00017319606","spectrum_index":53066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 76.0678 Da; putative annotation: N/A; putative formula: C7H8O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.143,"smiles":null,"spectrum_id":"CCMSLIB00017319607","spectrum_index":53067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 635.405 Da; putative annotation: N/A; putative formula: C36H53N5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":857.502,"smiles":null,"spectrum_id":"CCMSLIB00017319608","spectrum_index":53068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 60.0005 Da; putative annotation: N/A; putative formula: C5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.05,"smiles":null,"spectrum_id":"CCMSLIB00017319609","spectrum_index":53069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 148.0486 Da; putative annotation: N/A; putative formula: C4H8N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.109,"smiles":null,"spectrum_id":"CCMSLIB00017319610","spectrum_index":53070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Arabinose (delta mass: 65.0628 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.123,"smiles":null,"spectrum_id":"CCMSLIB00017319611","spectrum_index":53071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 91.0635 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.139,"smiles":null,"spectrum_id":"CCMSLIB00017319612","spectrum_index":53072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 23.059 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.102,"smiles":null,"spectrum_id":"CCMSLIB00017319613","spectrum_index":53073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 532.1099 Da; putative annotation: N/A; putative formula: C24H20N8O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.17,"smiles":null,"spectrum_id":"CCMSLIB00017319614","spectrum_index":53074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Glu (delta mass: 36.0249 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.128,"smiles":null,"spectrum_id":"CCMSLIB00017319615","spectrum_index":53075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005787 Indole-3-carboxylic acid|1H-indole-3-carboxylic acid (delta mass: 204.0359 Da; putative annotation: N/A; putative formula: C10H8N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.091,"smiles":null,"spectrum_id":"CCMSLIB00017319616","spectrum_index":53076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Acetyl-4-piperidinecarboxylic acid (delta mass: 46.0779 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.175,"smiles":null,"spectrum_id":"CCMSLIB00017319617","spectrum_index":53077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 125.0202 Da; putative annotation: N/A; putative formula: H-1N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.169,"smiles":null,"spectrum_id":"CCMSLIB00017319618","spectrum_index":53078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 257.0729 Da; putative annotation: N/A; putative formula: C12H19NO-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.153,"smiles":null,"spectrum_id":"CCMSLIB00017319619","spectrum_index":53079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 79.0824 Da; putative annotation: N/A; putative formula: C6H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.231,"smiles":null,"spectrum_id":"CCMSLIB00017319620","spectrum_index":53080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 189.1415 Da; putative annotation: N/A; putative formula: C7H19N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.254,"smiles":null,"spectrum_id":"CCMSLIB00017319621","spectrum_index":53081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (delta mass: 78.0331 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.166,"smiles":null,"spectrum_id":"CCMSLIB00017319622","spectrum_index":53082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 25.11 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.121,"smiles":null,"spectrum_id":"CCMSLIB00017319623","spectrum_index":53083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 27.0048 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.096,"smiles":null,"spectrum_id":"CCMSLIB00017319624","spectrum_index":53084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 73.0899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.27,"smiles":null,"spectrum_id":"CCMSLIB00017319625","spectrum_index":53085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 106.0267 Da; putative annotation: N/A; putative formula: C3H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.118,"smiles":null,"spectrum_id":"CCMSLIB00017319626","spectrum_index":53086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 120.0157 Da; putative annotation: N/A; putative formula: C4H9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.129,"smiles":null,"spectrum_id":"CCMSLIB00017319627","spectrum_index":53087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380084-01_C21H30O4_Benzo[b]cyclopenta[e]pyran-8(3H)-one, 3a,5,6,7,9,9a-hexahydro-7-hydroxy-1-[(4E)-6-hydroxy-1,5-dimethyl-4-hexen-1-yl]-3a-methyl- (delta mass: 14.0156 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.237,"smiles":null,"spectrum_id":"CCMSLIB00017319628","spectrum_index":53088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Olaquindox (delta mass: 103.0301 Da; putative annotation: N/A; putative formula: C2H6N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.128,"smiles":null,"spectrum_id":"CCMSLIB00017319629","spectrum_index":53089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 203.2245 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.28,"smiles":null,"spectrum_id":"CCMSLIB00017319630","spectrum_index":53090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethylselegiline (delta mass: 358.1275 Da; putative annotation: N/A; putative formula: C27H19O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.255,"smiles":null,"spectrum_id":"CCMSLIB00017319631","spectrum_index":53091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chymostatin B (delta mass: 19.0115 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":613.315,"smiles":null,"spectrum_id":"CCMSLIB00017319632","spectrum_index":53092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 552.1841 Da; putative annotation: N/A; putative formula: C32H32N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.236,"smiles":null,"spectrum_id":"CCMSLIB00017319633","spectrum_index":53093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydromorphone (delta mass: 311.1481 Da; putative annotation: N/A; putative formula: C14H21N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":597.292,"smiles":null,"spectrum_id":"CCMSLIB00017319634","spectrum_index":53094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 328.2588 Da; putative annotation: N/A; putative formula: C23H36O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.512,"smiles":null,"spectrum_id":"CCMSLIB00017319635","spectrum_index":53095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 234.114 Da; putative annotation: N/A; putative formula: C9H19N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.247,"smiles":null,"spectrum_id":"CCMSLIB00017319636","spectrum_index":53096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 172.0475 Da; putative annotation: N/A; putative formula: C8H13PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.134,"smiles":null,"spectrum_id":"CCMSLIB00017319637","spectrum_index":53097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxymethylone (delta mass: 226.1572 Da; putative annotation: N/A; putative formula: C13H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.265,"smiles":null,"spectrum_id":"CCMSLIB00017319638","spectrum_index":53098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 194.1089 Da; putative annotation: N/A; putative formula: C9H15N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.174,"smiles":null,"spectrum_id":"CCMSLIB00017319639","spectrum_index":53099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-3-yl)acetonitrile (delta mass: 63.9983 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.085,"smiles":null,"spectrum_id":"CCMSLIB00017319640","spectrum_index":53100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tulobuterol (delta mass: 162.0603 Da; putative annotation: N/A; putative formula: C10H11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.175,"smiles":null,"spectrum_id":"CCMSLIB00017319641","spectrum_index":53101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 478.2297 Da; putative annotation: N/A; putative formula: C21H34N8OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.316,"smiles":null,"spectrum_id":"CCMSLIB00017319642","spectrum_index":53102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 14.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.123,"smiles":null,"spectrum_id":"CCMSLIB00017319643","spectrum_index":53103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 165.0795 Da; putative annotation: N/A; putative formula: C9H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.249,"smiles":null,"spectrum_id":"CCMSLIB00017319644","spectrum_index":53104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 879.51 Da; putative annotation: N/A; putative formula: C46H69N7O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1210.66,"smiles":null,"spectrum_id":"CCMSLIB00017319645","spectrum_index":53105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 366.108 Da; putative annotation: N/A; putative formula: C14H23O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.173,"smiles":null,"spectrum_id":"CCMSLIB00017319646","spectrum_index":53106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine (delta mass: 42.0098 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.186,"smiles":null,"spectrum_id":"CCMSLIB00017319647","spectrum_index":53107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380224-01!1,7-bis(3,4-dihydroxyphenyl)-6-methoxyheptan-3-one (delta mass: 195.0892 Da; putative annotation: N/A; putative formula: C10H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.254,"smiles":null,"spectrum_id":"CCMSLIB00017319648","spectrum_index":53108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltose (delta mass: 396.1565 Da; putative annotation: N/A; putative formula: C15H28N2O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.28,"smiles":null,"spectrum_id":"CCMSLIB00017319649","spectrum_index":53109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 171.115 Da; putative annotation: N/A; putative formula: C11H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.238,"smiles":null,"spectrum_id":"CCMSLIB00017319650","spectrum_index":53110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 342.2773 Da; putative annotation: N/A; putative formula: C20H38O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.342,"smiles":null,"spectrum_id":"CCMSLIB00017319651","spectrum_index":53111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)-1-pentanamine (delta mass: 488.2271 Da; putative annotation: N/A; putative formula: C24H32N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.402,"smiles":null,"spectrum_id":"CCMSLIB00017319652","spectrum_index":53112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 313.0617 Da; putative annotation: N/A; putative formula: C15H12N3O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.104,"smiles":null,"spectrum_id":"CCMSLIB00017319653","spectrum_index":53113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 126.0322 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.113,"smiles":null,"spectrum_id":"CCMSLIB00017319654","spectrum_index":53114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noroxymorphone (delta mass: 217.1419 Da; putative annotation: N/A; putative formula: C11H24NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.265,"smiles":null,"spectrum_id":"CCMSLIB00017319655","spectrum_index":53115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 98.9961 Da; putative annotation: N/A; putative formula: C3HNO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.051,"smiles":null,"spectrum_id":"CCMSLIB00017319656","spectrum_index":53116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 67.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.181,"smiles":null,"spectrum_id":"CCMSLIB00017319657","spectrum_index":53117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 482.3074 Da; putative annotation: N/A; putative formula: C20H38N10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.431,"smiles":null,"spectrum_id":"CCMSLIB00017319658","spectrum_index":53118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Clenbuterol (delta mass: 129.0408 Da; putative annotation: N/A; putative formula: CH3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.128,"smiles":null,"spectrum_id":"CCMSLIB00017319659","spectrum_index":53119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methylecgonine (delta mass: 27.0 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.128,"smiles":null,"spectrum_id":"CCMSLIB00017319660","spectrum_index":53120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 132.0664 Da; putative annotation: N/A; putative formula: C3H8N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.2,"smiles":null,"spectrum_id":"CCMSLIB00017319661","spectrum_index":53121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 78.0109 Da; putative annotation: N/A; putative formula: C5H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.098,"smiles":null,"spectrum_id":"CCMSLIB00017319662","spectrum_index":53122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dichloro-1H-indole-2-carboxylic acid (delta mass: 377.0662 Da; putative annotation: N/A; putative formula: C20H7N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.043,"smiles":null,"spectrum_id":"CCMSLIB00017319663","spectrum_index":53123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 37.0316 Da; putative annotation: N/A; putative formula: C3H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017319664","spectrum_index":53124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-Mannitol from NIST14 (delta mass: 12.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.138,"smiles":null,"spectrum_id":"CCMSLIB00017319665","spectrum_index":53125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 293.126 Da; putative annotation: N/A; putative formula: C15H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.218,"smiles":null,"spectrum_id":"CCMSLIB00017319666","spectrum_index":53126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 385.212 Da; putative annotation: N/A; putative formula: C20H27N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":536.272,"smiles":null,"spectrum_id":"CCMSLIB00017319667","spectrum_index":53127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.097,"smiles":null,"spectrum_id":"CCMSLIB00017319668","spectrum_index":53128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 44.0265 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.175,"smiles":null,"spectrum_id":"CCMSLIB00017319669","spectrum_index":53129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 189.0999 Da; putative annotation: N/A; putative formula: C8H15NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.197,"smiles":null,"spectrum_id":"CCMSLIB00017319670","spectrum_index":53130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 247.1419 Da; putative annotation: N/A; putative formula: C11H21NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.228,"smiles":null,"spectrum_id":"CCMSLIB00017319671","spectrum_index":53131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acerogenin G (delta mass: 16.089 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.253,"smiles":null,"spectrum_id":"CCMSLIB00017319672","spectrum_index":53132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 177.1729 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.244,"smiles":null,"spectrum_id":"CCMSLIB00017319673","spectrum_index":53133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-hydroxy-3-methyl)-butyl-hydrocotarnine (delta mass: 116.0843 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.27,"smiles":null,"spectrum_id":"CCMSLIB00017319674","spectrum_index":53134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 745.278 Da; putative annotation: N/A; putative formula: C38H43N5O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1076.43,"smiles":null,"spectrum_id":"CCMSLIB00017319675","spectrum_index":53135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 51.049 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.203,"smiles":null,"spectrum_id":"CCMSLIB00017319676","spectrum_index":53136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 52.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.139,"smiles":null,"spectrum_id":"CCMSLIB00017319677","spectrum_index":53137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 120.0413 Da; putative annotation: N/A; putative formula: C5H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.143,"smiles":null,"spectrum_id":"CCMSLIB00017319678","spectrum_index":53138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 634.2521 Da; putative annotation: N/A; putative formula: C47H30N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":815.323,"smiles":null,"spectrum_id":"CCMSLIB00017319679","spectrum_index":53139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 282.0525 Da; putative annotation: N/A; putative formula: C16H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":625.176,"smiles":null,"spectrum_id":"CCMSLIB00017319680","spectrum_index":53140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.05,"smiles":null,"spectrum_id":"CCMSLIB00017319681","spectrum_index":53141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 62.0476 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.103,"smiles":null,"spectrum_id":"CCMSLIB00017319682","spectrum_index":53142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 129.0431 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.219,"smiles":null,"spectrum_id":"CCMSLIB00017319683","spectrum_index":53143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087705 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 236.0529 Da; putative annotation: N/A; putative formula: C8H12O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.118,"smiles":null,"spectrum_id":"CCMSLIB00017319684","spectrum_index":53144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GLUCOSAMINE (delta mass: 258.0352 Da; putative annotation: N/A; putative formula: C14H10O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.132,"smiles":null,"spectrum_id":"CCMSLIB00017319685","spectrum_index":53145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 355.1385 Da; putative annotation: N/A; putative formula: C18H22N5O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.241,"smiles":null,"spectrum_id":"CCMSLIB00017319686","spectrum_index":53146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-2-butanone (delta mass: 128.1765 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.284,"smiles":null,"spectrum_id":"CCMSLIB00017319687","spectrum_index":53147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: Hydroxyphenethylamine (delta mass: 93.0795 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.171,"smiles":null,"spectrum_id":"CCMSLIB00017319688","spectrum_index":53148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 119.0582 Da; putative annotation: N/A; putative formula: C4H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.228,"smiles":null,"spectrum_id":"CCMSLIB00017319689","spectrum_index":53149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminopyridine (delta mass: 42.9924 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.053,"smiles":null,"spectrum_id":"CCMSLIB00017319690","spectrum_index":53150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 47.0281 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.13,"smiles":null,"spectrum_id":"CCMSLIB00017319691","spectrum_index":53151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 162.1025 Da; putative annotation: N/A; putative formula: C11H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.278,"smiles":null,"spectrum_id":"CCMSLIB00017319692","spectrum_index":53152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Methoxyethyl)-1H-indole-2-carboxylic acid (delta mass: 215.1636 Da; putative annotation: N/A; putative formula: C10H21N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.26,"smiles":null,"spectrum_id":"CCMSLIB00017319693","spectrum_index":53153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 393.271 Da; putative annotation: N/A; putative formula: C16H31N11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.415,"smiles":null,"spectrum_id":"CCMSLIB00017319694","spectrum_index":53154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 104.0378 Da; putative annotation: N/A; putative formula: C6H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.135,"smiles":null,"spectrum_id":"CCMSLIB00017319695","spectrum_index":53155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 45.025 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.179,"smiles":null,"spectrum_id":"CCMSLIB00017319696","spectrum_index":53156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 37.9944 Da; putative annotation: N/A; putative formula: CH-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.076,"smiles":null,"spectrum_id":"CCMSLIB00017319697","spectrum_index":53157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 146.0846 Da; putative annotation: N/A; putative formula: C9H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.101,"smiles":null,"spectrum_id":"CCMSLIB00017319698","spectrum_index":53158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 44.948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.117,"smiles":null,"spectrum_id":"CCMSLIB00017319699","spectrum_index":53159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of {[3-(Difluoromethoxy)phenyl]methyl}(methyl)amine (delta mass: 256.0988 Da; putative annotation: N/A; putative formula: C12H13N6O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.187,"smiles":null,"spectrum_id":"CCMSLIB00017319700","spectrum_index":53160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galactitol - 30.0 eV (delta mass: 265.1832 Da; putative annotation: N/A; putative formula: C19H23N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.27,"smiles":null,"spectrum_id":"CCMSLIB00017319701","spectrum_index":53161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 101.068 Da; putative annotation: N/A; putative formula: C5H11NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.154,"smiles":null,"spectrum_id":"CCMSLIB00017319702","spectrum_index":53162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 108.0749 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.135,"smiles":null,"spectrum_id":"CCMSLIB00017319703","spectrum_index":53163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 205.9689 Da; putative annotation: N/A; putative formula: C10H6O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.04,"smiles":null,"spectrum_id":"CCMSLIB00017319704","spectrum_index":53164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 35.0738 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.249,"smiles":null,"spectrum_id":"CCMSLIB00017319705","spectrum_index":53165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3-methoxyphenyl)propylamine CollisionEnergy:102040 (delta mass: 186.1366 Da; putative annotation: N/A; putative formula: C9H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.259,"smiles":null,"spectrum_id":"CCMSLIB00017319706","spectrum_index":53166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 114.0833 Da; putative annotation: N/A; putative formula: C10H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017319707","spectrum_index":53167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 60.0207 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.086,"smiles":null,"spectrum_id":"CCMSLIB00017319708","spectrum_index":53168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 162.0728 Da; putative annotation: N/A; putative formula: C7H16P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.174,"smiles":null,"spectrum_id":"CCMSLIB00017319709","spectrum_index":53169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.beta.-Homoglutamine (delta mass: 112.089 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.181,"smiles":null,"spectrum_id":"CCMSLIB00017319710","spectrum_index":53170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Aminobutyl)hydroxylamine (delta mass: 27.995 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":133.097,"smiles":null,"spectrum_id":"CCMSLIB00017319711","spectrum_index":53171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 105.0427 Da; putative annotation: N/A; putative formula: C3H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.108,"smiles":null,"spectrum_id":"CCMSLIB00017319712","spectrum_index":53172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 247.2931 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.39,"smiles":null,"spectrum_id":"CCMSLIB00017319713","spectrum_index":53173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 100.0497 Da; putative annotation: N/A; putative formula: CH4N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.12,"smiles":null,"spectrum_id":"CCMSLIB00017319714","spectrum_index":53174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 198.0528 Da; putative annotation: N/A; putative formula: C9H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.155,"smiles":null,"spectrum_id":"CCMSLIB00017319715","spectrum_index":53175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxo-3-hydroxylysergic acid diethylamide (delta mass: 46.0308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.228,"smiles":null,"spectrum_id":"CCMSLIB00017319716","spectrum_index":53176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Leu (delta mass: 71.0368 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.181,"smiles":null,"spectrum_id":"CCMSLIB00017319717","spectrum_index":53177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corytuberine (delta mass: 1.9794 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.134,"smiles":null,"spectrum_id":"CCMSLIB00017319718","spectrum_index":53178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 46.9897 Da; putative annotation: N/A; putative formula: H2NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.086,"smiles":null,"spectrum_id":"CCMSLIB00017319719","spectrum_index":53179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 94.0784 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.201,"smiles":null,"spectrum_id":"CCMSLIB00017319720","spectrum_index":53180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 41.0267 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.107,"smiles":null,"spectrum_id":"CCMSLIB00017319721","spectrum_index":53181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Arg (delta mass: 26.028 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.2,"smiles":null,"spectrum_id":"CCMSLIB00017319722","spectrum_index":53182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 390.1103 Da; putative annotation: N/A; putative formula: C23H18O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.212,"smiles":null,"spectrum_id":"CCMSLIB00017319723","spectrum_index":53183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 116.0476 Da; putative annotation: N/A; putative formula: C5H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.16,"smiles":null,"spectrum_id":"CCMSLIB00017319724","spectrum_index":53184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 89.0458 Da; putative annotation: N/A; putative formula: C3H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.091,"smiles":null,"spectrum_id":"CCMSLIB00017319725","spectrum_index":53185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cephalexin (delta mass: 107.0376 Da; putative annotation: N/A; putative formula: C6H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":455.139,"smiles":null,"spectrum_id":"CCMSLIB00017319726","spectrum_index":53186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 151.0636 Da; putative annotation: Pyridoxine; putative formula: C8H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.187,"smiles":null,"spectrum_id":"CCMSLIB00017319727","spectrum_index":53187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 244.1056 Da; putative annotation: 1-Dehydroperuvinine; putative formula: C15H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.15,"smiles":null,"spectrum_id":"CCMSLIB00017319728","spectrum_index":53188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 296.1753 Da; putative annotation: all-trans-4-Ketoretinoic acid; putative formula: C20H24O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.287,"smiles":null,"spectrum_id":"CCMSLIB00017319729","spectrum_index":53189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 312.1369 Da; putative annotation: Tetrahydrosappanone A Trimethyl Ether; putative formula: C19H20O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.213,"smiles":null,"spectrum_id":"CCMSLIB00017319730","spectrum_index":53190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 129.0594 Da; putative annotation: 3-Methyloxyindole; AIF; CE0; MS2Dec; putative formula: C9H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.13,"smiles":null,"spectrum_id":"CCMSLIB00017319731","spectrum_index":53191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 119.0029 Da; putative annotation: 5-Cyano-2-furoic acid; putative formula: C6HNO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.063,"smiles":null,"spectrum_id":"CCMSLIB00017319732","spectrum_index":53192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 274.1336 Da; putative annotation: N/A; putative formula: C13H23O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.299,"smiles":null,"spectrum_id":"CCMSLIB00017319733","spectrum_index":53193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 154.1155 Da; putative annotation: N/A; putative formula: C13H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.181,"smiles":null,"spectrum_id":"CCMSLIB00017319734","spectrum_index":53194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 8.0416 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":120.081,"smiles":null,"spectrum_id":"CCMSLIB00017319735","spectrum_index":53195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 130.027 Da; putative annotation: N/A; putative formula: C5H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.15,"smiles":null,"spectrum_id":"CCMSLIB00017319736","spectrum_index":53196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 177.1518 Da; putative annotation: N/A; putative formula: C12H19N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.238,"smiles":null,"spectrum_id":"CCMSLIB00017319737","spectrum_index":53197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3R)-3-Amino-4,4-dimethylpentanoic acid (delta mass: 45.0213 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.139,"smiles":null,"spectrum_id":"CCMSLIB00017319738","spectrum_index":53198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 115.1363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.212,"smiles":null,"spectrum_id":"CCMSLIB00017319739","spectrum_index":53199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-isopropyl-1,2,3,4,-tetrahydro-beta-carboline-3-carboxylic acid (delta mass: 41.0001 Da; putative annotation: N/A; putative formula: H-1N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.144,"smiles":null,"spectrum_id":"CCMSLIB00017319740","spectrum_index":53200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-GALACTOSAMINE (delta mass: 130.0241 Da; putative annotation: N/A; putative formula: C9H6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.121,"smiles":null,"spectrum_id":"CCMSLIB00017319741","spectrum_index":53201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5,7-dimethoxy-4-oxochromen-2-yl)propanoic acid (delta mass: 18.0637 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.15,"smiles":null,"spectrum_id":"CCMSLIB00017319742","spectrum_index":53202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(Methylamino)-3-[2-(trifluoromethyl)phenoxy]-2-propanol (delta mass: 195.1313 Da; putative annotation: N/A; putative formula: C11H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.236,"smiles":null,"spectrum_id":"CCMSLIB00017319743","spectrum_index":53203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Indoleacrylic acid; LC-tDDA; CE10 (delta mass: 105.0797 Da; putative annotation: N/A; putative formula: H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.15,"smiles":null,"spectrum_id":"CCMSLIB00017319744","spectrum_index":53204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 67.041 Da; putative annotation: N/A; putative formula: C4H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.117,"smiles":null,"spectrum_id":"CCMSLIB00017319745","spectrum_index":53205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 102.0787 Da; putative annotation: N/A; putative formula: C4H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.165,"smiles":null,"spectrum_id":"CCMSLIB00017319746","spectrum_index":53206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 399.2428 Da; putative annotation: N/A; putative formula: C25H29N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.344,"smiles":null,"spectrum_id":"CCMSLIB00017319747","spectrum_index":53207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 74.0492 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.234,"smiles":null,"spectrum_id":"CCMSLIB00017319748","spectrum_index":53208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 52.0308 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017319749","spectrum_index":53209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 54.0466 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.169,"smiles":null,"spectrum_id":"CCMSLIB00017319750","spectrum_index":53210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 41.1195 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.289,"smiles":null,"spectrum_id":"CCMSLIB00017319751","spectrum_index":53211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 127.0493 Da; putative annotation: N/A; putative formula: C3H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.172,"smiles":null,"spectrum_id":"CCMSLIB00017319752","spectrum_index":53212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 285.061 Da; putative annotation: N/A; putative formula: C11H7N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":463.147,"smiles":null,"spectrum_id":"CCMSLIB00017319753","spectrum_index":53213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 133.0529 Da; putative annotation: N/A; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.145,"smiles":null,"spectrum_id":"CCMSLIB00017319754","spectrum_index":53214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(3,4-dimethoxyphenethyl)-1H-indole-3-carboxamide (delta mass: 45.0553 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.21,"smiles":null,"spectrum_id":"CCMSLIB00017319755","spectrum_index":53215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Hydroxymorphine (delta mass: 262.1575 Da; putative annotation: N/A; putative formula: C16H22O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.296,"smiles":null,"spectrum_id":"CCMSLIB00017319756","spectrum_index":53216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 211.1007 Da; putative annotation: N/A; putative formula: C7H13N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.128,"smiles":null,"spectrum_id":"CCMSLIB00017319757","spectrum_index":53217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"6,7-dimethoxy-1-benzyl-1,2,3,4-tetrahydroisoquinoline CollisionEnergy:102040\"\" (delta mass: 60.079 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.243,"smiles":null,"spectrum_id":"CCMSLIB00017319758","spectrum_index":53218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-MANNOSAMINE (delta mass: 88.0069 Da; putative annotation: N/A; putative formula: C5N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.094,"smiles":null,"spectrum_id":"CCMSLIB00017319759","spectrum_index":53219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 175.0634 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":430.197,"smiles":null,"spectrum_id":"CCMSLIB00017319760","spectrum_index":53220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyethyl)-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile (delta mass: 46.0022 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.11,"smiles":null,"spectrum_id":"CCMSLIB00017319761","spectrum_index":53221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 415.1329 Da; putative annotation: N/A; putative formula: C20H17N9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.193,"smiles":null,"spectrum_id":"CCMSLIB00017319762","spectrum_index":53222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 192.1875 Da; putative annotation: N/A; putative formula: C14H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":537.321,"smiles":null,"spectrum_id":"CCMSLIB00017319763","spectrum_index":53223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 63.0466 Da; putative annotation: N/A; putative formula: C5H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.084,"smiles":null,"spectrum_id":"CCMSLIB00017319764","spectrum_index":53224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopentylacetic acid (delta mass: 64.0681 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.17,"smiles":null,"spectrum_id":"CCMSLIB00017319765","spectrum_index":53225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 206.0243 Da; putative annotation: N/A; putative formula: C9H7N2O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.1,"smiles":null,"spectrum_id":"CCMSLIB00017319766","spectrum_index":53226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Hydroxymethyl)-6,7-dimethylquinolin-2-ol (delta mass: 155.0982 Da; putative annotation: N/A; putative formula: C7H14N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.2,"smiles":null,"spectrum_id":"CCMSLIB00017319767","spectrum_index":53227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 306.2571 Da; putative annotation: N/A; putative formula: C20H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.432,"smiles":null,"spectrum_id":"CCMSLIB00017319768","spectrum_index":53228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of KF 77AG6 (delta mass: 458.2395 Da; putative annotation: N/A; putative formula: C18H39N2O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":824.417,"smiles":null,"spectrum_id":"CCMSLIB00017319769","spectrum_index":53229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 27.0084 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":188.068,"smiles":null,"spectrum_id":"CCMSLIB00017319770","spectrum_index":53230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 92.0251 Da; putative annotation: N/A; putative formula: H5N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.096,"smiles":null,"spectrum_id":"CCMSLIB00017319771","spectrum_index":53231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 1.9134 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.989,"smiles":null,"spectrum_id":"CCMSLIB00017319772","spectrum_index":53232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 118.0419 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.279,"smiles":null,"spectrum_id":"CCMSLIB00017319773","spectrum_index":53233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 282.2193 Da; putative annotation: N/A; putative formula: C17H30O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.331,"smiles":null,"spectrum_id":"CCMSLIB00017319774","spectrum_index":53234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 27.0797 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.096,"smiles":null,"spectrum_id":"CCMSLIB00017319775","spectrum_index":53235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 163.0845 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.134,"smiles":null,"spectrum_id":"CCMSLIB00017319776","spectrum_index":53236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 665.3241 Da; putative annotation: N/A; putative formula: C37H44N7O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":828.384,"smiles":null,"spectrum_id":"CCMSLIB00017319777","spectrum_index":53237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 81.0087 Da; putative annotation: N/A; putative formula: CH-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.137,"smiles":null,"spectrum_id":"CCMSLIB00017319778","spectrum_index":53238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 89.0531 Da; putative annotation: N/A; putative formula: C2H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.233,"smiles":null,"spectrum_id":"CCMSLIB00017319779","spectrum_index":53239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 69.0583 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.145,"smiles":null,"spectrum_id":"CCMSLIB00017319780","spectrum_index":53240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 130.1107 Da; putative annotation: N/A; putative formula: C6H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.186,"smiles":null,"spectrum_id":"CCMSLIB00017319781","spectrum_index":53241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 466.1684 Da; putative annotation: N/A; putative formula: C25H30N4O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.27,"smiles":null,"spectrum_id":"CCMSLIB00017319782","spectrum_index":53242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 88.0538 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.103,"smiles":null,"spectrum_id":"CCMSLIB00017319783","spectrum_index":53243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-pyruvic acid (delta mass: 85.0905 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.156,"smiles":null,"spectrum_id":"CCMSLIB00017319784","spectrum_index":53244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-methylphenethylamine (delta mass: 159.0898 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.223,"smiles":null,"spectrum_id":"CCMSLIB00017319785","spectrum_index":53245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 71.0371 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.102,"smiles":null,"spectrum_id":"CCMSLIB00017319786","spectrum_index":53246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Pro (delta mass: 84.0209 Da; putative annotation: N/A; putative formula: C4H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.134,"smiles":null,"spectrum_id":"CCMSLIB00017319787","spectrum_index":53247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 127.0626 Da; putative annotation: N/A; putative formula: C6H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.197,"smiles":null,"spectrum_id":"CCMSLIB00017319788","spectrum_index":53248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Chloro-N-(2-naphthyl)acetamide (delta mass: 55.0888 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.141,"smiles":null,"spectrum_id":"CCMSLIB00017319789","spectrum_index":53249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 128.1611 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.288,"smiles":null,"spectrum_id":"CCMSLIB00017319790","spectrum_index":53250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Pro (delta mass: 42.0144 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.128,"smiles":null,"spectrum_id":"CCMSLIB00017319791","spectrum_index":53251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 105.9969 Da; putative annotation: N/A; putative formula: C6H3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.083,"smiles":null,"spectrum_id":"CCMSLIB00017319792","spectrum_index":53252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 36.9949 Da; putative annotation: N/A; putative formula: C2H-1N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.071,"smiles":null,"spectrum_id":"CCMSLIB00017319793","spectrum_index":53253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 18.1042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":362.253,"smiles":null,"spectrum_id":"CCMSLIB00017319794","spectrum_index":53254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 42.9725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.032,"smiles":null,"spectrum_id":"CCMSLIB00017319795","spectrum_index":53255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 276.0947 Da; putative annotation: N/A; putative formula: C14H18N2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.175,"smiles":null,"spectrum_id":"CCMSLIB00017319796","spectrum_index":53256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 36.9236 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.015,"smiles":null,"spectrum_id":"CCMSLIB00017319797","spectrum_index":53257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-DIHYDROXY-L-PHENYLALANINE - 40.0 eV (delta mass: 30.0253 Da; putative annotation: N/A; putative formula: H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":228.101,"smiles":null,"spectrum_id":"CCMSLIB00017319798","spectrum_index":53258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 196.0331 Da; putative annotation: N/A; putative formula: C4H8N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.124,"smiles":null,"spectrum_id":"CCMSLIB00017319799","spectrum_index":53259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 37.9895 Da; putative annotation: N/A; putative formula: CH-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.07,"smiles":null,"spectrum_id":"CCMSLIB00017319800","spectrum_index":53260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 308.2863 Da; putative annotation: N/A; putative formula: C24H36O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.415,"smiles":null,"spectrum_id":"CCMSLIB00017319801","spectrum_index":53261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 483.1944 Da; putative annotation: N/A; putative formula: C32H25N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.296,"smiles":null,"spectrum_id":"CCMSLIB00017319802","spectrum_index":53262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 665.2381 Da; putative annotation: N/A; putative formula: C38H39N3O4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":846.309,"smiles":null,"spectrum_id":"CCMSLIB00017319803","spectrum_index":53263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 168.0566 Da; putative annotation: N/A; putative formula: C12H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.127,"smiles":null,"spectrum_id":"CCMSLIB00017319804","spectrum_index":53264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaritine (delta mass: 41.0703 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.22,"smiles":null,"spectrum_id":"CCMSLIB00017319805","spectrum_index":53265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 25.0095 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":187.101,"smiles":null,"spectrum_id":"CCMSLIB00017319806","spectrum_index":53266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltopentaose (delta mass: 113.0815 Da; putative annotation: N/A; putative formula: C2H7N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":942.364,"smiles":null,"spectrum_id":"CCMSLIB00017319807","spectrum_index":53267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 99.069 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017319808","spectrum_index":53268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-UNDECEN-1-OL (delta mass: 70.0785 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.253,"smiles":null,"spectrum_id":"CCMSLIB00017319809","spectrum_index":53269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 92.0496 Da; putative annotation: N/A; putative formula: C4H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.13,"smiles":null,"spectrum_id":"CCMSLIB00017319810","spectrum_index":53270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 109.0527 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.155,"smiles":null,"spectrum_id":"CCMSLIB00017319811","spectrum_index":53271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 211.1499 Da; putative annotation: N/A; putative formula: C11H21N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.226,"smiles":null,"spectrum_id":"CCMSLIB00017319812","spectrum_index":53272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 370.3021 Da; putative annotation: N/A; putative formula: C29H38O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":557.425,"smiles":null,"spectrum_id":"CCMSLIB00017319813","spectrum_index":53273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 194.0733 Da; putative annotation: N/A; putative formula: C14H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.139,"smiles":null,"spectrum_id":"CCMSLIB00017319814","spectrum_index":53274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 180.094 Da; putative annotation: N/A; putative formula: C14H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.16,"smiles":null,"spectrum_id":"CCMSLIB00017319815","spectrum_index":53275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile (delta mass: 188.0728 Da; putative annotation: N/A; putative formula: C6H12N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.085,"smiles":null,"spectrum_id":"CCMSLIB00017319816","spectrum_index":53276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-N-methyl-N-isopropyltryptamine (delta mass: 193.0738 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.239,"smiles":null,"spectrum_id":"CCMSLIB00017319817","spectrum_index":53277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid (delta mass: 39.0174 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.076,"smiles":null,"spectrum_id":"CCMSLIB00017319818","spectrum_index":53278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3-Bis(hydroxymethyl)-1,3-dihydro-2H-benzimidazole-2-thione (delta mass: 343.0621 Da; putative annotation: N/A; putative formula: C16H13N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.116,"smiles":null,"spectrum_id":"CCMSLIB00017319819","spectrum_index":53279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 160.027 Da; putative annotation: N/A; putative formula: C8H4N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.145,"smiles":null,"spectrum_id":"CCMSLIB00017319820","spectrum_index":53280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyomeprazole sulfide (delta mass: 180.0734 Da; putative annotation: N/A; putative formula: C2H4N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.185,"smiles":null,"spectrum_id":"CCMSLIB00017319821","spectrum_index":53281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin F (delta mass: 70.0418 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.321,"smiles":null,"spectrum_id":"CCMSLIB00017319822","spectrum_index":53282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cytidine 5'-diphosphate ethanolamine (delta mass: 323.0556 Da; putative annotation: N/A; putative formula: C14H14NO6P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":770.123,"smiles":null,"spectrum_id":"CCMSLIB00017319823","spectrum_index":53283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 71.9148 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.98,"smiles":null,"spectrum_id":"CCMSLIB00017319824","spectrum_index":53284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolidine CollisionEnergy:102040 (delta mass: 18.0833 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.217,"smiles":null,"spectrum_id":"CCMSLIB00017319825","spectrum_index":53285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 195.0768 Da; putative annotation: N/A; putative formula: C12H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.152,"smiles":null,"spectrum_id":"CCMSLIB00017319826","spectrum_index":53286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 50.0145 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.09,"smiles":null,"spectrum_id":"CCMSLIB00017319827","spectrum_index":53287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Aminoethyl)-2-methyl-1H-indole-5-carbonitrile (delta mass: 59.0834 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.202,"smiles":null,"spectrum_id":"CCMSLIB00017319828","spectrum_index":53288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorophenyl)-2-(isopropylamino)ethanol (delta mass: 69.0196 Da; putative annotation: N/A; putative formula: C3H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.119,"smiles":null,"spectrum_id":"CCMSLIB00017319829","spectrum_index":53289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 225.0671 Da; putative annotation: N/A; putative formula: C7H15NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.147,"smiles":null,"spectrum_id":"CCMSLIB00017319830","spectrum_index":53290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 588.2196 Da; putative annotation: N/A; putative formula: C24H37N4O11P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":800.348,"smiles":null,"spectrum_id":"CCMSLIB00017319831","spectrum_index":53291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 59.0377 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.161,"smiles":null,"spectrum_id":"CCMSLIB00017319832","spectrum_index":53292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000692 Lactose (delta mass: 143.0582 Da; putative annotation: N/A; putative formula: C6H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.182,"smiles":null,"spectrum_id":"CCMSLIB00017319833","spectrum_index":53293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 568.4676 Da; putative annotation: N/A; putative formula: C30H60N6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":754.539,"smiles":null,"spectrum_id":"CCMSLIB00017319834","spectrum_index":53294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 62.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.175,"smiles":null,"spectrum_id":"CCMSLIB00017319835","spectrum_index":53295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-propanoic acid (delta mass: 187.0582 Da; putative annotation: N/A; putative formula: C8H14NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.145,"smiles":null,"spectrum_id":"CCMSLIB00017319836","spectrum_index":53296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolidine (delta mass: 185.1528 Da; putative annotation: N/A; putative formula: C9H19N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.286,"smiles":null,"spectrum_id":"CCMSLIB00017319837","spectrum_index":53297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 335.1232 Da; putative annotation: N/A; putative formula: C15H29NO-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.225,"smiles":null,"spectrum_id":"CCMSLIB00017319838","spectrum_index":53298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 160.047 Da; putative annotation: N/A; putative formula: C7H13PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.123,"smiles":null,"spectrum_id":"CCMSLIB00017319839","spectrum_index":53299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hydrastinine (delta mass: 73.0432 Da; putative annotation: N/A; putative formula: C3H8NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.14,"smiles":null,"spectrum_id":"CCMSLIB00017319840","spectrum_index":53300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 841.5353 Da; putative annotation: N/A; putative formula: C49H71N5O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.611,"smiles":null,"spectrum_id":"CCMSLIB00017319841","spectrum_index":53301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 133.039 Da; putative annotation: N/A; putative formula: C5H3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.163,"smiles":null,"spectrum_id":"CCMSLIB00017319842","spectrum_index":53302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 475.3092 Da; putative annotation: N/A; putative formula: C24H41N7OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.385,"smiles":null,"spectrum_id":"CCMSLIB00017319843","spectrum_index":53303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Roccellaric acid (delta mass: 80.0621 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.315,"smiles":null,"spectrum_id":"CCMSLIB00017319844","spectrum_index":53304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine (delta mass: 59.0367 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.133,"smiles":null,"spectrum_id":"CCMSLIB00017319845","spectrum_index":53305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 171.0537 Da; putative annotation: N/A; putative formula: C8H13NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.14,"smiles":null,"spectrum_id":"CCMSLIB00017319846","spectrum_index":53306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nalbuphine (delta mass: 16.0315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.233,"smiles":null,"spectrum_id":"CCMSLIB00017319847","spectrum_index":53307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 117.0449 Da; putative annotation: N/A; putative formula: C3H8N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.153,"smiles":null,"spectrum_id":"CCMSLIB00017319848","spectrum_index":53308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 158.0217 Da; putative annotation: N/A; putative formula: C6H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.087,"smiles":null,"spectrum_id":"CCMSLIB00017319849","spectrum_index":53309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PyroGlu-Glu-Lys (delta mass: 17.0239 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.211,"smiles":null,"spectrum_id":"CCMSLIB00017319850","spectrum_index":53310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline CollisionEnergy:102040\"\" (delta mass: 230.121 Da; putative annotation: N/A; putative formula: C2H10N14)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.27,"smiles":null,"spectrum_id":"CCMSLIB00017319851","spectrum_index":53311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 30.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.237,"smiles":null,"spectrum_id":"CCMSLIB00017319852","spectrum_index":53312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 672.6065 Da; putative annotation: N/A; putative formula: C45H76N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.704,"smiles":null,"spectrum_id":"CCMSLIB00017319853","spectrum_index":53313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 859.5919 Da; putative annotation: N/A; putative formula: C48H81N3O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1151.7,"smiles":null,"spectrum_id":"CCMSLIB00017319854","spectrum_index":53314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-3-Hexen-1-ol (delta mass: 192.1363 Da; putative annotation: N/A; putative formula: C10H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.232,"smiles":null,"spectrum_id":"CCMSLIB00017319855","spectrum_index":53315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine (delta mass: 104.047 Da; putative annotation: N/A; putative formula: C4H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.185,"smiles":null,"spectrum_id":"CCMSLIB00017319856","spectrum_index":53316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 678.2527 Da; putative annotation: N/A; putative formula: C47H38N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":897.354,"smiles":null,"spectrum_id":"CCMSLIB00017319857","spectrum_index":53317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 83.0027 Da; putative annotation: N/A; putative formula: C2H2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.014,"smiles":null,"spectrum_id":"CCMSLIB00017319858","spectrum_index":53318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 74.0467 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.118,"smiles":null,"spectrum_id":"CCMSLIB00017319859","spectrum_index":53319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 77.0896 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.223,"smiles":null,"spectrum_id":"CCMSLIB00017319860","spectrum_index":53320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 172.0955 Da; putative annotation: N/A; putative formula: C6H12N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.171,"smiles":null,"spectrum_id":"CCMSLIB00017319861","spectrum_index":53321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 275.2136 Da; putative annotation: N/A; putative formula: C13H30N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.299,"smiles":null,"spectrum_id":"CCMSLIB00017319862","spectrum_index":53322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 244.0943 Da; putative annotation: N/A; putative formula: C11H16O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.154,"smiles":null,"spectrum_id":"CCMSLIB00017319863","spectrum_index":53323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004503 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 47.0475 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.144,"smiles":null,"spectrum_id":"CCMSLIB00017319864","spectrum_index":53324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-nitrophenethylamine (delta mass: 108.0476 Da; putative annotation: N/A; putative formula: C7H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.15,"smiles":null,"spectrum_id":"CCMSLIB00017319865","spectrum_index":53325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 14.016 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.155,"smiles":null,"spectrum_id":"CCMSLIB00017319866","spectrum_index":53326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 98.0728 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.154,"smiles":null,"spectrum_id":"CCMSLIB00017319867","spectrum_index":53327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 62.0516 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.127,"smiles":null,"spectrum_id":"CCMSLIB00017319868","spectrum_index":53328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 175.1208 Da; putative annotation: N/A; putative formula: C8H17NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.16,"smiles":null,"spectrum_id":"CCMSLIB00017319869","spectrum_index":53329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 101.0469 Da; putative annotation: L-Homoserine; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.176,"smiles":null,"spectrum_id":"CCMSLIB00017319870","spectrum_index":53330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 231.072 Da; putative annotation: Gln-Cys; putative formula: C8H13N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.143,"smiles":null,"spectrum_id":"CCMSLIB00017319871","spectrum_index":53331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 242.0939 Da; putative annotation: Parishin C; putative formula: C15H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.159,"smiles":null,"spectrum_id":"CCMSLIB00017319872","spectrum_index":53332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 346.1819 Da; putative annotation: N/A; putative formula: C18H34S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.253,"smiles":null,"spectrum_id":"CCMSLIB00017319873","spectrum_index":53333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310692 Disaccharide(Hex-Hex) (delta mass: 179.0795 Da; putative annotation: N/A; putative formula: C6H13NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.203,"smiles":null,"spectrum_id":"CCMSLIB00017319874","spectrum_index":53334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 106.0732 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.259,"smiles":null,"spectrum_id":"CCMSLIB00017319875","spectrum_index":53335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of URIDINE 5'-DIPHOSPHO-N-ACETYLGALACTOSAMINE (delta mass: 49.1464 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":657.235,"smiles":null,"spectrum_id":"CCMSLIB00017319876","spectrum_index":53336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 270.1576 Da; putative annotation: N/A; putative formula: C13H22N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.218,"smiles":null,"spectrum_id":"CCMSLIB00017319877","spectrum_index":53337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 52.0338 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.112,"smiles":null,"spectrum_id":"CCMSLIB00017319878","spectrum_index":53338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 425.3505 Da; putative annotation: N/A; putative formula: C25H47NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":644.452,"smiles":null,"spectrum_id":"CCMSLIB00017319879","spectrum_index":53339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 408.3236 Da; putative annotation: N/A; putative formula: C25H44O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":627.425,"smiles":null,"spectrum_id":"CCMSLIB00017319880","spectrum_index":53340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,5S)-8-Methyl-8-azabicyclo[3.2.1]octan-3-amine (delta mass: 182.2025 Da; putative annotation: N/A; putative formula: C13H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.341,"smiles":null,"spectrum_id":"CCMSLIB00017319881","spectrum_index":53341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 192.1306 Da; putative annotation: N/A; putative formula: C16H16O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.206,"smiles":null,"spectrum_id":"CCMSLIB00017319882","spectrum_index":53342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 17.0647 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.25,"smiles":null,"spectrum_id":"CCMSLIB00017319883","spectrum_index":53343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 765.3927 Da; putative annotation: N/A; putative formula: C33H60N5O13P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":972.479,"smiles":null,"spectrum_id":"CCMSLIB00017319884","spectrum_index":53344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phenol, 4-(2-aminoethyl)- from NIST14 (delta mass: 92.056 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.147,"smiles":null,"spectrum_id":"CCMSLIB00017319885","spectrum_index":53345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 67.1964 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.247,"smiles":null,"spectrum_id":"CCMSLIB00017319886","spectrum_index":53346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Nitrophenyl)-1H-indole (delta mass: 49.0624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.144,"smiles":null,"spectrum_id":"CCMSLIB00017319887","spectrum_index":53347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 9.3409 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.5,"smiles":null,"spectrum_id":"CCMSLIB00017319888","spectrum_index":53348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 204.1005 Da; putative annotation: N/A; putative formula: C10H20S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.192,"smiles":null,"spectrum_id":"CCMSLIB00017319889","spectrum_index":53349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 41.0513 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.148,"smiles":null,"spectrum_id":"CCMSLIB00017319890","spectrum_index":53350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 244.1322 Da; putative annotation: N/A; putative formula: C13H24S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.244,"smiles":null,"spectrum_id":"CCMSLIB00017319891","spectrum_index":53351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 128.0474 Da; putative annotation: N/A; putative formula: C6H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.159,"smiles":null,"spectrum_id":"CCMSLIB00017319892","spectrum_index":53352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 240.1876 Da; putative annotation: N/A; putative formula: C18H24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":583.311,"smiles":null,"spectrum_id":"CCMSLIB00017319893","spectrum_index":53353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2S,3R)-2-(((S)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(5-chloropyridin-2-yl)-3-methylpentanamide (delta mass: 276.303 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":885.55,"smiles":null,"spectrum_id":"CCMSLIB00017319894","spectrum_index":53354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 120.0999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.39,"smiles":null,"spectrum_id":"CCMSLIB00017319895","spectrum_index":53355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 70.9219 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.982,"smiles":null,"spectrum_id":"CCMSLIB00017319896","spectrum_index":53356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2.alpha.-Mannobiose from NIST14 (delta mass: 147.0465 Da; putative annotation: N/A; putative formula: C4H9N3OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.17,"smiles":null,"spectrum_id":"CCMSLIB00017319897","spectrum_index":53357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-3-Benzazepine-7,8-diol, 6-chloro-2,3,4,5-tetrahydro-1-phenyl- (delta mass: 63.0393 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.134,"smiles":null,"spectrum_id":"CCMSLIB00017319898","spectrum_index":53358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOSYLAMINE (delta mass: 403.1941 Da; putative annotation: N/A; putative formula: C14H21N13O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":624.307,"smiles":null,"spectrum_id":"CCMSLIB00017319899","spectrum_index":53359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Xylose (delta mass: 97.978 Da; putative annotation: N/A; putative formula: CH-1N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.038,"smiles":null,"spectrum_id":"CCMSLIB00017319900","spectrum_index":53360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 17.1548 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.258,"smiles":null,"spectrum_id":"CCMSLIB00017319901","spectrum_index":53361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphylloside (delta mass: 116.0681 Da; putative annotation: N/A; putative formula: C3H8N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.28,"smiles":null,"spectrum_id":"CCMSLIB00017319902","spectrum_index":53362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 193.5505 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.647,"smiles":null,"spectrum_id":"CCMSLIB00017319903","spectrum_index":53363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-7-ol (delta mass: 14.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.071,"smiles":null,"spectrum_id":"CCMSLIB00017319904","spectrum_index":53364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-3,4-(methylenedioxy)benzylamine (delta mass: 29.0292 Da; putative annotation: N/A; putative formula: CH3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.115,"smiles":null,"spectrum_id":"CCMSLIB00017319905","spectrum_index":53365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 105.0691 Da; putative annotation: N/A; putative formula: C6H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.155,"smiles":null,"spectrum_id":"CCMSLIB00017319906","spectrum_index":53366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 28.0306 Da; putative annotation: N/A; putative formula: C2H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.042,"smiles":null,"spectrum_id":"CCMSLIB00017319907","spectrum_index":53367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-hydroxy-1H-indole-3-carboxylate (delta mass: 50.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.102,"smiles":null,"spectrum_id":"CCMSLIB00017319908","spectrum_index":53368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006102 Tyramine|4-(2-aminoethyl)phenol (delta mass: 99.0338 Da; putative annotation: N/A; putative formula: C3H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.125,"smiles":null,"spectrum_id":"CCMSLIB00017319909","spectrum_index":53369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 93.1154 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.269,"smiles":null,"spectrum_id":"CCMSLIB00017319910","spectrum_index":53370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 130.0671 Da; putative annotation: N/A; putative formula: C4H10N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.138,"smiles":null,"spectrum_id":"CCMSLIB00017319911","spectrum_index":53371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 294.2918 Da; putative annotation: N/A; putative formula: C20H38O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":903.563,"smiles":null,"spectrum_id":"CCMSLIB00017319912","spectrum_index":53372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-DL-valine (delta mass: 88.0153 Da; putative annotation: N/A; putative formula: C3H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.112,"smiles":null,"spectrum_id":"CCMSLIB00017319913","spectrum_index":53373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 121.9786 Da; putative annotation: N/A; putative formula: CH2N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.059,"smiles":null,"spectrum_id":"CCMSLIB00017319914","spectrum_index":53374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans-8, trans-10-Dodecadien-1-ol (delta mass: 90.0319 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.206,"smiles":null,"spectrum_id":"CCMSLIB00017319915","spectrum_index":53375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET140301 PAR_146.0966_8.3|N-propargylbenzylamine|N-benzylprop-2-yn-1-amine (delta mass: 12.8666 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.963,"smiles":null,"spectrum_id":"CCMSLIB00017319916","spectrum_index":53376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 74.0356 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.205,"smiles":null,"spectrum_id":"CCMSLIB00017319917","spectrum_index":53377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 245.2348 Da; putative annotation: N/A; putative formula: C10H27N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.31,"smiles":null,"spectrum_id":"CCMSLIB00017319918","spectrum_index":53378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 80.0629 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.107,"smiles":null,"spectrum_id":"CCMSLIB00017319919","spectrum_index":53379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxymethamphetamine (delta mass: 319.1479 Da; putative annotation: N/A; putative formula: C15H23N5O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.266,"smiles":null,"spectrum_id":"CCMSLIB00017319920","spectrum_index":53380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3E)-3-(4-Hydroxybenzylidene)-1,3-dihydro-2H-indol-2-one (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.123,"smiles":null,"spectrum_id":"CCMSLIB00017319921","spectrum_index":53381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 235.1717 Da; putative annotation: N/A; putative formula: C18H21NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.268,"smiles":null,"spectrum_id":"CCMSLIB00017319922","spectrum_index":53382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 46.0175 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.099,"smiles":null,"spectrum_id":"CCMSLIB00017319923","spectrum_index":53383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 8.9829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.06,"smiles":null,"spectrum_id":"CCMSLIB00017319924","spectrum_index":53384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 161.0698 Da; putative annotation: N/A; putative formula: C7H15NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.156,"smiles":null,"spectrum_id":"CCMSLIB00017319925","spectrum_index":53385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 81.0597 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.138,"smiles":null,"spectrum_id":"CCMSLIB00017319926","spectrum_index":53386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 136.1281 Da; putative annotation: N/A; putative formula: C10H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.199,"smiles":null,"spectrum_id":"CCMSLIB00017319927","spectrum_index":53387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Hydroxyethyl)-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile (delta mass: 113.0892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.197,"smiles":null,"spectrum_id":"CCMSLIB00017319928","spectrum_index":53388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 294.2557 Da; putative annotation: N/A; putative formula: C19H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.415,"smiles":null,"spectrum_id":"CCMSLIB00017319929","spectrum_index":53389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 12.0566 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.148,"smiles":null,"spectrum_id":"CCMSLIB00017319930","spectrum_index":53390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 662.6297 Da; putative annotation: N/A; putative formula: C38H78N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":848.701,"smiles":null,"spectrum_id":"CCMSLIB00017319931","spectrum_index":53391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:SM801802 2-Methylindole|2-METHYLINDOLE|2-methyl-1H-indole (delta mass: 268.2732 Da; putative annotation: N/A; putative formula: C14H32N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.354,"smiles":null,"spectrum_id":"CCMSLIB00017319932","spectrum_index":53392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 318.2562 Da; putative annotation: N/A; putative formula: C21H34O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":661.38,"smiles":null,"spectrum_id":"CCMSLIB00017319933","spectrum_index":53393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-tryptophanamide (delta mass: 17.0351 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.159,"smiles":null,"spectrum_id":"CCMSLIB00017319934","spectrum_index":53394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 143.0415 Da; putative annotation: N/A; putative formula: C6H11NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.128,"smiles":null,"spectrum_id":"CCMSLIB00017319935","spectrum_index":53395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 222.0942 Da; putative annotation: N/A; putative formula: C10H14N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.144,"smiles":null,"spectrum_id":"CCMSLIB00017319936","spectrum_index":53396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 80.0628 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.487,"smiles":null,"spectrum_id":"CCMSLIB00017319937","spectrum_index":53397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of C-mavacurine (delta mass: 216.0819 Da; putative annotation: N/A; putative formula: C10H16O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.278,"smiles":null,"spectrum_id":"CCMSLIB00017319938","spectrum_index":53398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 454.2866 Da; putative annotation: N/A; putative formula: C24H42N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":785.441,"smiles":null,"spectrum_id":"CCMSLIB00017319939","spectrum_index":53399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 625.3397 Da; putative annotation: N/A; putative formula: C31H51N3O8S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":927.478,"smiles":null,"spectrum_id":"CCMSLIB00017319940","spectrum_index":53400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 88.0523 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.175,"smiles":null,"spectrum_id":"CCMSLIB00017319941","spectrum_index":53401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 175.0343 Da; putative annotation: N/A; putative formula: C3H5N5O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.173,"smiles":null,"spectrum_id":"CCMSLIB00017319942","spectrum_index":53402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 193.192 Da; putative annotation: N/A; putative formula: C12H23N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.258,"smiles":null,"spectrum_id":"CCMSLIB00017319943","spectrum_index":53403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 382.724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":725.847,"smiles":null,"spectrum_id":"CCMSLIB00017319944","spectrum_index":53404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 115.9994 Da; putative annotation: N/A; putative formula: C6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.086,"smiles":null,"spectrum_id":"CCMSLIB00017319945","spectrum_index":53405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 24.0841 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.171,"smiles":null,"spectrum_id":"CCMSLIB00017319946","spectrum_index":53406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1-methyl-1H-pyrrole-2-carboxylic acid (delta mass: 45.1064 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.122,"smiles":null,"spectrum_id":"CCMSLIB00017319947","spectrum_index":53407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cys-Asp (delta mass: 129.0416 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.096,"smiles":null,"spectrum_id":"CCMSLIB00017319948","spectrum_index":53408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 110.1068 Da; putative annotation: N/A; putative formula: C8H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.292,"smiles":null,"spectrum_id":"CCMSLIB00017319949","spectrum_index":53409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 161.0871 Da; putative annotation: N/A; putative formula: C7H15NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.145,"smiles":null,"spectrum_id":"CCMSLIB00017319950","spectrum_index":53410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 120.0939 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":567.368,"smiles":null,"spectrum_id":"CCMSLIB00017319951","spectrum_index":53411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 199.0819 Da; putative annotation: N/A; putative formula: C13H13NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.116,"smiles":null,"spectrum_id":"CCMSLIB00017319952","spectrum_index":53412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 92.0261 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.091,"smiles":null,"spectrum_id":"CCMSLIB00017319953","spectrum_index":53413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 784.3662 Da; putative annotation: N/A; putative formula: C34H60N2O16S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":947.426,"smiles":null,"spectrum_id":"CCMSLIB00017319954","spectrum_index":53414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 569.4612 Da; putative annotation: N/A; putative formula: C40H59NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.537,"smiles":null,"spectrum_id":"CCMSLIB00017319955","spectrum_index":53415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 262.23 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.342,"smiles":null,"spectrum_id":"CCMSLIB00017319956","spectrum_index":53416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 144.9587 Da; putative annotation: N/A; putative formula: C2H-1N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.029,"smiles":null,"spectrum_id":"CCMSLIB00017319957","spectrum_index":53417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C7:0 (delta mass: 156.0786 Da; putative annotation: N/A; putative formula: C8H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.275,"smiles":null,"spectrum_id":"CCMSLIB00017319958","spectrum_index":53418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 206.0212 Da; putative annotation: N/A; putative formula: C10H6O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.165,"smiles":null,"spectrum_id":"CCMSLIB00017319959","spectrum_index":53419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Armepavine (delta mass: 88.0587 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.234,"smiles":null,"spectrum_id":"CCMSLIB00017319960","spectrum_index":53420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile-Arg (delta mass: 267.1282 Da; putative annotation: N/A; putative formula: C16H18N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.353,"smiles":null,"spectrum_id":"CCMSLIB00017319961","spectrum_index":53421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-oxindole-3-acetic acid CollisionEnergy:102040 (delta mass: 130.0261 Da; putative annotation: N/A; putative formula: C5H6O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.092,"smiles":null,"spectrum_id":"CCMSLIB00017319962","spectrum_index":53422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 1005.6607 Da; putative annotation: N/A; putative formula: C63H92NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1227.76,"smiles":null,"spectrum_id":"CCMSLIB00017319963","spectrum_index":53423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 74.0731 Da; putative annotation: N/A; putative formula: H6N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.175,"smiles":null,"spectrum_id":"CCMSLIB00017319964","spectrum_index":53424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 66.0205 Da; putative annotation: N/A; putative formula: C3H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.107,"smiles":null,"spectrum_id":"CCMSLIB00017319965","spectrum_index":53425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[(2-Methylpropyl)amino]acetic acid (delta mass: 42.0105 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.112,"smiles":null,"spectrum_id":"CCMSLIB00017319966","spectrum_index":53426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 14.0195 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.122,"smiles":null,"spectrum_id":"CCMSLIB00017319967","spectrum_index":53427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Leu (delta mass: 85.0897 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":332.219,"smiles":null,"spectrum_id":"CCMSLIB00017319968","spectrum_index":53428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB000501 5-methoxyindole-3-carbaldehyde (delta mass: 46.0055 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.076,"smiles":null,"spectrum_id":"CCMSLIB00017319969","spectrum_index":53429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 104.0864 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.173,"smiles":null,"spectrum_id":"CCMSLIB00017319970","spectrum_index":53430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 29.0019 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.156,"smiles":null,"spectrum_id":"CCMSLIB00017319971","spectrum_index":53431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 82.0759 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.188,"smiles":null,"spectrum_id":"CCMSLIB00017319972","spectrum_index":53432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7,8-Trihydroxy-3-methyl-1,4-dihydropyrano[4,3-b]chromen-10-one (delta mass: 41.02 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.091,"smiles":null,"spectrum_id":"CCMSLIB00017319973","spectrum_index":53433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 31.1118 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.188,"smiles":null,"spectrum_id":"CCMSLIB00017319974","spectrum_index":53434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 57.0465 Da; putative annotation: N/A; putative formula: H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.102,"smiles":null,"spectrum_id":"CCMSLIB00017319975","spectrum_index":53435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-Hydroxynonenal from NIST14 (delta mass: 57.0216 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017319976","spectrum_index":53436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 132.1757 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.21,"smiles":null,"spectrum_id":"CCMSLIB00017319977","spectrum_index":53437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 193.134 Da; putative annotation: N/A; putative formula: C9H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.283,"smiles":null,"spectrum_id":"CCMSLIB00017319978","spectrum_index":53438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neohesperidose (delta mass: 92.0264 Da; putative annotation: N/A; putative formula: C6H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.155,"smiles":null,"spectrum_id":"CCMSLIB00017319979","spectrum_index":53439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 126.0503 Da; putative annotation: N/A; putative formula: C7H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.209,"smiles":null,"spectrum_id":"CCMSLIB00017319980","spectrum_index":53440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 744.4445 Da; putative annotation: N/A; putative formula: C55H56N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":907.505,"smiles":null,"spectrum_id":"CCMSLIB00017319981","spectrum_index":53441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1s,3s)-3-(Aminomethyl)cyclobutan-1-ol (delta mass: 41.0264 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.118,"smiles":null,"spectrum_id":"CCMSLIB00017319982","spectrum_index":53442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 76.0526 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.17,"smiles":null,"spectrum_id":"CCMSLIB00017319983","spectrum_index":53443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 84.0322 Da; putative annotation: N/A; putative formula: C3H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.129,"smiles":null,"spectrum_id":"CCMSLIB00017319984","spectrum_index":53444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Triethylenetetramine (delta mass: 86.9728 Da; putative annotation: N/A; putative formula: C2H2NO-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.133,"smiles":null,"spectrum_id":"CCMSLIB00017319985","spectrum_index":53445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-(methylsulfanyl)-1H-indole-2-carboxylate (delta mass: 223.0309 Da; putative annotation: N/A; putative formula: C3H9N7OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.089,"smiles":null,"spectrum_id":"CCMSLIB00017319986","spectrum_index":53446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 70.0003 Da; putative annotation: N/A; putative formula: C2H2N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.06,"smiles":null,"spectrum_id":"CCMSLIB00017319987","spectrum_index":53447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 242.2244 Da; putative annotation: N/A; putative formula: C15H30O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.316,"smiles":null,"spectrum_id":"CCMSLIB00017319988","spectrum_index":53448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 255.1255 Da; putative annotation: N/A; putative formula: C16H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.212,"smiles":null,"spectrum_id":"CCMSLIB00017319989","spectrum_index":53449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Naphthyl)-2-naphthamide (delta mass: 96.0481 Da; putative annotation: N/A; putative formula: C6H9O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.171,"smiles":null,"spectrum_id":"CCMSLIB00017319990","spectrum_index":53450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 3-(2-Hydroxyethyl)indole from NIST14 (delta mass: 298.1424 Da; putative annotation: N/A; putative formula: C16H26OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.234,"smiles":null,"spectrum_id":"CCMSLIB00017319991","spectrum_index":53451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 17.0388 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.156,"smiles":null,"spectrum_id":"CCMSLIB00017319992","spectrum_index":53452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 264.1101 Da; putative annotation: N/A; putative formula: C15H21PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.16,"smiles":null,"spectrum_id":"CCMSLIB00017319993","spectrum_index":53453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 416.1339 Da; putative annotation: N/A; putative formula: C20H24N4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":641.246,"smiles":null,"spectrum_id":"CCMSLIB00017319994","spectrum_index":53454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 235.1304 Da; putative annotation: N/A; putative formula: C8H13N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.253,"smiles":null,"spectrum_id":"CCMSLIB00017319995","spectrum_index":53455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 43.9716 Da; putative annotation: N/A; putative formula: CS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":160.042,"smiles":null,"spectrum_id":"CCMSLIB00017319996","spectrum_index":53456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 14.0161 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.123,"smiles":null,"spectrum_id":"CCMSLIB00017319997","spectrum_index":53457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14Z,17Z,20Z,23Z,26Z,29Z-Dotriacontahexaen-1-ol (delta mass: 114.0886 Da; putative annotation: N/A; putative formula: C7H14O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.513,"smiles":null,"spectrum_id":"CCMSLIB00017319998","spectrum_index":53458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 15.9954 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.16,"smiles":null,"spectrum_id":"CCMSLIB00017319999","spectrum_index":53459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 143.0374 Da; putative annotation: N/A; putative formula: C9H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.087,"smiles":null,"spectrum_id":"CCMSLIB00017320000","spectrum_index":53460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (+)-Ritodrine (delta mass: 8.0238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.183,"smiles":null,"spectrum_id":"CCMSLIB00017320001","spectrum_index":53461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU288306 Norharmane|9H-pyrido[3,4-b]indole (delta mass: 25.9885 Da; putative annotation: N/A; putative formula: H-2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.064,"smiles":null,"spectrum_id":"CCMSLIB00017320002","spectrum_index":53462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 17.9491 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.051,"smiles":null,"spectrum_id":"CCMSLIB00017320003","spectrum_index":53463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 31.0058 Da; putative annotation: N/A; putative formula: HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.144,"smiles":null,"spectrum_id":"CCMSLIB00017320004","spectrum_index":53464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benz[a]anthracen-1-ol, 8-methoxy-3-methyl- (delta mass: 90.0526 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017320005","spectrum_index":53465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6aS)-1,2,10-Trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-9-ol (delta mass: 13.0082 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.173,"smiles":null,"spectrum_id":"CCMSLIB00017320006","spectrum_index":53466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 29.0527 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":139.113,"smiles":null,"spectrum_id":"CCMSLIB00017320007","spectrum_index":53467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 35.0361 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.273,"smiles":null,"spectrum_id":"CCMSLIB00017320008","spectrum_index":53468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 128.0658 Da; putative annotation: N/A; putative formula: C7H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.23,"smiles":null,"spectrum_id":"CCMSLIB00017320009","spectrum_index":53469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA000879 Galantamine (delta mass: 60.0154 Da; putative annotation: N/A; putative formula: CH4N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.175,"smiles":null,"spectrum_id":"CCMSLIB00017320010","spectrum_index":53470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ellipticine CollisionEnergy:205060 (delta mass: 170.1138 Da; putative annotation: N/A; putative formula: C3H10N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.237,"smiles":null,"spectrum_id":"CCMSLIB00017320011","spectrum_index":53471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 272.2136 Da; putative annotation: Massbank:AU281801 Epiandrosterone|(3S,5S,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one; putative formula: C19H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.274,"smiles":null,"spectrum_id":"CCMSLIB00017320012","spectrum_index":53472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 162.0527 Da; putative annotation: Spectral Match to D-(+)-Mannose from NIST14; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.123,"smiles":null,"spectrum_id":"CCMSLIB00017320013","spectrum_index":53473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 102.047 Da; putative annotation: 4-Vinylphenol; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.18,"smiles":null,"spectrum_id":"CCMSLIB00017320014","spectrum_index":53474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 922.4933 Da; putative annotation: NCGC00385557-01_C48H76O18_; putative formula: C48H74O17)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1075.57,"smiles":null,"spectrum_id":"CCMSLIB00017320015","spectrum_index":53475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 206.1673 Da; putative annotation: 5-Tetradecynoic acid; putative formula: C14H22O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.254,"smiles":null,"spectrum_id":"CCMSLIB00017320016","spectrum_index":53476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 268.1312 Da; putative annotation: Spicifernin; putative formula: C14H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.243,"smiles":null,"spectrum_id":"CCMSLIB00017320017","spectrum_index":53477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 180.1507 Da; putative annotation: cis-5-Dodecenoic acid; putative formula: C12H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.289,"smiles":null,"spectrum_id":"CCMSLIB00017320018","spectrum_index":53478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carboxylic acid, 2,3-dihydro-, methyl ester (delta mass: 98.0437 Da; putative annotation: N/A; putative formula: H2N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.13,"smiles":null,"spectrum_id":"CCMSLIB00017320019","spectrum_index":53479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 272.1258 Da; putative annotation: N/A; putative formula: C13H20O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":432.202,"smiles":null,"spectrum_id":"CCMSLIB00017320020","spectrum_index":53480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 94.0784 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.154,"smiles":null,"spectrum_id":"CCMSLIB00017320021","spectrum_index":53481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone (delta mass: 28.9516 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.106,"smiles":null,"spectrum_id":"CCMSLIB00017320022","spectrum_index":53482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 51.9956 Da; putative annotation: N/A; putative formula: C3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.108,"smiles":null,"spectrum_id":"CCMSLIB00017320023","spectrum_index":53483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,3,5-Pentamethyl-1,2,3,8-tetrahydro-7H-pyrrolo[3,2-g]quinolin-7-one (delta mass: 4.3352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.5,"smiles":null,"spectrum_id":"CCMSLIB00017320024","spectrum_index":53484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Ile (delta mass: 128.0585 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.182,"smiles":null,"spectrum_id":"CCMSLIB00017320025","spectrum_index":53485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 51.0466 Da; putative annotation: N/A; putative formula: C4H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.122,"smiles":null,"spectrum_id":"CCMSLIB00017320026","spectrum_index":53486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 124.0672 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.107,"smiles":null,"spectrum_id":"CCMSLIB00017320027","spectrum_index":53487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to PyroGlu-Phe from NIST14 (delta mass: 165.0806 Da; putative annotation: N/A; putative formula: C8H12N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.199,"smiles":null,"spectrum_id":"CCMSLIB00017320028","spectrum_index":53488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 397.3164 Da; putative annotation: N/A; putative formula: C19H39N7O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.418,"smiles":null,"spectrum_id":"CCMSLIB00017320029","spectrum_index":53489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 731.3723 Da; putative annotation: N/A; putative formula: C48H49N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":894.432,"smiles":null,"spectrum_id":"CCMSLIB00017320030","spectrum_index":53490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 112.8968 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.908,"smiles":null,"spectrum_id":"CCMSLIB00017320031","spectrum_index":53491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 179.0481 Da; putative annotation: N/A; putative formula: C11H5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.103,"smiles":null,"spectrum_id":"CCMSLIB00017320032","spectrum_index":53492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380402-01_C26H36O8_ (delta mass: 476.2353 Da; putative annotation: N/A; putative formula: C26H40N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":953.484,"smiles":null,"spectrum_id":"CCMSLIB00017320033","spectrum_index":53493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 74.0482 Da; putative annotation: N/A; putative formula: C2H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.166,"smiles":null,"spectrum_id":"CCMSLIB00017320034","spectrum_index":53494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00380084-01_C21H30O4_Benzo[b]cyclopenta[e]pyran-8(3H)-one, 3a,5,6,7,9,9a-hexahydro-7-hydroxy-1-[(4E)-6-hydroxy-1,5-dimethyl-4-hexen-1-yl]-3a-methyl- (delta mass: 127.9127 Da; putative annotation: N/A; putative formula: HO2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.134,"smiles":null,"spectrum_id":"CCMSLIB00017320035","spectrum_index":53495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .gamma.-Glu-Cys (delta mass: 57.0204 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.09,"smiles":null,"spectrum_id":"CCMSLIB00017320036","spectrum_index":53496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 427.1624 Da; putative annotation: N/A; putative formula: C15H29N3O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.264,"smiles":null,"spectrum_id":"CCMSLIB00017320037","spectrum_index":53497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 213.1369 Da; putative annotation: N/A; putative formula: C11H19NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.208,"smiles":null,"spectrum_id":"CCMSLIB00017320038","spectrum_index":53498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 108.0938 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.196,"smiles":null,"spectrum_id":"CCMSLIB00017320039","spectrum_index":53499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-2,3,4,9-tetrahydro-1H-carbazole (delta mass: 117.0579 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.155,"smiles":null,"spectrum_id":"CCMSLIB00017320040","spectrum_index":53500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 90.0432 Da; putative annotation: N/A; putative formula: C2H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.129,"smiles":null,"spectrum_id":"CCMSLIB00017320041","spectrum_index":53501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 128.1189 Da; putative annotation: N/A; putative formula: C8H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.179,"smiles":null,"spectrum_id":"CCMSLIB00017320042","spectrum_index":53502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 132.0382 Da; putative annotation: N/A; putative formula: C4H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.098,"smiles":null,"spectrum_id":"CCMSLIB00017320043","spectrum_index":53503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 203.0074 Da; putative annotation: N/A; putative formula: C7H9NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.067,"smiles":null,"spectrum_id":"CCMSLIB00017320044","spectrum_index":53504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 595.1904 Da; putative annotation: N/A; putative formula: C22H30N9O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":760.266,"smiles":null,"spectrum_id":"CCMSLIB00017320045","spectrum_index":53505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxymorphone (delta mass: 63.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.171,"smiles":null,"spectrum_id":"CCMSLIB00017320046","spectrum_index":53506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 87.0145 Da; putative annotation: N/A; putative formula: C3H5NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.064,"smiles":null,"spectrum_id":"CCMSLIB00017320047","spectrum_index":53507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 53.0474 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.113,"smiles":null,"spectrum_id":"CCMSLIB00017320048","spectrum_index":53508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Cyclodextrin (delta mass: 127.008 Da; putative annotation: N/A; putative formula: C5H5NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1100.33,"smiles":null,"spectrum_id":"CCMSLIB00017320049","spectrum_index":53509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 506.1508 Da; putative annotation: N/A; putative formula: C29H23N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.237,"smiles":null,"spectrum_id":"CCMSLIB00017320050","spectrum_index":53510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of POTASSIUM SORBATE (delta mass: 16.0095 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.025,"smiles":null,"spectrum_id":"CCMSLIB00017320051","spectrum_index":53511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 87.0288 Da; putative annotation: N/A; putative formula: C2H5N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.155,"smiles":null,"spectrum_id":"CCMSLIB00017320052","spectrum_index":53512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydropertusaric (delta mass: 120.0933 Da; putative annotation: N/A; putative formula: C9H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.357,"smiles":null,"spectrum_id":"CCMSLIB00017320053","spectrum_index":53513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 132.0432 Da; putative annotation: N/A; putative formula: C5H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.119,"smiles":null,"spectrum_id":"CCMSLIB00017320054","spectrum_index":53514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 246.1062 Da; putative annotation: N/A; putative formula: C9H19N4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.24,"smiles":null,"spectrum_id":"CCMSLIB00017320055","spectrum_index":53515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 31.0424 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.181,"smiles":null,"spectrum_id":"CCMSLIB00017320056","spectrum_index":53516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1(2H)-isoquinolinone (delta mass: 317.5068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.578,"smiles":null,"spectrum_id":"CCMSLIB00017320057","spectrum_index":53517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 112.0422 Da; putative annotation: N/A; putative formula: C8H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.102,"smiles":null,"spectrum_id":"CCMSLIB00017320058","spectrum_index":53518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 32.0342 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.183,"smiles":null,"spectrum_id":"CCMSLIB00017320059","spectrum_index":53519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tapentadol (delta mass: 40.9428 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.128,"smiles":null,"spectrum_id":"CCMSLIB00017320060","spectrum_index":53520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 703.5323 Da; putative annotation: N/A; putative formula: C41H73N3O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1087.68,"smiles":null,"spectrum_id":"CCMSLIB00017320061","spectrum_index":53521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 591.5209 Da; putative annotation: N/A; putative formula: C41H69NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":916.758,"smiles":null,"spectrum_id":"CCMSLIB00017320062","spectrum_index":53522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coumaroyl putrescin (delta mass: 202.0628 Da; putative annotation: N/A; putative formula: C12H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.207,"smiles":null,"spectrum_id":"CCMSLIB00017320063","spectrum_index":53523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385352-01!7-methoxy-9,10-dihydrophenanthrene-2,5-diol (delta mass: 73.9996 Da; putative annotation: N/A; putative formula: C2H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.101,"smiles":null,"spectrum_id":"CCMSLIB00017320064","spectrum_index":53524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 207.1114 Da; putative annotation: N/A; putative formula: C9H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.152,"smiles":null,"spectrum_id":"CCMSLIB00017320065","spectrum_index":53525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenanthridin-6-ol (delta mass: 41.0113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.087,"smiles":null,"spectrum_id":"CCMSLIB00017320066","spectrum_index":53526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 305.3082 Da; putative annotation: N/A; putative formula: C21H39N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.384,"smiles":null,"spectrum_id":"CCMSLIB00017320067","spectrum_index":53527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 43.9956 Da; putative annotation: N/A; putative formula: HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.119,"smiles":null,"spectrum_id":"CCMSLIB00017320068","spectrum_index":53528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 174.0455 Da; putative annotation: N/A; putative formula: C8H7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.095,"smiles":null,"spectrum_id":"CCMSLIB00017320069","spectrum_index":53529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methyl-1,2,3,4-tetrahydroquinoline (delta mass: 24.04 Da; putative annotation: N/A; putative formula: C3H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.152,"smiles":null,"spectrum_id":"CCMSLIB00017320070","spectrum_index":53530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 96.0243 Da; putative annotation: N/A; putative formula: C4H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.147,"smiles":null,"spectrum_id":"CCMSLIB00017320071","spectrum_index":53531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 38.0151 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":148.075,"smiles":null,"spectrum_id":"CCMSLIB00017320072","spectrum_index":53532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 82.2081 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.341,"smiles":null,"spectrum_id":"CCMSLIB00017320073","spectrum_index":53533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 232.1486 Da; putative annotation: N/A; putative formula: C14H21N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.328,"smiles":null,"spectrum_id":"CCMSLIB00017320074","spectrum_index":53534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methyloxindole; LC-tDDA; CE40 (delta mass: 47.0254 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.101,"smiles":null,"spectrum_id":"CCMSLIB00017320075","spectrum_index":53535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 498.1614 Da; putative annotation: N/A; putative formula: C29H26N2O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":775.264,"smiles":null,"spectrum_id":"CCMSLIB00017320076","spectrum_index":53536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 657.3934 Da; putative annotation: N/A; putative formula: C28H55N11O3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":820.453,"smiles":null,"spectrum_id":"CCMSLIB00017320077","spectrum_index":53537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 69.0073 Da; putative annotation: N/A; putative formula: H-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.125,"smiles":null,"spectrum_id":"CCMSLIB00017320078","spectrum_index":53538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 128.0573 Da; putative annotation: N/A; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017320079","spectrum_index":53539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 122.0357 Da; putative annotation: N/A; putative formula: CH7N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.137,"smiles":null,"spectrum_id":"CCMSLIB00017320080","spectrum_index":53540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(9-Oxodecyl)acetamide (delta mass: 82.0498 Da; putative annotation: N/A; putative formula: C4H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.23,"smiles":null,"spectrum_id":"CCMSLIB00017320081","spectrum_index":53541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 18.0803 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.229,"smiles":null,"spectrum_id":"CCMSLIB00017320082","spectrum_index":53542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 251.1588 Da; putative annotation: N/A; putative formula: C9H17N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":552.339,"smiles":null,"spectrum_id":"CCMSLIB00017320083","spectrum_index":53543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 145.8454 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.88,"smiles":null,"spectrum_id":"CCMSLIB00017320084","spectrum_index":53544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 117.0583 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.134,"smiles":null,"spectrum_id":"CCMSLIB00017320085","spectrum_index":53545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 57.0216 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.082,"smiles":null,"spectrum_id":"CCMSLIB00017320086","spectrum_index":53546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 143.0729 Da; putative annotation: N/A; putative formula: C4H10N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.222,"smiles":null,"spectrum_id":"CCMSLIB00017320087","spectrum_index":53547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)heptane-3,5-diol (delta mass: 93.0944 Da; putative annotation: N/A; putative formula: C7H11NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.269,"smiles":null,"spectrum_id":"CCMSLIB00017320088","spectrum_index":53548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indole (delta mass: 3.0053 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":121.07,"smiles":null,"spectrum_id":"CCMSLIB00017320089","spectrum_index":53549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 100.031 Da; putative annotation: N/A; putative formula: C8H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.154,"smiles":null,"spectrum_id":"CCMSLIB00017320090","spectrum_index":53550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 56.0713 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.13,"smiles":null,"spectrum_id":"CCMSLIB00017320091","spectrum_index":53551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 327.2167 Da; putative annotation: N/A; putative formula: C17H33N3O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":538.361,"smiles":null,"spectrum_id":"CCMSLIB00017320092","spectrum_index":53552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 110.0112 Da; putative annotation: N/A; putative formula: C4H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.139,"smiles":null,"spectrum_id":"CCMSLIB00017320093","spectrum_index":53553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 27.02 Da; putative annotation: N/A; putative formula: HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.125,"smiles":null,"spectrum_id":"CCMSLIB00017320094","spectrum_index":53554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 351.0797 Da; putative annotation: N/A; putative formula: C25H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.166,"smiles":null,"spectrum_id":"CCMSLIB00017320095","spectrum_index":53555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N'-(7-Fluoropyrrolo[1,2-a]quinoxalin-4-yl)pyrazinohydrazide (delta mass: 201.0918 Da; putative annotation: N/A; putative formula: C9H16NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.197,"smiles":null,"spectrum_id":"CCMSLIB00017320096","spectrum_index":53556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 412.2981 Da; putative annotation: N/A; putative formula: C27H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":576.39,"smiles":null,"spectrum_id":"CCMSLIB00017320097","spectrum_index":53557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 95.0391 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.115,"smiles":null,"spectrum_id":"CCMSLIB00017320098","spectrum_index":53558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 83.0346 Da; putative annotation: N/A; putative formula: HN7O-1)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.095,"smiles":null,"spectrum_id":"CCMSLIB00017320099","spectrum_index":53559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-2,8-diol (delta mass: 242.0132 Da; putative annotation: N/A; putative formula: C13H7O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.068,"smiles":null,"spectrum_id":"CCMSLIB00017320100","spectrum_index":53560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxy-N-methyl-N-isopropyltryptamine (delta mass: 147.0526 Da; putative annotation: N/A; putative formula: C5H9NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.217,"smiles":null,"spectrum_id":"CCMSLIB00017320101","spectrum_index":53561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 324.2094 Da; putative annotation: N/A; putative formula: C15H28N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":494.291,"smiles":null,"spectrum_id":"CCMSLIB00017320102","spectrum_index":53562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 37.9792 Da; putative annotation: N/A; putative formula: C2H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.066,"smiles":null,"spectrum_id":"CCMSLIB00017320103","spectrum_index":53563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha.-Mannobiose (delta mass: 158.0369 Da; putative annotation: N/A; putative formula: C10H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.16,"smiles":null,"spectrum_id":"CCMSLIB00017320104","spectrum_index":53564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Octopamine (delta mass: 52.9457 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.032,"smiles":null,"spectrum_id":"CCMSLIB00017320105","spectrum_index":53565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTITOL (delta mass: 109.0534 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.14,"smiles":null,"spectrum_id":"CCMSLIB00017320106","spectrum_index":53566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 84.1517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.238,"smiles":null,"spectrum_id":"CCMSLIB00017320107","spectrum_index":53567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 27.0043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":194.066,"smiles":null,"spectrum_id":"CCMSLIB00017320108","spectrum_index":53568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 131.0399 Da; putative annotation: N/A; putative formula: C5H9NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.163,"smiles":null,"spectrum_id":"CCMSLIB00017320109","spectrum_index":53569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 20.0113 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.061,"smiles":null,"spectrum_id":"CCMSLIB00017320110","spectrum_index":53570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 100.1197 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.221,"smiles":null,"spectrum_id":"CCMSLIB00017320111","spectrum_index":53571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 72.0575 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.138,"smiles":null,"spectrum_id":"CCMSLIB00017320112","spectrum_index":53572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 532.2285 Da; putative annotation: N/A; putative formula: C32H36O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":901.34,"smiles":null,"spectrum_id":"CCMSLIB00017320113","spectrum_index":53573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 49.9783 Da; putative annotation: N/A; putative formula: C3H-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.07,"smiles":null,"spectrum_id":"CCMSLIB00017320114","spectrum_index":53574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 44.0258 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.164,"smiles":null,"spectrum_id":"CCMSLIB00017320115","spectrum_index":53575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Fluorophenyl)-N-(4-methoxybenzyl)methanamine (delta mass: 113.0769 Da; putative annotation: N/A; putative formula: C6H12NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.206,"smiles":null,"spectrum_id":"CCMSLIB00017320116","spectrum_index":53576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385698-01!2-(1H-indol-3-yl)propanoic acid (delta mass: 59.0648 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.151,"smiles":null,"spectrum_id":"CCMSLIB00017320117","spectrum_index":53577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-4-nitronbenzoyl homoveratrylamine (delta mass: 1.9962 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.125,"smiles":null,"spectrum_id":"CCMSLIB00017320118","spectrum_index":53578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023101 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 485.1859 Da; putative annotation: N/A; putative formula: C23H23N11S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":990.362,"smiles":null,"spectrum_id":"CCMSLIB00017320119","spectrum_index":53579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 100.9934 Da; putative annotation: N/A; putative formula: C3H3NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.08,"smiles":null,"spectrum_id":"CCMSLIB00017320120","spectrum_index":53580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 102.0361 Da; putative annotation: N/A; putative formula: C2H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.123,"smiles":null,"spectrum_id":"CCMSLIB00017320121","spectrum_index":53581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 276.0411 Da; putative annotation: N/A; putative formula: C11H9N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.164,"smiles":null,"spectrum_id":"CCMSLIB00017320122","spectrum_index":53582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 755.1414 Da; putative annotation: N/A; putative formula: C37H29N3O13S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":977.239,"smiles":null,"spectrum_id":"CCMSLIB00017320123","spectrum_index":53583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-Dichloro-1H-indole-2-carboxylic acid (delta mass: 106.046 Da; putative annotation: N/A; putative formula: CH6N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.023,"smiles":null,"spectrum_id":"CCMSLIB00017320124","spectrum_index":53584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perivine (delta mass: 18.0102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.181,"smiles":null,"spectrum_id":"CCMSLIB00017320125","spectrum_index":53585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 206.143 Da; putative annotation: N/A; putative formula: C12H18N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.292,"smiles":null,"spectrum_id":"CCMSLIB00017320126","spectrum_index":53586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 51.0341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.136,"smiles":null,"spectrum_id":"CCMSLIB00017320127","spectrum_index":53587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nervobscurine (delta mass: 350.1656 Da; putative annotation: N/A; putative formula: C20H31O-1PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.362,"smiles":null,"spectrum_id":"CCMSLIB00017320128","spectrum_index":53588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 419.2163 Da; putative annotation: N/A; putative formula: C20H37NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":750.37,"smiles":null,"spectrum_id":"CCMSLIB00017320129","spectrum_index":53589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 57.0211 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.092,"smiles":null,"spectrum_id":"CCMSLIB00017320130","spectrum_index":53590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoroindole-2-carboxylic acid (delta mass: 27.017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.062,"smiles":null,"spectrum_id":"CCMSLIB00017320131","spectrum_index":53591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethanolamine (delta mass: 60.0576 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":198.149,"smiles":null,"spectrum_id":"CCMSLIB00017320132","spectrum_index":53592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 16.5213 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.597,"smiles":null,"spectrum_id":"CCMSLIB00017320133","spectrum_index":53593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 111.0386 Da; putative annotation: N/A; putative formula: HN9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.16,"smiles":null,"spectrum_id":"CCMSLIB00017320134","spectrum_index":53594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 395.1412 Da; putative annotation: N/A; putative formula: C22H18N7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.206,"smiles":null,"spectrum_id":"CCMSLIB00017320135","spectrum_index":53595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 32.0165 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.103,"smiles":null,"spectrum_id":"CCMSLIB00017320136","spectrum_index":53596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 24.9677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.055,"smiles":null,"spectrum_id":"CCMSLIB00017320137","spectrum_index":53597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 871.3115 Da; putative annotation: N/A; putative formula: C63H42N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1090.41,"smiles":null,"spectrum_id":"CCMSLIB00017320138","spectrum_index":53598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Bipyridine-4,4'-dicarboxylic acid (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.093,"smiles":null,"spectrum_id":"CCMSLIB00017320139","spectrum_index":53599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 264.2826 Da; putative annotation: N/A; putative formula: C19H36)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.379,"smiles":null,"spectrum_id":"CCMSLIB00017320140","spectrum_index":53600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Glu (delta mass: 77.0517 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.139,"smiles":null,"spectrum_id":"CCMSLIB00017320141","spectrum_index":53601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Methoxyethoxy)-5-(trifluoromethyl)aniline (delta mass: 59.0068 Da; putative annotation: N/A; putative formula: H2N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.096,"smiles":null,"spectrum_id":"CCMSLIB00017320142","spectrum_index":53602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dimethyl-7-nitro-1H-indole (delta mass: 176.0469 Da; putative annotation: N/A; putative formula: C10H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.128,"smiles":null,"spectrum_id":"CCMSLIB00017320143","spectrum_index":53603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 122.0568 Da; putative annotation: N/A; putative formula: C8H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.232,"smiles":null,"spectrum_id":"CCMSLIB00017320144","spectrum_index":53604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 500.4078 Da; putative annotation: N/A; putative formula: C29H56O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":783.635,"smiles":null,"spectrum_id":"CCMSLIB00017320145","spectrum_index":53605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 56.0626 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.222,"smiles":null,"spectrum_id":"CCMSLIB00017320146","spectrum_index":53606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glyceraldehyde, 3-(dihydrogen phosphate) (delta mass: 116.0498 Da; putative annotation: N/A; putative formula: C4H9N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.055,"smiles":null,"spectrum_id":"CCMSLIB00017320147","spectrum_index":53607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 164.0775 Da; putative annotation: N/A; putative formula: C9H12N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.138,"smiles":null,"spectrum_id":"CCMSLIB00017320148","spectrum_index":53608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100335 D-Mannose-6-phosphate|Man-6P|6-phosphono-D-mannopyranose (delta mass: 413.343 Da; putative annotation: N/A; putative formula: C24H48NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.38,"smiles":null,"spectrum_id":"CCMSLIB00017320149","spectrum_index":53609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 16.9873 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.079,"smiles":null,"spectrum_id":"CCMSLIB00017320150","spectrum_index":53610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 27.047 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.16,"smiles":null,"spectrum_id":"CCMSLIB00017320151","spectrum_index":53611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 29.0143 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.127,"smiles":null,"spectrum_id":"CCMSLIB00017320152","spectrum_index":53612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 99.0005 Da; putative annotation: N/A; putative formula: CHN5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.149,"smiles":null,"spectrum_id":"CCMSLIB00017320153","spectrum_index":53613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 10.9572 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":175.028,"smiles":null,"spectrum_id":"CCMSLIB00017320154","spectrum_index":53614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 47.025 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.07,"smiles":null,"spectrum_id":"CCMSLIB00017320155","spectrum_index":53615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 11.9883 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.07,"smiles":null,"spectrum_id":"CCMSLIB00017320156","spectrum_index":53616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 18.0602 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.172,"smiles":null,"spectrum_id":"CCMSLIB00017320157","spectrum_index":53617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 89.0735 Da; putative annotation: N/A; putative formula: CH7N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.197,"smiles":null,"spectrum_id":"CCMSLIB00017320158","spectrum_index":53618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 350.1059 Da; putative annotation: Chlorogenic acid, methyl ester; putative formula: C17H18O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":531.147,"smiles":null,"spectrum_id":"CCMSLIB00017320159","spectrum_index":53619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 189.0782 Da; putative annotation: 4-Acetyl-L-phenylalanine; putative formula: C11H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.169,"smiles":null,"spectrum_id":"CCMSLIB00017320160","spectrum_index":53620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 132.0938 Da; putative annotation: Thymol; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.331,"smiles":null,"spectrum_id":"CCMSLIB00017320161","spectrum_index":53621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 153.0804 Da; putative annotation: (1S,2R)-2-(Aminocarbonyl)cyclohexanecarboxylic acid; putative formula: C8H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.167,"smiles":null,"spectrum_id":"CCMSLIB00017320162","spectrum_index":53622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 158.0581 Da; putative annotation: 2-Isopropylmalic acid; putative formula: C7H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.123,"smiles":null,"spectrum_id":"CCMSLIB00017320163","spectrum_index":53623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 164.0107 Da; putative annotation: 4-Hydroxyisophthalic acid; putative formula: C8H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.081,"smiles":null,"spectrum_id":"CCMSLIB00017320164","spectrum_index":53624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank: citrulline|2-azaniumyl-5-(carbamoylamino)pentanoate (delta mass: 112.0525 Da; putative annotation: (3R,3aS,6aR)-Hexahydrofuro[2,3-b]furan-3-ol; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.155,"smiles":null,"spectrum_id":"CCMSLIB00017320165","spectrum_index":53625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 48.0339 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.146,"smiles":null,"spectrum_id":"CCMSLIB00017320166","spectrum_index":53626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 36.0209 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.258,"smiles":null,"spectrum_id":"CCMSLIB00017320167","spectrum_index":53627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Sorbose (delta mass: 149.0687 Da; putative annotation: N/A; putative formula: C5H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.139,"smiles":null,"spectrum_id":"CCMSLIB00017320168","spectrum_index":53628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 111.0595 Da; putative annotation: N/A; putative formula: C6H10NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.198,"smiles":null,"spectrum_id":"CCMSLIB00017320169","spectrum_index":53629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 10.9631 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":155.009,"smiles":null,"spectrum_id":"CCMSLIB00017320170","spectrum_index":53630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2-Chlorobenzyl)-1H-pyrrole-2-carboxamide (delta mass: 41.0227 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.086,"smiles":null,"spectrum_id":"CCMSLIB00017320171","spectrum_index":53631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 209.0331 Da; putative annotation: N/A; putative formula: C10H11NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.104,"smiles":null,"spectrum_id":"CCMSLIB00017320172","spectrum_index":53632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stepharine (delta mass: 27.9947 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.138,"smiles":null,"spectrum_id":"CCMSLIB00017320173","spectrum_index":53633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 78.0689 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.172,"smiles":null,"spectrum_id":"CCMSLIB00017320174","spectrum_index":53634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 64.0311 Da; putative annotation: N/A; putative formula: C5H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.112,"smiles":null,"spectrum_id":"CCMSLIB00017320175","spectrum_index":53635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 41.0265 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.102,"smiles":null,"spectrum_id":"CCMSLIB00017320176","spectrum_index":53636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4-Dihydroxyheptadec-16-ynyl acetate (delta mass: 625.3449 Da; putative annotation: N/A; putative formula: C37H47N5O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":952.598,"smiles":null,"spectrum_id":"CCMSLIB00017320177","spectrum_index":53637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 64.0598 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.183,"smiles":null,"spectrum_id":"CCMSLIB00017320178","spectrum_index":53638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 180.0244 Da; putative annotation: N/A; putative formula: C9H5FO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.069,"smiles":null,"spectrum_id":"CCMSLIB00017320179","spectrum_index":53639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 765.421 Da; putative annotation: N/A; putative formula: C43H63N3O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":931.507,"smiles":null,"spectrum_id":"CCMSLIB00017320180","spectrum_index":53640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of methyl (2E)-2-[(3S,12bR)-3-ethyl-4-oxo-1H,2H,3H,4H,6H,7H,12H,12bH-indolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate (delta mass: 18.0331 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.23,"smiles":null,"spectrum_id":"CCMSLIB00017320181","spectrum_index":53641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 195.0715 Da; putative annotation: N/A; putative formula: C10H13NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.158,"smiles":null,"spectrum_id":"CCMSLIB00017320182","spectrum_index":53642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.253,"smiles":null,"spectrum_id":"CCMSLIB00017320183","spectrum_index":53643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 3-formyl-1H-indole-2-carboxylate (delta mass: 149.0329 Da; putative annotation: N/A; putative formula: C5H11NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.114,"smiles":null,"spectrum_id":"CCMSLIB00017320184","spectrum_index":53644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 35.0238 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.112,"smiles":null,"spectrum_id":"CCMSLIB00017320185","spectrum_index":53645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 11.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":171.112,"smiles":null,"spectrum_id":"CCMSLIB00017320186","spectrum_index":53646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-3-pyridinol (delta mass: 57.0578 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.118,"smiles":null,"spectrum_id":"CCMSLIB00017320187","spectrum_index":53647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenaline; LC-tDDA; CE10 (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.149,"smiles":null,"spectrum_id":"CCMSLIB00017320188","spectrum_index":53648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 313.2895 Da; putative annotation: N/A; putative formula: C19H40NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.324,"smiles":null,"spectrum_id":"CCMSLIB00017320189","spectrum_index":53649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 82.078 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.221,"smiles":null,"spectrum_id":"CCMSLIB00017320190","spectrum_index":53650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACRYLIC ACID (delta mass: 338.2984 Da; putative annotation: N/A; putative formula: C25H38)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":526.369,"smiles":null,"spectrum_id":"CCMSLIB00017320191","spectrum_index":53651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 130.1355 Da; putative annotation: N/A; putative formula: C4H14N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.248,"smiles":null,"spectrum_id":"CCMSLIB00017320192","spectrum_index":53652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 212.078 Da; putative annotation: N/A; putative formula: C9H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.181,"smiles":null,"spectrum_id":"CCMSLIB00017320193","spectrum_index":53653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOTRIOSE (delta mass: 204.0637 Da; putative annotation: N/A; putative formula: C8H12O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.24,"smiles":null,"spectrum_id":"CCMSLIB00017320194","spectrum_index":53654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 165.1243 Da; putative annotation: N/A; putative formula: C9H15N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.211,"smiles":null,"spectrum_id":"CCMSLIB00017320195","spectrum_index":53655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 147.074 Da; putative annotation: N/A; putative formula: C6H15NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.145,"smiles":null,"spectrum_id":"CCMSLIB00017320196","spectrum_index":53656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 902.7389 Da; putative annotation: N/A; putative formula: C60H94N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1024.84,"smiles":null,"spectrum_id":"CCMSLIB00017320197","spectrum_index":53657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 386.1486 Da; putative annotation: N/A; putative formula: C21H26N2OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.209,"smiles":null,"spectrum_id":"CCMSLIB00017320198","spectrum_index":53658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 93.0206 Da; putative annotation: N/A; putative formula: C5H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.122,"smiles":null,"spectrum_id":"CCMSLIB00017320199","spectrum_index":53659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 264.0804 Da; putative annotation: N/A; putative formula: C10H14N6O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.172,"smiles":null,"spectrum_id":"CCMSLIB00017320200","spectrum_index":53660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 172.1024 Da; putative annotation: N/A; putative formula: C9H17OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.194,"smiles":null,"spectrum_id":"CCMSLIB00017320201","spectrum_index":53661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Rutinose (delta mass: 153.0411 Da; putative annotation: N/A; putative formula: CH8N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.17,"smiles":null,"spectrum_id":"CCMSLIB00017320202","spectrum_index":53662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 18.9489 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.035,"smiles":null,"spectrum_id":"CCMSLIB00017320203","spectrum_index":53663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C12:0 (delta mass: 70.0802 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":398.412,"smiles":null,"spectrum_id":"CCMSLIB00017320204","spectrum_index":53664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 256.1143 Da; putative annotation: N/A; putative formula: C6H12N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.19,"smiles":null,"spectrum_id":"CCMSLIB00017320205","spectrum_index":53665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 6-(methylsulfanyl)-1H-indole-2-carboxylate (delta mass: 167.0578 Da; putative annotation: N/A; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":389.116,"smiles":null,"spectrum_id":"CCMSLIB00017320206","spectrum_index":53666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Leu from NIST14 (delta mass: 41.9953 Da; putative annotation: N/A; putative formula: C2H2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.15,"smiles":null,"spectrum_id":"CCMSLIB00017320207","spectrum_index":53667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 118.1511 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.211,"smiles":null,"spectrum_id":"CCMSLIB00017320208","spectrum_index":53668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 543.2503 Da; putative annotation: N/A; putative formula: C26H41NO9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.326,"smiles":null,"spectrum_id":"CCMSLIB00017320209","spectrum_index":53669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-BUTYRIC ACID (delta mass: 526.304 Da; putative annotation: N/A; putative formula: C30H42N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":730.406,"smiles":null,"spectrum_id":"CCMSLIB00017320210","spectrum_index":53670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 26.0156 Da; putative annotation: N/A; putative formula: C2H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.191,"smiles":null,"spectrum_id":"CCMSLIB00017320211","spectrum_index":53671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 20.0 eV (delta mass: 171.1623 Da; putative annotation: N/A; putative formula: C10H21NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.238,"smiles":null,"spectrum_id":"CCMSLIB00017320212","spectrum_index":53672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 254.1156 Da; putative annotation: N/A; putative formula: C13H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.228,"smiles":null,"spectrum_id":"CCMSLIB00017320213","spectrum_index":53673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 259.0593 Da; putative annotation: N/A; putative formula: C12H9N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":632.224,"smiles":null,"spectrum_id":"CCMSLIB00017320214","spectrum_index":53674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 565.2388 Da; putative annotation: N/A; putative formula: C25H35N5O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":749.336,"smiles":null,"spectrum_id":"CCMSLIB00017320215","spectrum_index":53675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 288.027 Da; putative annotation: N/A; putative formula: C14H8O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.087,"smiles":null,"spectrum_id":"CCMSLIB00017320216","spectrum_index":53676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 161.0687 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.144,"smiles":null,"spectrum_id":"CCMSLIB00017320217","spectrum_index":53677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 45.9237 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.01,"smiles":null,"spectrum_id":"CCMSLIB00017320218","spectrum_index":53678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ethyl-1H-indole (delta mass: 117.0273 Da; putative annotation: N/A; putative formula: C4H9NO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.124,"smiles":null,"spectrum_id":"CCMSLIB00017320219","spectrum_index":53679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 76.008 Da; putative annotation: N/A; putative formula: C2H5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.121,"smiles":null,"spectrum_id":"CCMSLIB00017320220","spectrum_index":53680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLEACETALDEHYDE (delta mass: 99.0331 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.109,"smiles":null,"spectrum_id":"CCMSLIB00017320221","spectrum_index":53681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxyquinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 129.0427 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.093,"smiles":null,"spectrum_id":"CCMSLIB00017320222","spectrum_index":53682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"12-ethylidene-14-methyl-8,14-diazapentacyclo[9.5.2.0<1,9>.0<2,7>.0<14,17>]octa deca-2,4,6,9-tetraene-10-carbaldehyde, iodide CollisionEnergy:205060\"\" (delta mass: 53.0574 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.238,"smiles":null,"spectrum_id":"CCMSLIB00017320223","spectrum_index":53683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 192.0574 Da; putative annotation: N/A; putative formula: C14H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.123,"smiles":null,"spectrum_id":"CCMSLIB00017320224","spectrum_index":53684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 176.0987 Da; putative annotation: N/A; putative formula: C7H16N2OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.174,"smiles":null,"spectrum_id":"CCMSLIB00017320225","spectrum_index":53685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-5-hydroxy-1,7-diphenylhept-1-en-3-one (delta mass: 320.0738 Da; putative annotation: N/A; putative formula: C19H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.227,"smiles":null,"spectrum_id":"CCMSLIB00017320226","spectrum_index":53686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 106.1818 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.273,"smiles":null,"spectrum_id":"CCMSLIB00017320227","spectrum_index":53687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.gamma.-Glutamyl-L-glutamic acid (delta mass: 111.0318 Da; putative annotation: N/A; putative formula: C5H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.135,"smiles":null,"spectrum_id":"CCMSLIB00017320228","spectrum_index":53688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 74.0373 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.191,"smiles":null,"spectrum_id":"CCMSLIB00017320229","spectrum_index":53689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 160.0817 Da; putative annotation: N/A; putative formula: C2H8N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.162,"smiles":null,"spectrum_id":"CCMSLIB00017320230","spectrum_index":53690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385672-01!(E)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)hept-4-en-3-one (delta mass: 90.0184 Da; putative annotation: N/A; putative formula: H2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.162,"smiles":null,"spectrum_id":"CCMSLIB00017320231","spectrum_index":53691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N'-(7-Fluoropyrrolo[1,2-a]quinoxalin-4-yl)pyrazinohydrazide (delta mass: 29.9909 Da; putative annotation: N/A; putative formula: C4H-2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.096,"smiles":null,"spectrum_id":"CCMSLIB00017320232","spectrum_index":53692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Reserpic acid (delta mass: 16.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.26,"smiles":null,"spectrum_id":"CCMSLIB00017320233","spectrum_index":53693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 17.0262 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.154,"smiles":null,"spectrum_id":"CCMSLIB00017320234","spectrum_index":53694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 188.0426 Da; putative annotation: N/A; putative formula: C8H13OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.181,"smiles":null,"spectrum_id":"CCMSLIB00017320235","spectrum_index":53695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 181.0536 Da; putative annotation: N/A; putative formula: C5H7N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":524.177,"smiles":null,"spectrum_id":"CCMSLIB00017320236","spectrum_index":53696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 163.9932 Da; putative annotation: N/A; putative formula: C8H4O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.127,"smiles":null,"spectrum_id":"CCMSLIB00017320237","spectrum_index":53697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 262.2295 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.389,"smiles":null,"spectrum_id":"CCMSLIB00017320238","spectrum_index":53698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 466.1209 Da; putative annotation: N/A; putative formula: C25H26N2OS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":629.181,"smiles":null,"spectrum_id":"CCMSLIB00017320239","spectrum_index":53699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 161.0464 Da; putative annotation: N/A; putative formula: C3H8N5OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.133,"smiles":null,"spectrum_id":"CCMSLIB00017320240","spectrum_index":53700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA003546 Hordenine|4-[2-(dimethylamino)ethyl]phenol (delta mass: 151.0325 Da; putative annotation: N/A; putative formula: C5H5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.155,"smiles":null,"spectrum_id":"CCMSLIB00017320241","spectrum_index":53701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 48.0366 Da; putative annotation: N/A; putative formula: C5H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.191,"smiles":null,"spectrum_id":"CCMSLIB00017320242","spectrum_index":53702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOSE (delta mass: 142.202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.326,"smiles":null,"spectrum_id":"CCMSLIB00017320243","spectrum_index":53703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 52.0683 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.29,"smiles":null,"spectrum_id":"CCMSLIB00017320244","spectrum_index":53704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 106.171 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.247,"smiles":null,"spectrum_id":"CCMSLIB00017320245","spectrum_index":53705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 29.0111 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.077,"smiles":null,"spectrum_id":"CCMSLIB00017320246","spectrum_index":53706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmaline (delta mass: 57.0677 Da; putative annotation: N/A; putative formula: C2H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.186,"smiles":null,"spectrum_id":"CCMSLIB00017320247","spectrum_index":53707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 220.0731 Da; putative annotation: N/A; putative formula: C12H12O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":487.175,"smiles":null,"spectrum_id":"CCMSLIB00017320248","spectrum_index":53708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 180.0799 Da; putative annotation: N/A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.229,"smiles":null,"spectrum_id":"CCMSLIB00017320249","spectrum_index":53709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 343.1275 Da; putative annotation: N/A; putative formula: C16H25NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.203,"smiles":null,"spectrum_id":"CCMSLIB00017320250","spectrum_index":53710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 32.0341 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.178,"smiles":null,"spectrum_id":"CCMSLIB00017320251","spectrum_index":53711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 107.0687 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017320252","spectrum_index":53712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Fluorobenzyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 134.0522 Da; putative annotation: N/A; putative formula: C12H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.145,"smiles":null,"spectrum_id":"CCMSLIB00017320253","spectrum_index":53713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-acetyltyramine (delta mass: 131.1187 Da; putative annotation: N/A; putative formula: C4H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.221,"smiles":null,"spectrum_id":"CCMSLIB00017320254","spectrum_index":53714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 3,16-dihydroxy-4,4,8,12,16-pentamethyl-15,17-dioxoandrost-11-ene-14-carboxylate (delta mass: 52.0312 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.305,"smiles":null,"spectrum_id":"CCMSLIB00017320255","spectrum_index":53715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 690.3987 Da; putative annotation: N/A; putative formula: C39H54N4O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":855.474,"smiles":null,"spectrum_id":"CCMSLIB00017320256","spectrum_index":53716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 139.8965 Da; putative annotation: N/A; putative formula: H-1O3P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.999,"smiles":null,"spectrum_id":"CCMSLIB00017320257","spectrum_index":53717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 241.2441 Da; putative annotation: N/A; putative formula: C15H31NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.299,"smiles":null,"spectrum_id":"CCMSLIB00017320258","spectrum_index":53718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 825.4517 Da; putative annotation: N/A; putative formula: C42H67NO15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":988.512,"smiles":null,"spectrum_id":"CCMSLIB00017320259","spectrum_index":53719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 718.4103 Da; putative annotation: N/A; putative formula: C46H61N2O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":881.47,"smiles":null,"spectrum_id":"CCMSLIB00017320260","spectrum_index":53720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 355.3149 Da; putative annotation: N/A; putative formula: C16H37N9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.407,"smiles":null,"spectrum_id":"CCMSLIB00017320261","spectrum_index":53721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 390.205 Da; putative annotation: N/A; putative formula: C15H30N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":558.307,"smiles":null,"spectrum_id":"CCMSLIB00017320262","spectrum_index":53722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Zanamivir (delta mass: 18.9825 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.123,"smiles":null,"spectrum_id":"CCMSLIB00017320263","spectrum_index":53723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 472.1771 Da; putative annotation: N/A; putative formula: C22H32O9S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":635.237,"smiles":null,"spectrum_id":"CCMSLIB00017320264","spectrum_index":53724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-Binaphthyl-8,8'-dicarboxylic acid (delta mass: 315.3558 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":658.452,"smiles":null,"spectrum_id":"CCMSLIB00017320265","spectrum_index":53725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 64.041 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.174,"smiles":null,"spectrum_id":"CCMSLIB00017320266","spectrum_index":53726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 226.1935 Da; putative annotation: N/A; putative formula: C14H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":373.259,"smiles":null,"spectrum_id":"CCMSLIB00017320267","spectrum_index":53727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 119.0334 Da; putative annotation: N/A; putative formula: C2H5N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.145,"smiles":null,"spectrum_id":"CCMSLIB00017320268","spectrum_index":53728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Aminobutyl)hydroxylamine (delta mass: 24.0001 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":129.102,"smiles":null,"spectrum_id":"CCMSLIB00017320269","spectrum_index":53729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 477.2583 Da; putative annotation: N/A; putative formula: C23H43NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.318,"smiles":null,"spectrum_id":"CCMSLIB00017320270","spectrum_index":53730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy[1]benzothieno[2,3-c]quinolin-6(5H)-one (delta mass: 27.9949 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.053,"smiles":null,"spectrum_id":"CCMSLIB00017320271","spectrum_index":53731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 735.2709 Da; putative annotation: N/A; putative formula: C52H37N3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":957.368,"smiles":null,"spectrum_id":"CCMSLIB00017320272","spectrum_index":53732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR300261 Pteropodine (delta mass: 314.175 Da; putative annotation: N/A; putative formula: C17H32O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":683.356,"smiles":null,"spectrum_id":"CCMSLIB00017320273","spectrum_index":53733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(5-Methoxy-1H-indol-3-yl)propanoic acid (delta mass: 127.1337 Da; putative annotation: N/A; putative formula: C8H17N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.23,"smiles":null,"spectrum_id":"CCMSLIB00017320274","spectrum_index":53734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 175.0228 Da; putative annotation: N/A; putative formula: C4H5N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.12,"smiles":null,"spectrum_id":"CCMSLIB00017320275","spectrum_index":53735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 29.0015 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.14,"smiles":null,"spectrum_id":"CCMSLIB00017320276","spectrum_index":53736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 194.2012 Da; putative annotation: N/A; putative formula: C14H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.324,"smiles":null,"spectrum_id":"CCMSLIB00017320277","spectrum_index":53737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 348.1398 Da; putative annotation: N/A; putative formula: C19H24O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":739.315,"smiles":null,"spectrum_id":"CCMSLIB00017320278","spectrum_index":53738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 289.0801 Da; putative annotation: N/A; putative formula: C14H16N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.107,"smiles":null,"spectrum_id":"CCMSLIB00017320279","spectrum_index":53739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 374.138 Da; putative annotation: N/A; putative formula: C21H18N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":713.261,"smiles":null,"spectrum_id":"CCMSLIB00017320280","spectrum_index":53740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alline (delta mass: 249.1191 Da; putative annotation: N/A; putative formula: C14H19NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.237,"smiles":null,"spectrum_id":"CCMSLIB00017320281","spectrum_index":53741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 181.0151 Da; putative annotation: N/A; putative formula: C5H12NPS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.097,"smiles":null,"spectrum_id":"CCMSLIB00017320282","spectrum_index":53742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 114.0525 Da; putative annotation: N/A; putative formula: C3H6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.165,"smiles":null,"spectrum_id":"CCMSLIB00017320283","spectrum_index":53743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE30; MS2Dec (delta mass: 9.0003 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":95.0603,"smiles":null,"spectrum_id":"CCMSLIB00017320284","spectrum_index":53744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 56.9953 Da; putative annotation: N/A; putative formula: H-1N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.093,"smiles":null,"spectrum_id":"CCMSLIB00017320285","spectrum_index":53745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 312.147 Da; putative annotation: N/A; putative formula: C10H24N4O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.227,"smiles":null,"spectrum_id":"CCMSLIB00017320286","spectrum_index":53746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 284.2182 Da; putative annotation: N/A; putative formula: C10H24N10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.278,"smiles":null,"spectrum_id":"CCMSLIB00017320287","spectrum_index":53747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 263.1731 Da; putative annotation: N/A; putative formula: C12H25NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.249,"smiles":null,"spectrum_id":"CCMSLIB00017320288","spectrum_index":53748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 325.1168 Da; putative annotation: N/A; putative formula: C16H23NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.214,"smiles":null,"spectrum_id":"CCMSLIB00017320289","spectrum_index":53749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Eupatoriochromene (delta mass: 480.1466 Da; putative annotation: N/A; putative formula: C23H30O7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.248,"smiles":null,"spectrum_id":"CCMSLIB00017320290","spectrum_index":53750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 65.0181 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.057,"smiles":null,"spectrum_id":"CCMSLIB00017320291","spectrum_index":53751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 110.0481 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.145,"smiles":null,"spectrum_id":"CCMSLIB00017320292","spectrum_index":53752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 32.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.159,"smiles":null,"spectrum_id":"CCMSLIB00017320293","spectrum_index":53753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 44.063 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.149,"smiles":null,"spectrum_id":"CCMSLIB00017320294","spectrum_index":53754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 164.1566 Da; putative annotation: N/A; putative formula: C12H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.243,"smiles":null,"spectrum_id":"CCMSLIB00017320295","spectrum_index":53755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 57.102 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.225,"smiles":null,"spectrum_id":"CCMSLIB00017320296","spectrum_index":53756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(5-Nitro-1H-indol-3-yl)ethan-1-one (delta mass: 27.0109 Da; putative annotation: N/A; putative formula: CHN)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.072,"smiles":null,"spectrum_id":"CCMSLIB00017320297","spectrum_index":53757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 84.0574 Da; putative annotation: N/A; putative formula: C5H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.155,"smiles":null,"spectrum_id":"CCMSLIB00017320298","spectrum_index":53758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 132.0463 Da; putative annotation: N/A; putative formula: C3H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.128,"smiles":null,"spectrum_id":"CCMSLIB00017320299","spectrum_index":53759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [2-(4-Chlorophenyl)ethyl](methyl)amine (delta mass: 103.1114 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.185,"smiles":null,"spectrum_id":"CCMSLIB00017320300","spectrum_index":53760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 70.0184 Da; putative annotation: N/A; putative formula: C2H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.105,"smiles":null,"spectrum_id":"CCMSLIB00017320301","spectrum_index":53761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Naphthyl)-2-naphthamide (delta mass: 18.0101 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.133,"smiles":null,"spectrum_id":"CCMSLIB00017320302","spectrum_index":53762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Inden-2-amine, 2,3-dihydro-N-methyl- (delta mass: 71.0131 Da; putative annotation: N/A; putative formula: CHN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.125,"smiles":null,"spectrum_id":"CCMSLIB00017320303","spectrum_index":53763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 428.3223 Da; putative annotation: N/A; putative formula: C19H40N8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.419,"smiles":null,"spectrum_id":"CCMSLIB00017320304","spectrum_index":53764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-GLUCOSE (delta mass: 106.115 Da; putative annotation: N/A; putative formula: C9H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.191,"smiles":null,"spectrum_id":"CCMSLIB00017320305","spectrum_index":53765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 216.0573 Da; putative annotation: N/A; putative formula: C16H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":471.191,"smiles":null,"spectrum_id":"CCMSLIB00017320306","spectrum_index":53766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2-Amino-1-phenylethanol from NIST14 (delta mass: 148.0517 Da; putative annotation: 3-(3-Hydroxyphenyl)propanoic acid; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.143,"smiles":null,"spectrum_id":"CCMSLIB00017320307","spectrum_index":53767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 162.0526 Da; putative annotation: D-(+)-Mannose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017320308","spectrum_index":53768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Z,E)-Tetradeca-9,12-dienol (delta mass: 122.1099 Da; putative annotation: trans,cis-3,6-Nonadien-1-ol; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.315,"smiles":null,"spectrum_id":"CCMSLIB00017320309","spectrum_index":53769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-.alpha.-Cyclohexylglycine (delta mass: 96.0942 Da; putative annotation: Cyclohexanemethanol; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.212,"smiles":null,"spectrum_id":"CCMSLIB00017320310","spectrum_index":53770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 287.0328 Da; putative annotation: 4-Desmethoxypropoxyl-4-chlororabeprazole; putative formula: C14H10ClN3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.083,"smiles":null,"spectrum_id":"CCMSLIB00017320311","spectrum_index":53771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:102040\"\" (delta mass: 68.0585 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.155,"smiles":null,"spectrum_id":"CCMSLIB00017320312","spectrum_index":53772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desomorphine (delta mass: 18.0103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.175,"smiles":null,"spectrum_id":"CCMSLIB00017320313","spectrum_index":53773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 258.0897 Da; putative annotation: N/A; putative formula: C8H14N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.112,"smiles":null,"spectrum_id":"CCMSLIB00017320314","spectrum_index":53774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naloxone N-oxide (delta mass: 96.0955 Da; putative annotation: N/A; putative formula: C7H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.245,"smiles":null,"spectrum_id":"CCMSLIB00017320315","spectrum_index":53775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Neodihydroprotolichesterinic acid (delta mass: 177.0766 Da; putative annotation: N/A; putative formula: C6H7N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.33,"smiles":null,"spectrum_id":"CCMSLIB00017320316","spectrum_index":53776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 46.0669 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.215,"smiles":null,"spectrum_id":"CCMSLIB00017320317","spectrum_index":53777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of phenylethanolamine - 40.0 eV (delta mass: 483.299 Da; putative annotation: N/A; putative formula: C30H45NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":621.39,"smiles":null,"spectrum_id":"CCMSLIB00017320318","spectrum_index":53778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 202.1032 Da; putative annotation: N/A; putative formula: C13H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.215,"smiles":null,"spectrum_id":"CCMSLIB00017320319","spectrum_index":53779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 24.0728 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.201,"smiles":null,"spectrum_id":"CCMSLIB00017320320","spectrum_index":53780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 130.1697 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.271,"smiles":null,"spectrum_id":"CCMSLIB00017320321","spectrum_index":53781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 38.1975 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.331,"smiles":null,"spectrum_id":"CCMSLIB00017320322","spectrum_index":53782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 282.1833 Da; putative annotation: N/A; putative formula: C16H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.249,"smiles":null,"spectrum_id":"CCMSLIB00017320323","spectrum_index":53783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of indirubin (delta mass: 17.1485 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.23,"smiles":null,"spectrum_id":"CCMSLIB00017320324","spectrum_index":53784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Chloro-5-(1H-pyrrol-2-yl)-1,3-dihydro-1,4-benzodiazepin-2-one (delta mass: 27.9914 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.05,"smiles":null,"spectrum_id":"CCMSLIB00017320325","spectrum_index":53785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 983.5097 Da; putative annotation: N/A; putative formula: C41H83N3O19P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1190.6,"smiles":null,"spectrum_id":"CCMSLIB00017320326","spectrum_index":53786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 867.4256 Da; putative annotation: N/A; putative formula: C49H57N9O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1074.51,"smiles":null,"spectrum_id":"CCMSLIB00017320327","spectrum_index":53787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-1,2,3,4-tetrahydroisoquinoline (delta mass: 94.0481 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":304.176,"smiles":null,"spectrum_id":"CCMSLIB00017320328","spectrum_index":53788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001203376-01!1-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid\"\" (delta mass: 40.0488 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.13,"smiles":null,"spectrum_id":"CCMSLIB00017320329","spectrum_index":53789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 286.1168 Da; putative annotation: N/A; putative formula: C12H18N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":451.193,"smiles":null,"spectrum_id":"CCMSLIB00017320330","spectrum_index":53790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 189.0995 Da; putative annotation: N/A; putative formula: C8H15NO4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.186,"smiles":null,"spectrum_id":"CCMSLIB00017320331","spectrum_index":53791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"(1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol CollisionEnergy:102040\"\" (delta mass: 32.0333 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.229,"smiles":null,"spectrum_id":"CCMSLIB00017320332","spectrum_index":53792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.alpha./.beta.-Hydroxyoxymorphone (delta mass: 145.0214 Da; putative annotation: N/A; putative formula: C5H9NP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.176,"smiles":null,"spectrum_id":"CCMSLIB00017320333","spectrum_index":53793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 125.0628 Da; putative annotation: N/A; putative formula: C10H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.171,"smiles":null,"spectrum_id":"CCMSLIB00017320334","spectrum_index":53794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole (delta mass: 2.0315 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017320335","spectrum_index":53795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyldanofloxacin (delta mass: 263.1568 Da; putative annotation: N/A; putative formula: C12H27NOP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.297,"smiles":null,"spectrum_id":"CCMSLIB00017320336","spectrum_index":53796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Naphthyl)-1H-indole (delta mass: 77.0409 Da; putative annotation: N/A; putative formula: C4H3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.153,"smiles":null,"spectrum_id":"CCMSLIB00017320337","spectrum_index":53797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinoline (delta mass: 45.0091 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.152,"smiles":null,"spectrum_id":"CCMSLIB00017320338","spectrum_index":53798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminoindole (delta mass: 228.054 Da; putative annotation: N/A; putative formula: C5H8N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.13,"smiles":null,"spectrum_id":"CCMSLIB00017320339","spectrum_index":53799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 155.0798 Da; putative annotation: N/A; putative formula: C5H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.239,"smiles":null,"spectrum_id":"CCMSLIB00017320340","spectrum_index":53800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Decitabine (delta mass: 121.0418 Da; putative annotation: N/A; putative formula: C2H8N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.135,"smiles":null,"spectrum_id":"CCMSLIB00017320341","spectrum_index":53801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthalenol, 1-[2-(2,4-dimethylphenyl)diazenyl]- (delta mass: 62.0238 Da; putative annotation: N/A; putative formula: C4H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.157,"smiles":null,"spectrum_id":"CCMSLIB00017320342","spectrum_index":53802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 304.1379 Da; putative annotation: N/A; putative formula: C21H21P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.25,"smiles":null,"spectrum_id":"CCMSLIB00017320343","spectrum_index":53803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 414.1666 Da; putative annotation: N/A; putative formula: C23H26O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":805.342,"smiles":null,"spectrum_id":"CCMSLIB00017320344","spectrum_index":53804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(3,4,5-Trimethoxyphenyl)propanohydrazide (delta mass: 26.0197 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.154,"smiles":null,"spectrum_id":"CCMSLIB00017320345","spectrum_index":53805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 147.1042 Da; putative annotation: N/A; putative formula: C10H13N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.217,"smiles":null,"spectrum_id":"CCMSLIB00017320346","spectrum_index":53806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 195.0912 Da; putative annotation: N/A; putative formula: C11H9N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.156,"smiles":null,"spectrum_id":"CCMSLIB00017320347","spectrum_index":53807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(2-Hydroxyethyl)indole (delta mass: 43.9487 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.04,"smiles":null,"spectrum_id":"CCMSLIB00017320348","spectrum_index":53808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of pyrraline (delta mass: 32.0264 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.16,"smiles":null,"spectrum_id":"CCMSLIB00017320349","spectrum_index":53809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 134.1087 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.179,"smiles":null,"spectrum_id":"CCMSLIB00017320350","spectrum_index":53810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 159.039 Da; putative annotation: N/A; putative formula: C3H5N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.125,"smiles":null,"spectrum_id":"CCMSLIB00017320351","spectrum_index":53811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]-2-furamide (delta mass: 46.005 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.128,"smiles":null,"spectrum_id":"CCMSLIB00017320352","spectrum_index":53812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 238.1533 Da; putative annotation: N/A; putative formula: C10H18N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.25,"smiles":null,"spectrum_id":"CCMSLIB00017320353","spectrum_index":53813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 36.0296 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.07,"smiles":null,"spectrum_id":"CCMSLIB00017320354","spectrum_index":53814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of sinomenine (delta mass: 86.0753 Da; putative annotation: N/A; putative formula: C5H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.245,"smiles":null,"spectrum_id":"CCMSLIB00017320355","spectrum_index":53815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HYDROQUINIDINE (delta mass: 405.343 Da; putative annotation: N/A; putative formula: C26H47NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.55,"smiles":null,"spectrum_id":"CCMSLIB00017320356","spectrum_index":53816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 94.0569 Da; putative annotation: N/A; putative formula: C5H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.133,"smiles":null,"spectrum_id":"CCMSLIB00017320357","spectrum_index":53817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aloeresin A (delta mass: 27.9948 Da; putative annotation: N/A; putative formula: CO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":569.165,"smiles":null,"spectrum_id":"CCMSLIB00017320358","spectrum_index":53818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 236.2144 Da; putative annotation: N/A; putative formula: C16H28O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":448.306,"smiles":null,"spectrum_id":"CCMSLIB00017320359","spectrum_index":53819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 745.1958 Da; putative annotation: N/A; putative formula: C42H35N7O-1P4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":950.282,"smiles":null,"spectrum_id":"CCMSLIB00017320360","spectrum_index":53820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 477.3304 Da; putative annotation: N/A; putative formula: C27H48N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":820.454,"smiles":null,"spectrum_id":"CCMSLIB00017320361","spectrum_index":53821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-3,4-dihydro-2(1H)-quinolinone (delta mass: 87.0677 Da; putative annotation: N/A; putative formula: C4H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.138,"smiles":null,"spectrum_id":"CCMSLIB00017320362","spectrum_index":53822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 312.0891 Da; putative annotation: N/A; putative formula: C11H22O6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":496.186,"smiles":null,"spectrum_id":"CCMSLIB00017320363","spectrum_index":53823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 231.0201 Da; putative annotation: N/A; putative formula: C8H9NO5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.117,"smiles":null,"spectrum_id":"CCMSLIB00017320364","spectrum_index":53824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-2-methyl-1H-indole (delta mass: 380.2287 Da; putative annotation: N/A; putative formula: C24H32N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.32,"smiles":null,"spectrum_id":"CCMSLIB00017320365","spectrum_index":53825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 277.4202 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":886.691,"smiles":null,"spectrum_id":"CCMSLIB00017320366","spectrum_index":53826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 131.997 Da; putative annotation: N/A; putative formula: C4H5O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.057,"smiles":null,"spectrum_id":"CCMSLIB00017320367","spectrum_index":53827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 84.0123 Da; putative annotation: N/A; putative formula: C4H5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.134,"smiles":null,"spectrum_id":"CCMSLIB00017320368","spectrum_index":53828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6-Fluoro-1H-benzimidazol-2-yl)methanol (delta mass: 272.077 Da; putative annotation: N/A; putative formula: C15H12O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.138,"smiles":null,"spectrum_id":"CCMSLIB00017320369","spectrum_index":53829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.175,"smiles":null,"spectrum_id":"CCMSLIB00017320370","spectrum_index":53830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 59.0343 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.11,"smiles":null,"spectrum_id":"CCMSLIB00017320371","spectrum_index":53831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austinoneol (delta mass: 47.0617 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.273,"smiles":null,"spectrum_id":"CCMSLIB00017320372","spectrum_index":53832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 18.0112 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.098,"smiles":null,"spectrum_id":"CCMSLIB00017320373","spectrum_index":53833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[(4-Methyl-1-piperazinyl)methyl]-1H-indole (delta mass: 54.0211 Da; putative annotation: N/A; putative formula: C2H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.186,"smiles":null,"spectrum_id":"CCMSLIB00017320374","spectrum_index":53834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 38.0206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.107,"smiles":null,"spectrum_id":"CCMSLIB00017320375","spectrum_index":53835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Oxindole; LC-tDDA; CE30 (delta mass: 23.9976 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.058,"smiles":null,"spectrum_id":"CCMSLIB00017320376","spectrum_index":53836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 482.2578 Da; putative annotation: N/A; putative formula: C24H34N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":620.349,"smiles":null,"spectrum_id":"CCMSLIB00017320377","spectrum_index":53837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 61.0395 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.085,"smiles":null,"spectrum_id":"CCMSLIB00017320378","spectrum_index":53838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Luciferin (delta mass: 16.0771 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.082,"smiles":null,"spectrum_id":"CCMSLIB00017320379","spectrum_index":53839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 191.1158 Da; putative annotation: N/A; putative formula: C9H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.165,"smiles":null,"spectrum_id":"CCMSLIB00017320380","spectrum_index":53840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCOSAMINE 6-PHOSPHATE SODIUM SALT - 40.0 eV (delta mass: 318.2286 Da; putative annotation: N/A; putative formula: C15H26N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.282,"smiles":null,"spectrum_id":"CCMSLIB00017320381","spectrum_index":53841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 26.9625 Da; putative annotation: N/A; putative formula: C9H13N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.101,"smiles":null,"spectrum_id":"CCMSLIB00017320382","spectrum_index":53842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 347.3407 Da; putative annotation: N/A; putative formula: C21H41N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.49,"smiles":null,"spectrum_id":"CCMSLIB00017320383","spectrum_index":53843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371603 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 49.0216 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.092,"smiles":null,"spectrum_id":"CCMSLIB00017320384","spectrum_index":53844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 418.1275 Da; putative annotation: N/A; putative formula: C32H19O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":761.251,"smiles":null,"spectrum_id":"CCMSLIB00017320385","spectrum_index":53845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 193.074 Da; putative annotation: N/A; putative formula: C10H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.176,"smiles":null,"spectrum_id":"CCMSLIB00017320386","spectrum_index":53846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 74.0415 Da; putative annotation: N/A; putative formula: C2H7N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.084,"smiles":null,"spectrum_id":"CCMSLIB00017320387","spectrum_index":53847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 52.0249 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.211,"smiles":null,"spectrum_id":"CCMSLIB00017320388","spectrum_index":53848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 227.1344 Da; putative annotation: N/A; putative formula: C12H21NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.299,"smiles":null,"spectrum_id":"CCMSLIB00017320389","spectrum_index":53849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of [4-(Difluoromethoxy)-3-methoxyphenyl]methanamine (delta mass: 82.046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.129,"smiles":null,"spectrum_id":"CCMSLIB00017320390","spectrum_index":53850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 344.234 Da; putative annotation: N/A; putative formula: C16H33N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":525.305,"smiles":null,"spectrum_id":"CCMSLIB00017320391","spectrum_index":53851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 183.036 Da; putative annotation: N/A; putative formula: CHN11O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.122,"smiles":null,"spectrum_id":"CCMSLIB00017320392","spectrum_index":53852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 95.0581 Da; putative annotation: N/A; putative formula: C3H5N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.134,"smiles":null,"spectrum_id":"CCMSLIB00017320393","spectrum_index":53853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 240.146 Da; putative annotation: N/A; putative formula: C14H25O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.238,"smiles":null,"spectrum_id":"CCMSLIB00017320394","spectrum_index":53854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Codeine-6-.beta.-D-glucuronide (delta mass: 88.0587 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":564.25,"smiles":null,"spectrum_id":"CCMSLIB00017320395","spectrum_index":53855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 246.1206 Da; putative annotation: N/A; putative formula: C12H23OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.265,"smiles":null,"spectrum_id":"CCMSLIB00017320396","spectrum_index":53856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 397.1949 Da; putative annotation: N/A; putative formula: C16H31NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.266,"smiles":null,"spectrum_id":"CCMSLIB00017320397","spectrum_index":53857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 671.2784 Da; putative annotation: N/A; putative formula: C44H37N3O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":822.339,"smiles":null,"spectrum_id":"CCMSLIB00017320398","spectrum_index":53858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 2.alpha.-Mannobiose from NIST14 (delta mass: 97.9747 Da; putative annotation: N/A; putative formula: C4H3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.098,"smiles":null,"spectrum_id":"CCMSLIB00017320399","spectrum_index":53859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 57.0215 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.16,"smiles":null,"spectrum_id":"CCMSLIB00017320400","spectrum_index":53860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 310.2803 Da; putative annotation: N/A; putative formula: C19H38N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.34,"smiles":null,"spectrum_id":"CCMSLIB00017320401","spectrum_index":53861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 659.359 Da; putative annotation: N/A; putative formula: C39H45N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":974.518,"smiles":null,"spectrum_id":"CCMSLIB00017320402","spectrum_index":53862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-Chloralose (delta mass: 16.1121 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.082,"smiles":null,"spectrum_id":"CCMSLIB00017320403","spectrum_index":53863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 216.1112 Da; putative annotation: N/A; putative formula: C9H16N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.133,"smiles":null,"spectrum_id":"CCMSLIB00017320404","spectrum_index":53864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 516.2999 Da; putative annotation: N/A; putative formula: C33H44N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":740.464,"smiles":null,"spectrum_id":"CCMSLIB00017320405","spectrum_index":53865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 6.9621 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.997,"smiles":null,"spectrum_id":"CCMSLIB00017320406","spectrum_index":53866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 145.9041 Da; putative annotation: N/A; putative formula: C2H-2N2S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.964,"smiles":null,"spectrum_id":"CCMSLIB00017320407","spectrum_index":53867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 38.0624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.331,"smiles":null,"spectrum_id":"CCMSLIB00017320408","spectrum_index":53868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 117.062 Da; putative annotation: N/A; putative formula: C5H11NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.084,"smiles":null,"spectrum_id":"CCMSLIB00017320409","spectrum_index":53869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 96.0212 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.118,"smiles":null,"spectrum_id":"CCMSLIB00017320410","spectrum_index":53870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 8.103 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.206,"smiles":null,"spectrum_id":"CCMSLIB00017320411","spectrum_index":53871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 52.0315 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.102,"smiles":null,"spectrum_id":"CCMSLIB00017320412","spectrum_index":53872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 767.498 Da; putative annotation: N/A; putative formula: C38H69N7O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":900.574,"smiles":null,"spectrum_id":"CCMSLIB00017320413","spectrum_index":53873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl .alpha.-D-mannopyranoside (delta mass: 207.1123 Da; putative annotation: N/A; putative formula: C9H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.199,"smiles":null,"spectrum_id":"CCMSLIB00017320414","spectrum_index":53874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSAMINE (delta mass: 133.9996 Da; putative annotation: N/A; putative formula: CH3N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.086,"smiles":null,"spectrum_id":"CCMSLIB00017320415","spectrum_index":53875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-DL-phenylalanine (delta mass: 17.0502 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.126,"smiles":null,"spectrum_id":"CCMSLIB00017320416","spectrum_index":53876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-carbinol (delta mass: 43.4243 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.5,"smiles":null,"spectrum_id":"CCMSLIB00017320417","spectrum_index":53877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 24.0065 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.093,"smiles":null,"spectrum_id":"CCMSLIB00017320418","spectrum_index":53878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylglutamine (delta mass: 110.0483 Da; putative annotation: N/A; putative formula: C5H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.167,"smiles":null,"spectrum_id":"CCMSLIB00017320419","spectrum_index":53879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 412.2405 Da; putative annotation: N/A; putative formula: C22H40N2O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":618.319,"smiles":null,"spectrum_id":"CCMSLIB00017320420","spectrum_index":53880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-6-methyl-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 132.0522 Da; putative annotation: N/A; putative formula: C6H13O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.134,"smiles":null,"spectrum_id":"CCMSLIB00017320421","spectrum_index":53881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 90.0531 Da; putative annotation: N/A; putative formula: CH6N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.238,"smiles":null,"spectrum_id":"CCMSLIB00017320422","spectrum_index":53882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile (delta mass: 181.2417 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.254,"smiles":null,"spectrum_id":"CCMSLIB00017320423","spectrum_index":53883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 33.9944 Da; putative annotation: N/A; putative formula: C2H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.102,"smiles":null,"spectrum_id":"CCMSLIB00017320424","spectrum_index":53884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Meropenem (delta mass: 268.1271 Da; putative annotation: N/A; putative formula: C9H20N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":652.286,"smiles":null,"spectrum_id":"CCMSLIB00017320425","spectrum_index":53885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 232.1999 Da; putative annotation: N/A; putative formula: C9H24N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.359,"smiles":null,"spectrum_id":"CCMSLIB00017320426","spectrum_index":53886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 245.1129 Da; putative annotation: N/A; putative formula: C9H19N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.215,"smiles":null,"spectrum_id":"CCMSLIB00017320427","spectrum_index":53887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 14.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":158.056,"smiles":null,"spectrum_id":"CCMSLIB00017320428","spectrum_index":53888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of otosenine (delta mass: 164.1044 Da; putative annotation: N/A; putative formula: C8H12N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.275,"smiles":null,"spectrum_id":"CCMSLIB00017320429","spectrum_index":53889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 59.0257 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.117,"smiles":null,"spectrum_id":"CCMSLIB00017320430","spectrum_index":53890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-3-(4-hydroxy-3-methoxyphenyl)propanoic acid (delta mass: 38.0521 Da; putative annotation: N/A; putative formula: C4H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.154,"smiles":null,"spectrum_id":"CCMSLIB00017320431","spectrum_index":53891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 9.9939 Da; putative annotation: N/A; putative formula: H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.005,"smiles":null,"spectrum_id":"CCMSLIB00017320432","spectrum_index":53892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Toloxatone (delta mass: 45.021 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":253.118,"smiles":null,"spectrum_id":"CCMSLIB00017320433","spectrum_index":53893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 434.2157 Da; putative annotation: N/A; putative formula: C23H35N2O2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.385,"smiles":null,"spectrum_id":"CCMSLIB00017320434","spectrum_index":53894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 186.0887 Da; putative annotation: N/A; putative formula: C9H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.164,"smiles":null,"spectrum_id":"CCMSLIB00017320435","spectrum_index":53895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 45.0822 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.132,"smiles":null,"spectrum_id":"CCMSLIB00017320436","spectrum_index":53896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 80.0629 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.3,"smiles":null,"spectrum_id":"CCMSLIB00017320437","spectrum_index":53897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 465.3094 Da; putative annotation: N/A; putative formula: C26H43NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.37,"smiles":null,"spectrum_id":"CCMSLIB00017320438","spectrum_index":53898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetylpyrrole (delta mass: 110.0728 Da; putative annotation: N/A; putative formula: C7H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.133,"smiles":null,"spectrum_id":"CCMSLIB00017320439","spectrum_index":53899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salsolinol (delta mass: 65.9488 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.051,"smiles":null,"spectrum_id":"CCMSLIB00017320440","spectrum_index":53900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Di(2-naphthyl)amine (delta mass: 16.0308 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.159,"smiles":null,"spectrum_id":"CCMSLIB00017320441","spectrum_index":53901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 88.0524 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":254.139,"smiles":null,"spectrum_id":"CCMSLIB00017320442","spectrum_index":53902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 331.0785 Da; putative annotation: N/A; putative formula: C12H13N9O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.139,"smiles":null,"spectrum_id":"CCMSLIB00017320443","spectrum_index":53903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 56.0372 Da; putative annotation: N/A; putative formula: C2H4N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.16,"smiles":null,"spectrum_id":"CCMSLIB00017320444","spectrum_index":53904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 111.9851 Da; putative annotation: N/A; putative formula: C2N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.026,"smiles":null,"spectrum_id":"CCMSLIB00017320445","spectrum_index":53905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Aminobutyl)urea (delta mass: 99.0563 Da; putative annotation: N/A; putative formula: C2H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.169,"smiles":null,"spectrum_id":"CCMSLIB00017320446","spectrum_index":53906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 43.1165 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.219,"smiles":null,"spectrum_id":"CCMSLIB00017320447","spectrum_index":53907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 57.0578 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.112,"smiles":null,"spectrum_id":"CCMSLIB00017320448","spectrum_index":53908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 177.0409 Da; putative annotation: N/A; putative formula: C3H8N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":358.12,"smiles":null,"spectrum_id":"CCMSLIB00017320449","spectrum_index":53909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-bis(4-hydroxyphenyl)heptan-3-one (delta mass: 190.0676 Da; putative annotation: N/A; putative formula: C8H16OP2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.232,"smiles":null,"spectrum_id":"CCMSLIB00017320450","spectrum_index":53910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 55.0155 Da; putative annotation: N/A; putative formula: CHN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.202,"smiles":null,"spectrum_id":"CCMSLIB00017320451","spectrum_index":53911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 113.0853 Da; putative annotation: Norleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.256,"smiles":null,"spectrum_id":"CCMSLIB00017320452","spectrum_index":53912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 117.0575 Da; putative annotation: 4-Amino-5-fluoropentanoic acid; putative formula: C5H8FNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.128,"smiles":null,"spectrum_id":"CCMSLIB00017320453","spectrum_index":53913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100306 O-Acetyl-L-homoserine|Ac-HSer|(2S)-4-(acetyloxy)-2-aminobutanoic acid (delta mass: 101.0482 Da; putative annotation: MFCD00209793 - 30.0 eV; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":263.124,"smiles":null,"spectrum_id":"CCMSLIB00017320454","spectrum_index":53914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 128.0586 Da; putative annotation: Glutamine; AIF; CE0; CorrDec; putative formula: C5H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.129,"smiles":null,"spectrum_id":"CCMSLIB00017320455","spectrum_index":53915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 1070.5666 Da; putative annotation: (3?,5?,9?,16?)-16,23-Dihydroxy-13,28-epoxyolean-11-en-3-yl 6-deoxy-?-L-mannopyranosyl-(1->2)-[6-deoxy-?-L-mannopyranosyl-(1->4)-?-D-glucopyranosyl-(1->3)]-?-D-glucopyranoside; putative formula: C54H86O21)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1251.64,"smiles":null,"spectrum_id":"CCMSLIB00017320456","spectrum_index":53916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 149.0464 Da; putative annotation: 3-Hydroxyacetaminophen; putative formula: C8H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.107,"smiles":null,"spectrum_id":"CCMSLIB00017320457","spectrum_index":53917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 230.1309 Da; putative annotation: 6-Hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,9a,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one; putative formula: C15H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.196,"smiles":null,"spectrum_id":"CCMSLIB00017320458","spectrum_index":53918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 176.1203 Da; putative annotation: 3-Methyl-1-adamantanecarboxylic acid; putative formula: C12H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.347,"smiles":null,"spectrum_id":"CCMSLIB00017320459","spectrum_index":53919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 150.1045 Da; putative annotation: (2E)-3-Cyclohexyl-2-butenoic acid; putative formula: C10H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.217,"smiles":null,"spectrum_id":"CCMSLIB00017320460","spectrum_index":53920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 146.0577 Da; putative annotation: L-Fucose; putative formula: C6H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.138,"smiles":null,"spectrum_id":"CCMSLIB00017320461","spectrum_index":53921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 34.0049 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.18,"smiles":null,"spectrum_id":"CCMSLIB00017320462","spectrum_index":53922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 421.1531 Da; putative annotation: N/A; putative formula: C17H23N7O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":766.323,"smiles":null,"spectrum_id":"CCMSLIB00017320463","spectrum_index":53923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 117.1979 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.321,"smiles":null,"spectrum_id":"CCMSLIB00017320464","spectrum_index":53924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-Dihydroxyheptadec-16-yn-4-yl acetate (delta mass: 80.0628 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.316,"smiles":null,"spectrum_id":"CCMSLIB00017320465","spectrum_index":53925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 52.0318 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":180.139,"smiles":null,"spectrum_id":"CCMSLIB00017320466","spectrum_index":53926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Chloropropyl)-1,3-dihydro-2H-benzimidazol-2-one (delta mass: 47.9962 Da; putative annotation: N/A; putative formula: C4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.06,"smiles":null,"spectrum_id":"CCMSLIB00017320467","spectrum_index":53927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 166.0839 Da; putative annotation: N/A; putative formula: C3H6N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":511.217,"smiles":null,"spectrum_id":"CCMSLIB00017320468","spectrum_index":53928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 327.2064 Da; putative annotation: N/A; putative formula: C18H25N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":486.287,"smiles":null,"spectrum_id":"CCMSLIB00017320469","spectrum_index":53929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]cyclopropanecarboxamide (delta mass: 27.9858 Da; putative annotation: N/A; putative formula: CHO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.13,"smiles":null,"spectrum_id":"CCMSLIB00017320470","spectrum_index":53930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"[4-(2-1,2,3,4-tetrahydroisoquinolylmethyl)phenyl]-N-(2-{[4-(2-1,2,3,4-tetrahyd roisoquinolylmethyl)phenyl]carbonylamino}ethyl)carboxamide CollisionEnergy:102040\"\" (delta mass: 131.098 Da; putative annotation: N/A; putative formula: C5H14N3O-1P)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.405,"smiles":null,"spectrum_id":"CCMSLIB00017320471","spectrum_index":53931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 124.0677 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.107,"smiles":null,"spectrum_id":"CCMSLIB00017320472","spectrum_index":53932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 595.2477 Da; putative annotation: N/A; putative formula: C31H33N9O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":956.412,"smiles":null,"spectrum_id":"CCMSLIB00017320473","spectrum_index":53933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(5-Aminopentyl)-N-hydroxyacetamide (delta mass: 53.05 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.178,"smiles":null,"spectrum_id":"CCMSLIB00017320474","spectrum_index":53934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide (delta mass: 38.0191 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.153,"smiles":null,"spectrum_id":"CCMSLIB00017320475","spectrum_index":53935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 45.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.17,"smiles":null,"spectrum_id":"CCMSLIB00017320476","spectrum_index":53936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 317.3017 Da; putative annotation: N/A; putative formula: C22H39N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.471,"smiles":null,"spectrum_id":"CCMSLIB00017320477","spectrum_index":53937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 242.07 Da; putative annotation: N/A; putative formula: C6H10N8OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.156,"smiles":null,"spectrum_id":"CCMSLIB00017320478","spectrum_index":53938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ampicillin (delta mass: 69.0641 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.181,"smiles":null,"spectrum_id":"CCMSLIB00017320479","spectrum_index":53939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acaranoic acid (delta mass: 23.9999 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.222,"smiles":null,"spectrum_id":"CCMSLIB00017320480","spectrum_index":53940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aerugine (delta mass: 59.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.126,"smiles":null,"spectrum_id":"CCMSLIB00017320481","spectrum_index":53941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 710.372 Da; putative annotation: N/A; putative formula: C46H50N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":971.409,"smiles":null,"spectrum_id":"CCMSLIB00017320482","spectrum_index":53942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 816.2536 Da; putative annotation: N/A; putative formula: C32H48O24)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1038.35,"smiles":null,"spectrum_id":"CCMSLIB00017320483","spectrum_index":53943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-3-(1H-indol-3-yl)butanoic acid (delta mass: 282.2768 Da; putative annotation: N/A; putative formula: C16H34N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":502.374,"smiles":null,"spectrum_id":"CCMSLIB00017320484","spectrum_index":53944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 141.2948 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.354,"smiles":null,"spectrum_id":"CCMSLIB00017320485","spectrum_index":53945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Glu (delta mass: 121.0777 Da; putative annotation: N/A; putative formula: C5H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.165,"smiles":null,"spectrum_id":"CCMSLIB00017320486","spectrum_index":53946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Val (delta mass: 246.1361 Da; putative annotation: N/A; putative formula: C14H18N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.275,"smiles":null,"spectrum_id":"CCMSLIB00017320487","spectrum_index":53947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU238301 Sotalol|N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide (delta mass: 328.1398 Da; putative annotation: N/A; putative formula: C22H20N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.266,"smiles":null,"spectrum_id":"CCMSLIB00017320488","spectrum_index":53948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 316.1517 Da; putative annotation: N/A; putative formula: C15H24O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.227,"smiles":null,"spectrum_id":"CCMSLIB00017320489","spectrum_index":53949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 8.9903 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.082,"smiles":null,"spectrum_id":"CCMSLIB00017320490","spectrum_index":53950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxynonenal (delta mass: 50.0522 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.174,"smiles":null,"spectrum_id":"CCMSLIB00017320491","spectrum_index":53951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 238.1928 Da; putative annotation: N/A; putative formula: C15H26O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.29,"smiles":null,"spectrum_id":"CCMSLIB00017320492","spectrum_index":53952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 341.1322 Da; putative annotation: N/A; putative formula: C12H23NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":702.297,"smiles":null,"spectrum_id":"CCMSLIB00017320493","spectrum_index":53953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Myricanol (delta mass: 41.062 Da; putative annotation: N/A; putative formula: C3H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.247,"smiles":null,"spectrum_id":"CCMSLIB00017320494","spectrum_index":53954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,2'-Bipyridine-4,4'-dicarboxylic acid (delta mass: 135.0687 Da; putative annotation: N/A; putative formula: C8H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.124,"smiles":null,"spectrum_id":"CCMSLIB00017320495","spectrum_index":53955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 60.0573 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.169,"smiles":null,"spectrum_id":"CCMSLIB00017320496","spectrum_index":53956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00160283-01!1-(8-Quinolinyl)-beta-carboline (delta mass: 18.0109 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":314.129,"smiles":null,"spectrum_id":"CCMSLIB00017320497","spectrum_index":53957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 287.0866 Da; putative annotation: N/A; putative formula: C9H13N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.173,"smiles":null,"spectrum_id":"CCMSLIB00017320498","spectrum_index":53958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Acetyl-L-serine (delta mass: 129.0396 Da; putative annotation: N/A; putative formula: CH3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.1,"smiles":null,"spectrum_id":"CCMSLIB00017320499","spectrum_index":53959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 117.9352 Da; putative annotation: N/A; putative formula: C2H-2O4S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.995,"smiles":null,"spectrum_id":"CCMSLIB00017320500","spectrum_index":53960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 97.0888 Da; putative annotation: N/A; putative formula: C6H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.233,"smiles":null,"spectrum_id":"CCMSLIB00017320501","spectrum_index":53961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 85.0393 Da; putative annotation: N/A; putative formula: CH3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.162,"smiles":null,"spectrum_id":"CCMSLIB00017320502","spectrum_index":53962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 210.1091 Da; putative annotation: N/A; putative formula: C12H20O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":541.263,"smiles":null,"spectrum_id":"CCMSLIB00017320503","spectrum_index":53963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 212.16 Da; putative annotation: N/A; putative formula: C13H24S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.314,"smiles":null,"spectrum_id":"CCMSLIB00017320504","spectrum_index":53964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 114.0427 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.172,"smiles":null,"spectrum_id":"CCMSLIB00017320505","spectrum_index":53965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 99.0471 Da; putative annotation: N/A; putative formula: C8H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.128,"smiles":null,"spectrum_id":"CCMSLIB00017320506","spectrum_index":53966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-D-Xylobiose (delta mass: 163.0848 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.187,"smiles":null,"spectrum_id":"CCMSLIB00017320507","spectrum_index":53967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of imbricatine (delta mass: 74.036 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.133,"smiles":null,"spectrum_id":"CCMSLIB00017320508","spectrum_index":53968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dacinostat (delta mass: 69.0679 Da; putative annotation: N/A; putative formula: C3H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.265,"smiles":null,"spectrum_id":"CCMSLIB00017320509","spectrum_index":53969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HNQ:db (delta mass: 79.9752 Da; putative annotation: N/A; putative formula: O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.16,"smiles":null,"spectrum_id":"CCMSLIB00017320510","spectrum_index":53970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 122.1096 Da; putative annotation: N/A; putative formula: C9H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.17,"smiles":null,"spectrum_id":"CCMSLIB00017320511","spectrum_index":53971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-Glu (delta mass: 226.0589 Da; putative annotation: N/A; putative formula: C9H10N2O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.162,"smiles":null,"spectrum_id":"CCMSLIB00017320512","spectrum_index":53972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 325.1017 Da; putative annotation: N/A; putative formula: C12H23NO5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":606.255,"smiles":null,"spectrum_id":"CCMSLIB00017320513","spectrum_index":53973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 126.0832 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.128,"smiles":null,"spectrum_id":"CCMSLIB00017320514","spectrum_index":53974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 17.0269 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.15,"smiles":null,"spectrum_id":"CCMSLIB00017320515","spectrum_index":53975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU228201 10,11-Dihydro-10-Hydroxycarbazepine|Licarbazepine|5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 207.1729 Da; putative annotation: N/A; putative formula: C12H21N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":462.286,"smiles":null,"spectrum_id":"CCMSLIB00017320516","spectrum_index":53976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1026.3486 Da; putative annotation: N/A; putative formula: C36H66O33)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1369.47,"smiles":null,"spectrum_id":"CCMSLIB00017320517","spectrum_index":53977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 316.206 Da; putative annotation: N/A; putative formula: C13H30N6O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.298,"smiles":null,"spectrum_id":"CCMSLIB00017320518","spectrum_index":53978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 25.0343 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.094,"smiles":null,"spectrum_id":"CCMSLIB00017320519","spectrum_index":53979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 121.0569 Da; putative annotation: N/A; putative formula: CH7N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.122,"smiles":null,"spectrum_id":"CCMSLIB00017320520","spectrum_index":53980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 101.0529 Da; putative annotation: N/A; putative formula: C3H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.161,"smiles":null,"spectrum_id":"CCMSLIB00017320521","spectrum_index":53981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 59.0375 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.139,"smiles":null,"spectrum_id":"CCMSLIB00017320522","spectrum_index":53982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00385474-01_C21H24N2O4_2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethylidene-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, 3-oxide, (5E)- (delta mass: 43.0088 Da; putative annotation: N/A; putative formula: CHNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.19,"smiles":null,"spectrum_id":"CCMSLIB00017320523","spectrum_index":53983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Egenine (delta mass: 13.0362 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.165,"smiles":null,"spectrum_id":"CCMSLIB00017320524","spectrum_index":53984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(?)-ampicillin - 30.0 eV (delta mass: 216.0547 Da; putative annotation: N/A; putative formula: C12H4N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.172,"smiles":null,"spectrum_id":"CCMSLIB00017320525","spectrum_index":53985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 185.2027 Da; putative annotation: N/A; putative formula: C9H23N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.3,"smiles":null,"spectrum_id":"CCMSLIB00017320526","spectrum_index":53986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 309.1214 Da; putative annotation: N/A; putative formula: C15H19NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":474.197,"smiles":null,"spectrum_id":"CCMSLIB00017320527","spectrum_index":53987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 241.1506 Da; putative annotation: N/A; putative formula: C13H23NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.252,"smiles":null,"spectrum_id":"CCMSLIB00017320528","spectrum_index":53988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tyramine (delta mass: 175.0408 Da; putative annotation: N/A; putative formula: C7H6N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.132,"smiles":null,"spectrum_id":"CCMSLIB00017320529","spectrum_index":53989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MLS001401377-01!Atomoxetine hydrochloride (delta mass: 125.1063 Da; putative annotation: N/A; putative formula: C5H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.253,"smiles":null,"spectrum_id":"CCMSLIB00017320530","spectrum_index":53990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 169.053 Da; putative annotation: N/A; putative formula: C11H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":464.155,"smiles":null,"spectrum_id":"CCMSLIB00017320531","spectrum_index":53991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 195.1094 Da; putative annotation: N/A; putative formula: C4H9N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.279,"smiles":null,"spectrum_id":"CCMSLIB00017320532","spectrum_index":53992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 415.2571 Da; putative annotation: N/A; putative formula: C21H37NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":566.317,"smiles":null,"spectrum_id":"CCMSLIB00017320533","spectrum_index":53993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 341.2804 Da; putative annotation: N/A; putative formula: C17H35N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":563.378,"smiles":null,"spectrum_id":"CCMSLIB00017320534","spectrum_index":53994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinecarboxylic acid, 2-[(4-oxo-4H-1-benzopyran-3-yl)methylene]hydrazide (delta mass: 50.0187 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.106,"smiles":null,"spectrum_id":"CCMSLIB00017320535","spectrum_index":53995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 133.0413 Da; putative annotation: N/A; putative formula: C3H8N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.174,"smiles":null,"spectrum_id":"CCMSLIB00017320536","spectrum_index":53996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 75.0854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.134,"smiles":null,"spectrum_id":"CCMSLIB00017320537","spectrum_index":53997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 138.1138 Da; putative annotation: N/A; putative formula: C8H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.226,"smiles":null,"spectrum_id":"CCMSLIB00017320538","spectrum_index":53998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 245.2408 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.353,"smiles":null,"spectrum_id":"CCMSLIB00017320539","spectrum_index":53999},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 614.3454 Da; putative annotation: N/A; putative formula: C35H50O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":807.416,"smiles":null,"spectrum_id":"CCMSLIB00017320540","spectrum_index":54000},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-7-carboxaldehyde (delta mass: 38.9261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.986,"smiles":null,"spectrum_id":"CCMSLIB00017320541","spectrum_index":54001},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 218.2036 Da; putative annotation: N/A; putative formula: C16H26)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.269,"smiles":null,"spectrum_id":"CCMSLIB00017320542","spectrum_index":54002},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 186.1256 Da; putative annotation: N/A; putative formula: C10H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.19,"smiles":null,"spectrum_id":"CCMSLIB00017320543","spectrum_index":54003},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 274.0818 Da; putative annotation: N/A; putative formula: C15H14O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.158,"smiles":null,"spectrum_id":"CCMSLIB00017320544","spectrum_index":54004},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 749.4736 Da; putative annotation: N/A; putative formula: C43H59N9O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":914.549,"smiles":null,"spectrum_id":"CCMSLIB00017320545","spectrum_index":54005},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSAMINE (delta mass: 69.058 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.145,"smiles":null,"spectrum_id":"CCMSLIB00017320546","spectrum_index":54006},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006021 (+/-) Salsolinol|1-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 180.0789 Da; putative annotation: N/A; putative formula: C10H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.181,"smiles":null,"spectrum_id":"CCMSLIB00017320547","spectrum_index":54007},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-2,3,4,5-tetrahydro-1H-azepin[4,5-b]indole (delta mass: 12.0237 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.162,"smiles":null,"spectrum_id":"CCMSLIB00017320548","spectrum_index":54008},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 133.0537 Da; putative annotation: N/A; putative formula: C8H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.151,"smiles":null,"spectrum_id":"CCMSLIB00017320549","spectrum_index":54009},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 123.0531 Da; putative annotation: N/A; putative formula: C4H5N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.165,"smiles":null,"spectrum_id":"CCMSLIB00017320550","spectrum_index":54010},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 489.2003 Da; putative annotation: N/A; putative formula: C28H32N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":696.287,"smiles":null,"spectrum_id":"CCMSLIB00017320551","spectrum_index":54011},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 112.0013 Da; putative annotation: N/A; putative formula: C2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.082,"smiles":null,"spectrum_id":"CCMSLIB00017320552","spectrum_index":54012},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Aminomethyl)indole (delta mass: 66.0735 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.165,"smiles":null,"spectrum_id":"CCMSLIB00017320553","spectrum_index":54013},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Naphthyl)-1H-indole (delta mass: 17.0183 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.13,"smiles":null,"spectrum_id":"CCMSLIB00017320554","spectrum_index":54014},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 121.049 Da; putative annotation: N/A; putative formula: C2H7N3O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.203,"smiles":null,"spectrum_id":"CCMSLIB00017320555","spectrum_index":54015},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 412.7828 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.88,"smiles":null,"spectrum_id":"CCMSLIB00017320556","spectrum_index":54016},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 250.0635 Da; putative annotation: N/A; putative formula: C8H16N2O3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.187,"smiles":null,"spectrum_id":"CCMSLIB00017320557","spectrum_index":54017},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 225.3147 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":584.5,"smiles":null,"spectrum_id":"CCMSLIB00017320558","spectrum_index":54018},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 60.0212 Da; putative annotation: N/A; putative formula: C2H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.113,"smiles":null,"spectrum_id":"CCMSLIB00017320559","spectrum_index":54019},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carbonitrile (delta mass: 145.0718 Da; putative annotation: N/A; putative formula: C2H7N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.132,"smiles":null,"spectrum_id":"CCMSLIB00017320560","spectrum_index":54020},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Indole-3-lactic acid (delta mass: 317.1118 Da; putative annotation: N/A; putative formula: C14H23NO3S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":523.193,"smiles":null,"spectrum_id":"CCMSLIB00017320561","spectrum_index":54021},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 112.1101 Da; putative annotation: N/A; putative formula: C5H12N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.196,"smiles":null,"spectrum_id":"CCMSLIB00017320562","spectrum_index":54022},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 157.0634 Da; putative annotation: N/A; putative formula: C9H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.134,"smiles":null,"spectrum_id":"CCMSLIB00017320563","spectrum_index":54023},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 262.2294 Da; putative annotation: N/A; putative formula: C18H30O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.326,"smiles":null,"spectrum_id":"CCMSLIB00017320564","spectrum_index":54024},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (5-Methoxy-1H-indol-2-yl)methanol (delta mass: 12.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":190.144,"smiles":null,"spectrum_id":"CCMSLIB00017320565","spectrum_index":54025},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-BUTYRIC ACID (delta mass: 430.3582 Da; putative annotation: N/A; putative formula: C25H51O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.46,"smiles":null,"spectrum_id":"CCMSLIB00017320566","spectrum_index":54026},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Thr (delta mass: 18.0144 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.123,"smiles":null,"spectrum_id":"CCMSLIB00017320567","spectrum_index":54027},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 168.1787 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.307,"smiles":null,"spectrum_id":"CCMSLIB00017320568","spectrum_index":54028},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 227.1016 Da; putative annotation: N/A; putative formula: C8H13N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.198,"smiles":null,"spectrum_id":"CCMSLIB00017320569","spectrum_index":54029},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 779.4514 Da; putative annotation: N/A; putative formula: C32H57N15O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":986.538,"smiles":null,"spectrum_id":"CCMSLIB00017320570","spectrum_index":54030},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sorbitol-6-phosphate (delta mass: 148.0381 Da; putative annotation: N/A; putative formula: C6H12S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.091,"smiles":null,"spectrum_id":"CCMSLIB00017320571","spectrum_index":54031},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyltyramine (delta mass: 208.121 Da; putative annotation: N/A; putative formula: C11H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.228,"smiles":null,"spectrum_id":"CCMSLIB00017320572","spectrum_index":54032},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 116.0623 Da; putative annotation: N/A; putative formula: C9H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.159,"smiles":null,"spectrum_id":"CCMSLIB00017320573","spectrum_index":54033},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU161803 Ecgonine-methyl-ester (EME)|AC1L9FBF|methyl (3S,4R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate (delta mass: 135.057 Da; putative annotation: N/A; putative formula: C3H10N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017320574","spectrum_index":54034},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 266.0344 Da; putative annotation: N/A; putative formula: C12H11O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":447.105,"smiles":null,"spectrum_id":"CCMSLIB00017320575","spectrum_index":54035},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol (delta mass: 250.9623 Da; putative annotation: N/A; putative formula: C3H3N5O5P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":491.122,"smiles":null,"spectrum_id":"CCMSLIB00017320576","spectrum_index":54036},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 325.1291 Da; putative annotation: N/A; putative formula: C12H24NO7P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":437.168,"smiles":null,"spectrum_id":"CCMSLIB00017320577","spectrum_index":54037},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 273.1447 Da; putative annotation: N/A; putative formula: C11H23N5O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":574.325,"smiles":null,"spectrum_id":"CCMSLIB00017320578","spectrum_index":54038},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 41.0344 Da; putative annotation: N/A; putative formula: CH3N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.116,"smiles":null,"spectrum_id":"CCMSLIB00017320579","spectrum_index":54039},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 32.0624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017320580","spectrum_index":54040},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 254.1002 Da; putative annotation: N/A; putative formula: C9H18O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.176,"smiles":null,"spectrum_id":"CCMSLIB00017320581","spectrum_index":54041},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxyindole-3-acetic acid (delta mass: 67.0513 Da; putative annotation: N/A; putative formula: C3H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.117,"smiles":null,"spectrum_id":"CCMSLIB00017320582","spectrum_index":54042},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 150.1118 Da; putative annotation: N/A; putative formula: C9H14N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.167,"smiles":null,"spectrum_id":"CCMSLIB00017320583","spectrum_index":54043},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 743.342 Da; putative annotation: N/A; putative formula: C41H49N3O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":965.439,"smiles":null,"spectrum_id":"CCMSLIB00017320584","spectrum_index":54044},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 100.1415 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.187,"smiles":null,"spectrum_id":"CCMSLIB00017320585","spectrum_index":54045},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100334 D-(-)-Erythrose|(2R,3R)-(-)-Erythrose|2,3,4-Trihydroxybutanal (delta mass: 3.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":124.087,"smiles":null,"spectrum_id":"CCMSLIB00017320586","spectrum_index":54046},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 109.0742 Da; putative annotation: N/A; putative formula: C4H7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.129,"smiles":null,"spectrum_id":"CCMSLIB00017320587","spectrum_index":54047},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-DEOXY-D-GLUCOSE - 50.0 eV (delta mass: 55.0423 Da; putative annotation: N/A; putative formula: C3H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.118,"smiles":null,"spectrum_id":"CCMSLIB00017320588","spectrum_index":54048},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 315.1832 Da; putative annotation: N/A; putative formula: C19H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.332,"smiles":null,"spectrum_id":"CCMSLIB00017320589","spectrum_index":54049},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 56.0629 Da; putative annotation: N/A; putative formula: C4H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.155,"smiles":null,"spectrum_id":"CCMSLIB00017320590","spectrum_index":54050},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 81.0579 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017320591","spectrum_index":54051},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 331.1404 Da; putative annotation: N/A; putative formula: C15H13N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.238,"smiles":null,"spectrum_id":"CCMSLIB00017320592","spectrum_index":54052},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 117.0576 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.108,"smiles":null,"spectrum_id":"CCMSLIB00017320593","spectrum_index":54053},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 33.0166 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":179.017,"smiles":null,"spectrum_id":"CCMSLIB00017320594","spectrum_index":54054},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 71.0345 Da; putative annotation: N/A; putative formula: C3H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.188,"smiles":null,"spectrum_id":"CCMSLIB00017320595","spectrum_index":54055},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 62.052 Da; putative annotation: N/A; putative formula: C6H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.342,"smiles":null,"spectrum_id":"CCMSLIB00017320596","spectrum_index":54056},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 122.0592 Da; putative annotation: N/A; putative formula: C5H6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.161,"smiles":null,"spectrum_id":"CCMSLIB00017320597","spectrum_index":54057},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Higenamine hydrochloride (delta mass: 43.0507 Da; putative annotation: N/A; putative formula: CH5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.155,"smiles":null,"spectrum_id":"CCMSLIB00017320598","spectrum_index":54058},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 27.0478 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.181,"smiles":null,"spectrum_id":"CCMSLIB00017320599","spectrum_index":54059},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 161.1781 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.249,"smiles":null,"spectrum_id":"CCMSLIB00017320600","spectrum_index":54060},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Guanidinopropionic acid (delta mass: 42.0332 Da; putative annotation: N/A; putative formula: H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":174.11,"smiles":null,"spectrum_id":"CCMSLIB00017320601","spectrum_index":54061},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 103.034 Da; putative annotation: N/A; putative formula: CH5N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":287.131,"smiles":null,"spectrum_id":"CCMSLIB00017320602","spectrum_index":54062},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Dihydroxyindole-2-carboxylic acid (delta mass: 160.0371 Da; putative annotation: N/A; putative formula: C6H8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.082,"smiles":null,"spectrum_id":"CCMSLIB00017320603","spectrum_index":54063},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(6-Hydroxy-1,2-dihydro-5-acenaphthylenyl)ethanone (delta mass: 154.0593 Da; putative annotation: N/A; putative formula: C4H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.15,"smiles":null,"spectrum_id":"CCMSLIB00017320604","spectrum_index":54064},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 57.0203 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.143,"smiles":null,"spectrum_id":"CCMSLIB00017320605","spectrum_index":54065},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Norphenylephrine (delta mass: 120.0574 Da; putative annotation: R-(-)-Phenyl-1,2-ethanediol; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.144,"smiles":null,"spectrum_id":"CCMSLIB00017320606","spectrum_index":54066},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Decyn-1-ol (delta mass: 256.2021 Da; putative annotation: Monolaurin; putative formula: C15H28O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.345,"smiles":null,"spectrum_id":"CCMSLIB00017320607","spectrum_index":54067},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 280.2409 Da; putative annotation: 8-(3-Octyl-2-oxiranyl)octanoic acid; putative formula: C18H32O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.306,"smiles":null,"spectrum_id":"CCMSLIB00017320608","spectrum_index":54068},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 198.1255 Da; putative annotation: Sebacic acid monomethyl ester; putative formula: C11H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.191,"smiles":null,"spectrum_id":"CCMSLIB00017320609","spectrum_index":54069},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Formyl-L-tryptophan (delta mass: 186.0994 Da; putative annotation: Val-Ser; putative formula: C8H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.191,"smiles":null,"spectrum_id":"CCMSLIB00017320610","spectrum_index":54070},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 141.0424 Da; putative annotation: (2-Oxo-4-morpholinyl)acetic acid; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.134,"smiles":null,"spectrum_id":"CCMSLIB00017320611","spectrum_index":54071},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 94.0417 Da; putative annotation: (2E,4E)-Hexa-2,4-dienoic acid; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.149,"smiles":null,"spectrum_id":"CCMSLIB00017320612","spectrum_index":54072},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 486.1559 Da; putative annotation: RAFFINOSE; putative formula: C18H30O15)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":708.253,"smiles":null,"spectrum_id":"CCMSLIB00017320613","spectrum_index":54073},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 214.0995 Da; putative annotation: Asp-Val; putative formula: C9H14N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.155,"smiles":null,"spectrum_id":"CCMSLIB00017320614","spectrum_index":54074},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 138.0466 Da; putative annotation: N/A; putative formula: C11H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.17,"smiles":null,"spectrum_id":"CCMSLIB00017320615","spectrum_index":54075},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-Binaphthyl-8,8'-dicarboxylic acid (delta mass: 324.1909 Da; putative annotation: N/A; putative formula: C18H28O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.287,"smiles":null,"spectrum_id":"CCMSLIB00017320616","spectrum_index":54076},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 6.0093 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.179,"smiles":null,"spectrum_id":"CCMSLIB00017320617","spectrum_index":54077},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 307.1728 Da; putative annotation: N/A; putative formula: C16H27N3O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.254,"smiles":null,"spectrum_id":"CCMSLIB00017320618","spectrum_index":54078},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 331.2095 Da; putative annotation: N/A; putative formula: C17H34NOPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.291,"smiles":null,"spectrum_id":"CCMSLIB00017320619","spectrum_index":54079},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 274.1516 Da; putative annotation: N/A; putative formula: C9H14N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.326,"smiles":null,"spectrum_id":"CCMSLIB00017320620","spectrum_index":54080},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 203.0717 Da; putative annotation: N/A; putative formula: C8H14NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.184,"smiles":null,"spectrum_id":"CCMSLIB00017320621","spectrum_index":54081},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 261.1119 Da; putative annotation: N/A; putative formula: C6H15N9OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":466.198,"smiles":null,"spectrum_id":"CCMSLIB00017320622","spectrum_index":54082},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Noradrenaline; AIF; CE10; MS2Dec (delta mass: 254.1155 Da; putative annotation: N/A; putative formula: C13H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.197,"smiles":null,"spectrum_id":"CCMSLIB00017320623","spectrum_index":54083},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 484.3242 Da; putative annotation: N/A; putative formula: C36H40N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":589.379,"smiles":null,"spectrum_id":"CCMSLIB00017320624","spectrum_index":54084},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Glu-His (delta mass: 184.0483 Da; putative annotation: N/A; putative formula: C7H8N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.168,"smiles":null,"spectrum_id":"CCMSLIB00017320625","spectrum_index":54085},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Heliotrine (delta mass: 72.0438 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":386.24,"smiles":null,"spectrum_id":"CCMSLIB00017320626","spectrum_index":54086},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyropheophorbide a (delta mass: 58.005 Da; putative annotation: N/A; putative formula: C2H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":593.275,"smiles":null,"spectrum_id":"CCMSLIB00017320627","spectrum_index":54087},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hordenine (delta mass: 270.1932 Da; putative annotation: N/A; putative formula: C16H31O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.316,"smiles":null,"spectrum_id":"CCMSLIB00017320628","spectrum_index":54088},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 140.1206 Da; putative annotation: N/A; putative formula: C9H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.221,"smiles":null,"spectrum_id":"CCMSLIB00017320629","spectrum_index":54089},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benz[a]anthracen-1-ol, 8-methoxy-3-methyl- (delta mass: 136.0583 Da; putative annotation: N/A; putative formula: C2H8N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":425.181,"smiles":null,"spectrum_id":"CCMSLIB00017320630","spectrum_index":54090},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-guanidinobutanamide (delta mass: 220.9843 Da; putative annotation: N/A; putative formula: C3H3N5O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.093,"smiles":null,"spectrum_id":"CCMSLIB00017320631","spectrum_index":54091},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 127.0416 Da; putative annotation: N/A; putative formula: C3H6N5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.159,"smiles":null,"spectrum_id":"CCMSLIB00017320632","spectrum_index":54092},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4-amino-3-indol-3-ylazoline-2,5-dione CollisionEnergy:102040\"\" (delta mass: 62.0001 Da; putative annotation: N/A; putative formula: CH2O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.077,"smiles":null,"spectrum_id":"CCMSLIB00017320633","spectrum_index":54093},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 102.0503 Da; putative annotation: N/A; putative formula: C5H10S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.138,"smiles":null,"spectrum_id":"CCMSLIB00017320634","spectrum_index":54094},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 54.0103 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.164,"smiles":null,"spectrum_id":"CCMSLIB00017320635","spectrum_index":54095},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 190.0995 Da; putative annotation: N/A; putative formula: C12H14O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.212,"smiles":null,"spectrum_id":"CCMSLIB00017320636","spectrum_index":54096},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 85.0493 Da; putative annotation: N/A; putative formula: H3N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":337.172,"smiles":null,"spectrum_id":"CCMSLIB00017320637","spectrum_index":54097},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 6.0131 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":200.131,"smiles":null,"spectrum_id":"CCMSLIB00017320638","spectrum_index":54098},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 68.0629 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.175,"smiles":null,"spectrum_id":"CCMSLIB00017320639","spectrum_index":54099},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 114.0283 Da; putative annotation: N/A; putative formula: CH2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.152,"smiles":null,"spectrum_id":"CCMSLIB00017320640","spectrum_index":54100},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 145.0887 Da; putative annotation: N/A; putative formula: C10H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.201,"smiles":null,"spectrum_id":"CCMSLIB00017320641","spectrum_index":54101},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 92.0613 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.153,"smiles":null,"spectrum_id":"CCMSLIB00017320642","spectrum_index":54102},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 68.042 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.144,"smiles":null,"spectrum_id":"CCMSLIB00017320643","spectrum_index":54103},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to 4-(2-Amino-1-hydroxyethyl)-2-methoxyphenol from NIST14 (delta mass: 154.0351 Da; putative annotation: N/A; putative formula: C2H2N8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.132,"smiles":null,"spectrum_id":"CCMSLIB00017320644","spectrum_index":54104},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 180.0405 Da; putative annotation: N/A; putative formula: C5H14N2O-1P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.09,"smiles":null,"spectrum_id":"CCMSLIB00017320645","spectrum_index":54105},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 463.2745 Da; putative annotation: N/A; putative formula: C28H38N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.35,"smiles":null,"spectrum_id":"CCMSLIB00017320646","spectrum_index":54106},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 64.0017 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.061,"smiles":null,"spectrum_id":"CCMSLIB00017320647","spectrum_index":54107},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[4-[Acetyl(hydroxy)amino]butylcarbamoyl]-5-[3-[acetyl(hydroxy)amino]propylamino]-3-hydroxy-5-oxopentanoic acid (delta mass: 377.2707 Da; putative annotation: N/A; putative formula: C18H39N3O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.479,"smiles":null,"spectrum_id":"CCMSLIB00017320648","spectrum_index":54108},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 147.0309 Da; putative annotation: N/A; putative formula: C8H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.133,"smiles":null,"spectrum_id":"CCMSLIB00017320649","spectrum_index":54109},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 363.1761 Da; putative annotation: N/A; putative formula: C14H29N5O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":582.31,"smiles":null,"spectrum_id":"CCMSLIB00017320650","spectrum_index":54110},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 206.2395 Da; putative annotation: N/A; putative formula: C16H30O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.341,"smiles":null,"spectrum_id":"CCMSLIB00017320651","spectrum_index":54111},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 105.0889 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":296.17,"smiles":null,"spectrum_id":"CCMSLIB00017320652","spectrum_index":54112},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005787 Indole-3-carboxylic acid|1H-indole-3-carboxylic acid (delta mass: 187.063 Da; putative annotation: N/A; putative formula: C11H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.118,"smiles":null,"spectrum_id":"CCMSLIB00017320653","spectrum_index":54113},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 96.0208 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.107,"smiles":null,"spectrum_id":"CCMSLIB00017320654","spectrum_index":54114},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 400.2394 Da; putative annotation: N/A; putative formula: C22H33N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.399,"smiles":null,"spectrum_id":"CCMSLIB00017320655","spectrum_index":54115},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 86.0009 Da; putative annotation: N/A; putative formula: C3H2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.103,"smiles":null,"spectrum_id":"CCMSLIB00017320656","spectrum_index":54116},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Difluoro-1H-indole-2-carboxylic acid (delta mass: 341.1359 Da; putative annotation: N/A; putative formula: C12H20N7O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.172,"smiles":null,"spectrum_id":"CCMSLIB00017320657","spectrum_index":54117},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 60.068 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":182.164,"smiles":null,"spectrum_id":"CCMSLIB00017320658","spectrum_index":54118},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-.beta.-Homomethionine (delta mass: 42.01 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.084,"smiles":null,"spectrum_id":"CCMSLIB00017320659","spectrum_index":54119},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 174.1469 Da; putative annotation: N/A; putative formula: C7H18N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.228,"smiles":null,"spectrum_id":"CCMSLIB00017320660","spectrum_index":54120},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-{2-[(2-Aminoethyl)amino]ethyl}piperazin-1-yl)ethan-1-amine (delta mass: 237.1018 Da; putative annotation: N/A; putative formula: C13H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.32,"smiles":null,"spectrum_id":"CCMSLIB00017320661","spectrum_index":54121},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 24.0765 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":236.168,"smiles":null,"spectrum_id":"CCMSLIB00017320662","spectrum_index":54122},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Glu (delta mass: 235.0732 Da; putative annotation: N/A; putative formula: C6H13N5O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":498.161,"smiles":null,"spectrum_id":"CCMSLIB00017320663","spectrum_index":54123},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GALACTOSAMINE - 20.0 eV (delta mass: 134.0367 Da; putative annotation: N/A; putative formula: C8H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.134,"smiles":null,"spectrum_id":"CCMSLIB00017320664","spectrum_index":54124},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-methoxy-6-methyl-6,7-dihydro-5h-dibenzo[c,e]azepin-2-ol (delta mass: 35.0627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.196,"smiles":null,"spectrum_id":"CCMSLIB00017320665","spectrum_index":54125},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 227.2348 Da; putative annotation: N/A; putative formula: C13H29N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":418.316,"smiles":null,"spectrum_id":"CCMSLIB00017320666","spectrum_index":54126},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 10-Chloro-1-decanol (delta mass: 48.0447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.18,"smiles":null,"spectrum_id":"CCMSLIB00017320667","spectrum_index":54127},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 255.2578 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.328,"smiles":null,"spectrum_id":"CCMSLIB00017320668","spectrum_index":54128},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 167.0796 Da; putative annotation: N/A; putative formula: C6H9N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017320669","spectrum_index":54129},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methylindole (delta mass: 185.1066 Da; putative annotation: N/A; putative formula: C10H11N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.187,"smiles":null,"spectrum_id":"CCMSLIB00017320670","spectrum_index":54130},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 309.3016 Da; putative annotation: N/A; putative formula: C16H35N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.377,"smiles":null,"spectrum_id":"CCMSLIB00017320671","spectrum_index":54131},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 258.0854 Da; putative annotation: N/A; putative formula: C10H14N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.172,"smiles":null,"spectrum_id":"CCMSLIB00017320672","spectrum_index":54132},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 136.0895 Da; putative annotation: N/A; putative formula: C9H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.181,"smiles":null,"spectrum_id":"CCMSLIB00017320673","spectrum_index":54133},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-METHYL PHENETHYLAMINE (delta mass: 29.977 Da; putative annotation: N/A; putative formula: H-2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.089,"smiles":null,"spectrum_id":"CCMSLIB00017320674","spectrum_index":54134},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA001077 Citrinin (delta mass: 70.0058 Da; putative annotation: N/A; putative formula: C3H2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.097,"smiles":null,"spectrum_id":"CCMSLIB00017320675","spectrum_index":54135},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Trp (delta mass: 101.0481 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.167,"smiles":null,"spectrum_id":"CCMSLIB00017320676","spectrum_index":54136},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 16.9902 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.076,"smiles":null,"spectrum_id":"CCMSLIB00017320677","spectrum_index":54137},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 43.0346 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.084,"smiles":null,"spectrum_id":"CCMSLIB00017320678","spectrum_index":54138},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 61.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.16,"smiles":null,"spectrum_id":"CCMSLIB00017320679","spectrum_index":54139},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(methylamino)hexane-1,2,3,4,5-pentaol (delta mass: 47.9739 Da; putative annotation: N/A; putative formula: HOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.092,"smiles":null,"spectrum_id":"CCMSLIB00017320680","spectrum_index":54140},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 97.0557 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.152,"smiles":null,"spectrum_id":"CCMSLIB00017320681","spectrum_index":54141},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 16.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":164.106,"smiles":null,"spectrum_id":"CCMSLIB00017320682","spectrum_index":54142},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 15.0249 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.085,"smiles":null,"spectrum_id":"CCMSLIB00017320683","spectrum_index":54143},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCURONOLACTONE (delta mass: 10.0724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.122,"smiles":null,"spectrum_id":"CCMSLIB00017320684","spectrum_index":54144},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 176.0865 Da; putative annotation: N/A; putative formula: C10H13N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.21,"smiles":null,"spectrum_id":"CCMSLIB00017320685","spectrum_index":54145},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 293.1419 Da; putative annotation: N/A; putative formula: C19H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.265,"smiles":null,"spectrum_id":"CCMSLIB00017320686","spectrum_index":54146},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 162.061 Da; putative annotation: N/A; putative formula: C9H10N2O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.121,"smiles":null,"spectrum_id":"CCMSLIB00017320687","spectrum_index":54147},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 15.0359 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.154,"smiles":null,"spectrum_id":"CCMSLIB00017320688","spectrum_index":54148},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 72.0364 Da; putative annotation: N/A; putative formula: C7H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.217,"smiles":null,"spectrum_id":"CCMSLIB00017320689","spectrum_index":54149},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 149.1406 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.243,"smiles":null,"spectrum_id":"CCMSLIB00017320690","spectrum_index":54150},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 367.2146 Da; putative annotation: N/A; putative formula: C23H29NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":710.338,"smiles":null,"spectrum_id":"CCMSLIB00017320691","spectrum_index":54151},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 197.1076 Da; putative annotation: N/A; putative formula: C9H16N3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.173,"smiles":null,"spectrum_id":"CCMSLIB00017320692","spectrum_index":54152},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 88.4352 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.5,"smiles":null,"spectrum_id":"CCMSLIB00017320693","spectrum_index":54153},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 183.0726 Da; putative annotation: N/A; putative formula: C2H5N11)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.18,"smiles":null,"spectrum_id":"CCMSLIB00017320694","spectrum_index":54154},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 53.0266 Da; putative annotation: N/A; putative formula: C3H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017320695","spectrum_index":54155},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 218.0946 Da; putative annotation: N/A; putative formula: C13H14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.155,"smiles":null,"spectrum_id":"CCMSLIB00017320696","spectrum_index":54156},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU227506 trans-3-Hydroxycotinine|Hydroxycotinine|(3R,5S)-3-hydroxy-1-methyl-5-pyridin-3-ylpyrrolidin-2-one (delta mass: 45.0102 Da; putative annotation: N/A; putative formula: CH4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017320697","spectrum_index":54157},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anhydrobrazilic Acid (delta mass: 54.0473 Da; putative annotation: N/A; putative formula: C4H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.107,"smiles":null,"spectrum_id":"CCMSLIB00017320698","spectrum_index":54158},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 228.1682 Da; putative annotation: N/A; putative formula: C9H20N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.247,"smiles":null,"spectrum_id":"CCMSLIB00017320699","spectrum_index":54159},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine (delta mass: 91.0491 Da; putative annotation: N/A; putative formula: H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.193,"smiles":null,"spectrum_id":"CCMSLIB00017320700","spectrum_index":54160},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 194.1098 Da; putative annotation: N/A; putative formula: C15H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.181,"smiles":null,"spectrum_id":"CCMSLIB00017320701","spectrum_index":54161},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile (delta mass: 70.0532 Da; putative annotation: N/A; putative formula: C3H6N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.182,"smiles":null,"spectrum_id":"CCMSLIB00017320702","spectrum_index":54162},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 355.148 Da; putative annotation: N/A; putative formula: C13H25NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":686.302,"smiles":null,"spectrum_id":"CCMSLIB00017320703","spectrum_index":54163},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 248.0347 Da; putative annotation: N/A; putative formula: C11H9N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.121,"smiles":null,"spectrum_id":"CCMSLIB00017320704","spectrum_index":54164},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Xylitol (delta mass: 65.0643 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.14,"smiles":null,"spectrum_id":"CCMSLIB00017320705","spectrum_index":54165},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 342.1174 Da; putative annotation: N/A; putative formula: C23H19OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.199,"smiles":null,"spectrum_id":"CCMSLIB00017320706","spectrum_index":54166},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin E (delta mass: 50.0515 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.242,"smiles":null,"spectrum_id":"CCMSLIB00017320707","spectrum_index":54167},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Keto-L-gulonic acid (delta mass: 74.0365 Da; putative annotation: N/A; putative formula: C3H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.086,"smiles":null,"spectrum_id":"CCMSLIB00017320708","spectrum_index":54168},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 308.0544 Da; putative annotation: N/A; putative formula: C15H8N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":639.208,"smiles":null,"spectrum_id":"CCMSLIB00017320709","spectrum_index":54169},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 99.0686 Da; putative annotation: N/A; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.176,"smiles":null,"spectrum_id":"CCMSLIB00017320710","spectrum_index":54170},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[2-(Dimethylamino)ethyl]-2-(phenylthio)acetamide (delta mass: 66.0087 Da; putative annotation: N/A; putative formula: H-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.13,"smiles":null,"spectrum_id":"CCMSLIB00017320711","spectrum_index":54171},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PYRROLE-2-CARBOXYLIC ACID CollisionEnergy:102040 (delta mass: 165.0907 Da; putative annotation: N/A; putative formula: C8H11N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.13,"smiles":null,"spectrum_id":"CCMSLIB00017320712","spectrum_index":54172},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucose 6-phosphate (delta mass: 497.1429 Da; putative annotation: N/A; putative formula: C26H28NO5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":758.18,"smiles":null,"spectrum_id":"CCMSLIB00017320713","spectrum_index":54173},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-7-methylquinoline-3-carbaldehyde (delta mass: 43.0662 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.137,"smiles":null,"spectrum_id":"CCMSLIB00017320714","spectrum_index":54174},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 45.9932 Da; putative annotation: N/A; putative formula: C3H-2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.096,"smiles":null,"spectrum_id":"CCMSLIB00017320715","spectrum_index":54175},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Gly-Leu (delta mass: 147.0688 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":449.276,"smiles":null,"spectrum_id":"CCMSLIB00017320716","spectrum_index":54176},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 269.0883 Da; putative annotation: N/A; putative formula: C9H15N7O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":453.185,"smiles":null,"spectrum_id":"CCMSLIB00017320717","spectrum_index":54177},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 32.9714 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.036,"smiles":null,"spectrum_id":"CCMSLIB00017320718","spectrum_index":54178},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6E)-Heptadeca-6,16-diene-1,2,4-triol (delta mass: 134.1103 Da; putative annotation: N/A; putative formula: C10H14)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.353,"smiles":null,"spectrum_id":"CCMSLIB00017320719","spectrum_index":54179},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 47.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":230.118,"smiles":null,"spectrum_id":"CCMSLIB00017320720","spectrum_index":54180},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 267.1114 Da; putative annotation: N/A; putative formula: C6H17N7O3S)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.177,"smiles":null,"spectrum_id":"CCMSLIB00017320721","spectrum_index":54181},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 65.0614 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.132,"smiles":null,"spectrum_id":"CCMSLIB00017320722","spectrum_index":54182},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methyl-3,4,6,10b-tetrahydro-2H-pyrano[3,2-c]isochromene-4a,7,9-triol (delta mass: 124.0517 Da; putative annotation: N/A; putative formula: C7H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.159,"smiles":null,"spectrum_id":"CCMSLIB00017320723","spectrum_index":54183},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Sorbitol (delta mass: 78.0623 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.149,"smiles":null,"spectrum_id":"CCMSLIB00017320724","spectrum_index":54184},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 81.0449 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":364.214,"smiles":null,"spectrum_id":"CCMSLIB00017320725","spectrum_index":54185},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactose (delta mass: 722.3875 Da; putative annotation: N/A; putative formula: C36H46N14O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1065.51,"smiles":null,"spectrum_id":"CCMSLIB00017320726","spectrum_index":54186},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 106.0826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.19,"smiles":null,"spectrum_id":"CCMSLIB00017320727","spectrum_index":54187},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ac-Asp-Glu (delta mass: 67.0784 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.176,"smiles":null,"spectrum_id":"CCMSLIB00017320728","spectrum_index":54188},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 32.057 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.105,"smiles":null,"spectrum_id":"CCMSLIB00017320729","spectrum_index":54189},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9H-Xanthene-4-acetic acid, 5,6-dimethyl-9-oxo- (delta mass: 224.138 Da; putative annotation: N/A; putative formula: C9H16N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.234,"smiles":null,"spectrum_id":"CCMSLIB00017320730","spectrum_index":54190},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE (delta mass: 144.1143 Da; putative annotation: N/A; putative formula: C8H16O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":292.19,"smiles":null,"spectrum_id":"CCMSLIB00017320731","spectrum_index":54191},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 461.4114 Da; putative annotation: N/A; putative formula: C32H51N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":776.57,"smiles":null,"spectrum_id":"CCMSLIB00017320732","spectrum_index":54192},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Trehalose from NIST14 (delta mass: 76.0672 Da; putative annotation: N/A; putative formula: C7H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.191,"smiles":null,"spectrum_id":"CCMSLIB00017320733","spectrum_index":54193},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[4-[Acetyl(hydroxy)amino]butylcarbamoyl]-5-[3-[acetyl(hydroxy)amino]propylamino]-3-hydroxy-5-oxopentanoic acid (delta mass: 43.9796 Da; putative annotation: N/A; putative formula: CHP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.188,"smiles":null,"spectrum_id":"CCMSLIB00017320734","spectrum_index":54194},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 495.7192 Da; putative annotation: N/A; putative formula: H16O-1P16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.816,"smiles":null,"spectrum_id":"CCMSLIB00017320735","spectrum_index":54195},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Flerobuterol (delta mass: 37.0401 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.185,"smiles":null,"spectrum_id":"CCMSLIB00017320736","spectrum_index":54196},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 198.0687 Da; putative annotation: N/A; putative formula: C6H10N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.223,"smiles":null,"spectrum_id":"CCMSLIB00017320737","spectrum_index":54197},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 102.031 Da; putative annotation: N/A; putative formula: C4H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.128,"smiles":null,"spectrum_id":"CCMSLIB00017320738","spectrum_index":54198},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Aminopyridine (delta mass: 81.0572 Da; putative annotation: N/A; putative formula: C5H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.118,"smiles":null,"spectrum_id":"CCMSLIB00017320739","spectrum_index":54199},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Curcumin (delta mass: 89.1345 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.268,"smiles":null,"spectrum_id":"CCMSLIB00017320740","spectrum_index":54200},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 185.1045 Da; putative annotation: N/A; putative formula: C9H15NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.196,"smiles":null,"spectrum_id":"CCMSLIB00017320741","spectrum_index":54201},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2,3-Dimethoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine (delta mass: 301.2105 Da; putative annotation: N/A; putative formula: C15H32N3O-1PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.391,"smiles":null,"spectrum_id":"CCMSLIB00017320742","spectrum_index":54202},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of glucitol-4-gucopyanoside (delta mass: 130.0784 Da; putative annotation: N/A; putative formula: C10H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.217,"smiles":null,"spectrum_id":"CCMSLIB00017320743","spectrum_index":54203},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of spermidine-C13:0 (delta mass: 70.0787 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":412.427,"smiles":null,"spectrum_id":"CCMSLIB00017320744","spectrum_index":54204},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-.alpha.-Cyclohexylglycine (delta mass: 82.0784 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.196,"smiles":null,"spectrum_id":"CCMSLIB00017320745","spectrum_index":54205},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,3-thiazole-4-carboxylic acid (delta mass: 68.1013 Da; putative annotation: N/A; putative formula: C6H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.113,"smiles":null,"spectrum_id":"CCMSLIB00017320746","spectrum_index":54206},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 114.0681 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.128,"smiles":null,"spectrum_id":"CCMSLIB00017320747","spectrum_index":54207},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005923 Tetrahydropapaveroline|1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 43.0311 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.154,"smiles":null,"spectrum_id":"CCMSLIB00017320748","spectrum_index":54208},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6H-Indolo[2,3-b]quinoline (delta mass: 62.0221 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.114,"smiles":null,"spectrum_id":"CCMSLIB00017320749","spectrum_index":54209},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Formoterol (delta mass: 54.0314 Da; putative annotation: N/A; putative formula: CH2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.212,"smiles":null,"spectrum_id":"CCMSLIB00017320750","spectrum_index":54210},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-ethylthiophenethylamine (delta mass: 113.033 Da; putative annotation: N/A; putative formula: C2H3N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.154,"smiles":null,"spectrum_id":"CCMSLIB00017320751","spectrum_index":54211},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-D-glucamine (delta mass: 165.0905 Da; putative annotation: N/A; putative formula: C8H11N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.208,"smiles":null,"spectrum_id":"CCMSLIB00017320752","spectrum_index":54212},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 92.0587 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.145,"smiles":null,"spectrum_id":"CCMSLIB00017320753","spectrum_index":54213},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(Butylamino)benzoic acid (delta mass: 44.0263 Da; putative annotation: N/A; putative formula: C2H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.144,"smiles":null,"spectrum_id":"CCMSLIB00017320754","spectrum_index":54214},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxy-1-(methylamino)-D-galactitol (delta mass: 111.0511 Da; putative annotation: N/A; putative formula: C6H9NO-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.169,"smiles":null,"spectrum_id":"CCMSLIB00017320755","spectrum_index":54215},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Fucose (delta mass: 206.1391 Da; putative annotation: N/A; putative formula: C8H14N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.215,"smiles":null,"spectrum_id":"CCMSLIB00017320756","spectrum_index":54216},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Xylulose (delta mass: 91.0629 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.123,"smiles":null,"spectrum_id":"CCMSLIB00017320757","spectrum_index":54217},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 99.0679 Da; putative annotation: Isovaline; putative formula: C5H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.17,"smiles":null,"spectrum_id":"CCMSLIB00017320758","spectrum_index":54218},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,6-ANHYDRO-B-GLUCOSE\"\" (delta mass: 332.2345 Da; putative annotation: 5-(5-Methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid; putative formula: C21H32O3)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.295,"smiles":null,"spectrum_id":"CCMSLIB00017320759","spectrum_index":54219},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole (delta mass: 175.064 Da; putative annotation: Phenaceturic acid; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.129,"smiles":null,"spectrum_id":"CCMSLIB00017320760","spectrum_index":54220},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 168.0896 Da; putative annotation: Pro-Ala; putative formula: C8H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":349.16,"smiles":null,"spectrum_id":"CCMSLIB00017320761","spectrum_index":54221},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 340.2469 Da; putative annotation: Ile-Val-Lys; putative formula: C17H32N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.318,"smiles":null,"spectrum_id":"CCMSLIB00017320762","spectrum_index":54222},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 229.0929 Da; putative annotation: Linamarin; putative formula: C10H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.164,"smiles":null,"spectrum_id":"CCMSLIB00017320763","spectrum_index":54223},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00169588-02!(3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 166.0636 Da; putative annotation: Vanylglycol; putative formula: C9H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.15,"smiles":null,"spectrum_id":"CCMSLIB00017320764","spectrum_index":54224},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 338.2094 Da; putative annotation: (2E,4E)-12-Hydroxy-13-(hydroxymethyl)-14-methoxy-3,5,7-trimethyl-14-oxotetradeca-2,4-dienoic acid; putative formula: C19H30O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.27,"smiles":null,"spectrum_id":"CCMSLIB00017320765","spectrum_index":54225},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin F (delta mass: 164.1196 Da; putative annotation: 10-Undecynoic acid; putative formula: C11H16O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":595.399,"smiles":null,"spectrum_id":"CCMSLIB00017320766","spectrum_index":54226},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 203.1316 Da; putative annotation: 7-(2-Aminophenyl)heptanoic acid; putative formula: C13H17NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":384.202,"smiles":null,"spectrum_id":"CCMSLIB00017320767","spectrum_index":54227},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 311.1667 Da; putative annotation: N/A; putative formula: C15H25N3O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":656.336,"smiles":null,"spectrum_id":"CCMSLIB00017320768","spectrum_index":54228},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Glucurono-.gamma.-lactone (delta mass: 100.0673 Da; putative annotation: N/A; putative formula: C9H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.107,"smiles":null,"spectrum_id":"CCMSLIB00017320769","spectrum_index":54229},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU101904 1-(2-Hydroxyethyl)pyrrolidin-2-one (delta mass: 55.9899 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.076,"smiles":null,"spectrum_id":"CCMSLIB00017320770","spectrum_index":54230},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 152.0681 Da; putative annotation: N/A; putative formula: C2H4N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":497.201,"smiles":null,"spectrum_id":"CCMSLIB00017320771","spectrum_index":54231},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 131.0949 Da; putative annotation: N/A; putative formula: C6H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":414.203,"smiles":null,"spectrum_id":"CCMSLIB00017320772","spectrum_index":54232},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 110.0523 Da; putative annotation: N/A; putative formula: C10H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.139,"smiles":null,"spectrum_id":"CCMSLIB00017320773","spectrum_index":54233},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 63.0323 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.197,"smiles":null,"spectrum_id":"CCMSLIB00017320774","spectrum_index":54234},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2.alpha.-Mannobiose (delta mass: 138.0827 Da; putative annotation: N/A; putative formula: C12H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.206,"smiles":null,"spectrum_id":"CCMSLIB00017320775","spectrum_index":54235},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-Indol-4-amine (delta mass: 45.0299 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.096,"smiles":null,"spectrum_id":"CCMSLIB00017320776","spectrum_index":54236},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Normetanephrine (delta mass: 98.0367 Da; putative annotation: N/A; putative formula: C5H6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.134,"smiles":null,"spectrum_id":"CCMSLIB00017320777","spectrum_index":54237},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 164.1416 Da; putative annotation: N/A; putative formula: C9H16N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.264,"smiles":null,"spectrum_id":"CCMSLIB00017320778","spectrum_index":54238},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 16-Heptadecyn-4-one, 1,2-dihydroxy- (delta mass: 38.0155 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.242,"smiles":null,"spectrum_id":"CCMSLIB00017320779","spectrum_index":54239},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 60.047 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.17,"smiles":null,"spectrum_id":"CCMSLIB00017320780","spectrum_index":54240},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-[8-(2-Hydroxypropan-2-yl)-3-methoxycarbonyl-3,4a,7,10a-tetramethyl-5-methylidene-1,4-dioxo-6,6a,8,9,10,10b-hexahydrobenzo[h]isochromen-7-yl]propanoic acid (delta mass: 80.0222 Da; putative annotation: N/A; putative formula: CN6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":559.286,"smiles":null,"spectrum_id":"CCMSLIB00017320781","spectrum_index":54241},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU229901 N-Butylbenzenesulfonamide|N-butylbenzenesulfonamide (delta mass: 76.813 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.903,"smiles":null,"spectrum_id":"CCMSLIB00017320782","spectrum_index":54242},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylethylamine (delta mass: 255.256 Da; putative annotation: N/A; putative formula: C16H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.352,"smiles":null,"spectrum_id":"CCMSLIB00017320783","spectrum_index":54243},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Glucosamine (delta mass: 93.0812 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.168,"smiles":null,"spectrum_id":"CCMSLIB00017320784","spectrum_index":54244},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 52.068 Da; putative annotation: N/A; putative formula: C5H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.112,"smiles":null,"spectrum_id":"CCMSLIB00017320785","spectrum_index":54245},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 405.1428 Da; putative annotation: N/A; putative formula: C23H24N3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.219,"smiles":null,"spectrum_id":"CCMSLIB00017320786","spectrum_index":54246},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 17.9383 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.108,"smiles":null,"spectrum_id":"CCMSLIB00017320787","spectrum_index":54247},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 341.2205 Da; putative annotation: N/A; putative formula: C18H31NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.301,"smiles":null,"spectrum_id":"CCMSLIB00017320788","spectrum_index":54248},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethyl 5-chloro-3-phenyl-1H-indole-2-carboxylate (delta mass: 46.0498 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.128,"smiles":null,"spectrum_id":"CCMSLIB00017320789","spectrum_index":54249},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1,3-dimethyl-1H-indole-2-carboxylic acid (delta mass: 36.0203 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.097,"smiles":null,"spectrum_id":"CCMSLIB00017320790","spectrum_index":54250},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014501 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 796.2735 Da; putative annotation: N/A; putative formula: C37H52N2O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1018.37,"smiles":null,"spectrum_id":"CCMSLIB00017320791","spectrum_index":54251},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 71.0732 Da; putative annotation: N/A; putative formula: C4H9N)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.138,"smiles":null,"spectrum_id":"CCMSLIB00017320792","spectrum_index":54252},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 180.0928 Da; putative annotation: N/A; putative formula: C8H13N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.168,"smiles":null,"spectrum_id":"CCMSLIB00017320793","spectrum_index":54253},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 130.1101 Da; putative annotation: N/A; putative formula: C6H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.212,"smiles":null,"spectrum_id":"CCMSLIB00017320794","spectrum_index":54254},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 140.0659 Da; putative annotation: N/A; putative formula: C8H12S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.13,"smiles":null,"spectrum_id":"CCMSLIB00017320795","spectrum_index":54255},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 125.0878 Da; putative annotation: N/A; putative formula: C7H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.247,"smiles":null,"spectrum_id":"CCMSLIB00017320796","spectrum_index":54256},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 145.0741 Da; putative annotation: N/A; putative formula: C6H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.171,"smiles":null,"spectrum_id":"CCMSLIB00017320797","spectrum_index":54257},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:BML00350 (1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol (delta mass: 17.0438 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.24,"smiles":null,"spectrum_id":"CCMSLIB00017320798","spectrum_index":54258},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 88.0313 Da; putative annotation: N/A; putative formula: C7H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":269.102,"smiles":null,"spectrum_id":"CCMSLIB00017320799","spectrum_index":54259},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol (delta mass: 542.2788 Da; putative annotation: N/A; putative formula: C26H38N8O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.37,"smiles":null,"spectrum_id":"CCMSLIB00017320800","spectrum_index":54260},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 161.0472 Da; putative annotation: N/A; putative formula: C9H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.118,"smiles":null,"spectrum_id":"CCMSLIB00017320801","spectrum_index":54261},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 15.9958 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.082,"smiles":null,"spectrum_id":"CCMSLIB00017320802","spectrum_index":54262},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Nitro-1,2,3,4-tetrahydroquinoline (delta mass: 159.0893 Da; putative annotation: N/A; putative formula: C7H13NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.171,"smiles":null,"spectrum_id":"CCMSLIB00017320803","spectrum_index":54263},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 229.188 Da; putative annotation: N/A; putative formula: C13H27NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.248,"smiles":null,"spectrum_id":"CCMSLIB00017320804","spectrum_index":54264},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 314.1921 Da; putative annotation: N/A; putative formula: C17H30O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.278,"smiles":null,"spectrum_id":"CCMSLIB00017320805","spectrum_index":54265},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU228201 10,11-Dihydro-10-Hydroxycarbazepine|Licarbazepine|5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide (delta mass: 147.1146 Da; putative annotation: N/A; putative formula: C9H13N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.227,"smiles":null,"spectrum_id":"CCMSLIB00017320806","spectrum_index":54266},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 537.1319 Da; putative annotation: N/A; putative formula: C25H23N5O7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":759.229,"smiles":null,"spectrum_id":"CCMSLIB00017320807","spectrum_index":54267},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Andrastin D (delta mass: 124.087 Da; putative annotation: N/A; putative formula: C8H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.351,"smiles":null,"spectrum_id":"CCMSLIB00017320808","spectrum_index":54268},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 360.2147 Da; putative annotation: N/A; putative formula: C18H32O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":507.28,"smiles":null,"spectrum_id":"CCMSLIB00017320809","spectrum_index":54269},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 340.0589 Da; putative annotation: N/A; putative formula: C18H12O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.135,"smiles":null,"spectrum_id":"CCMSLIB00017320810","spectrum_index":54270},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxynaphthaleneacetic acid (delta mass: 25.9792 Da; putative annotation: N/A; putative formula: CH-2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.065,"smiles":null,"spectrum_id":"CCMSLIB00017320811","spectrum_index":54271},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 148.105 Da; putative annotation: N/A; putative formula: C3H12N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.212,"smiles":null,"spectrum_id":"CCMSLIB00017320812","spectrum_index":54272},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 294.145 Da; putative annotation: N/A; putative formula: C13H14N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.221,"smiles":null,"spectrum_id":"CCMSLIB00017320813","spectrum_index":54273},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 41.0266 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":162.076,"smiles":null,"spectrum_id":"CCMSLIB00017320814","spectrum_index":54274},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Amino-1-methyl-2-piperidinone (delta mass: 123.036 Da; putative annotation: N/A; putative formula: C5H6N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":252.138,"smiles":null,"spectrum_id":"CCMSLIB00017320815","spectrum_index":54275},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of O-Methyltyramine (delta mass: 129.0413 Da; putative annotation: N/A; putative formula: C5H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.148,"smiles":null,"spectrum_id":"CCMSLIB00017320816","spectrum_index":54276},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 10.0528 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.128,"smiles":null,"spectrum_id":"CCMSLIB00017320817","spectrum_index":54277},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 296.1632 Da; putative annotation: N/A; putative formula: C17H28S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.223,"smiles":null,"spectrum_id":"CCMSLIB00017320818","spectrum_index":54278},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 465.1469 Da; putative annotation: N/A; putative formula: C22H29NO6P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":628.207,"smiles":null,"spectrum_id":"CCMSLIB00017320819","spectrum_index":54279},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB006102 Tyramine|4-(2-aminoethyl)phenol (delta mass: 230.0229 Da; putative annotation: N/A; putative formula: C13H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.114,"smiles":null,"spectrum_id":"CCMSLIB00017320820","spectrum_index":54280},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of PHENYLETHANOLAMINE (delta mass: 205.2727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.364,"smiles":null,"spectrum_id":"CCMSLIB00017320821","spectrum_index":54281},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dichlorokynurenic acid (delta mass: 134.0693 Da; putative annotation: N/A; putative formula: C4H10N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":392.041,"smiles":null,"spectrum_id":"CCMSLIB00017320822","spectrum_index":54282},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 207.1089 Da; putative annotation: N/A; putative formula: C5H9N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.152,"smiles":null,"spectrum_id":"CCMSLIB00017320823","spectrum_index":54283},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,6-Difluoro-1H-indole-3-acetic acid (delta mass: 341.136 Da; putative annotation: N/A; putative formula: C12H20N7O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.188,"smiles":null,"spectrum_id":"CCMSLIB00017320824","spectrum_index":54284},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 694.2515 Da; putative annotation: N/A; putative formula: C31H50O11S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1037.38,"smiles":null,"spectrum_id":"CCMSLIB00017320825","spectrum_index":54285},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 78.0927 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.236,"smiles":null,"spectrum_id":"CCMSLIB00017320826","spectrum_index":54286},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 119.0684 Da; putative annotation: N/A; putative formula: C3H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":280.128,"smiles":null,"spectrum_id":"CCMSLIB00017320827","spectrum_index":54287},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285114 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 330.0359 Da; putative annotation: N/A; putative formula: C13H10N6OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":570.195,"smiles":null,"spectrum_id":"CCMSLIB00017320828","spectrum_index":54288},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(3-Pyridinyl)-1H-indole-3-carbaldehyde (delta mass: 22.9304 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.017,"smiles":null,"spectrum_id":"CCMSLIB00017320829","spectrum_index":54289},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 230.0427 Da; putative annotation: N/A; putative formula: C9H10O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.108,"smiles":null,"spectrum_id":"CCMSLIB00017320830","spectrum_index":54290},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 66.0371 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.144,"smiles":null,"spectrum_id":"CCMSLIB00017320831","spectrum_index":54291},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrexidine (delta mass: 18.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.201,"smiles":null,"spectrum_id":"CCMSLIB00017320832","spectrum_index":54292},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 582.3601 Da; putative annotation: N/A; putative formula: C25H46N10O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":865.529,"smiles":null,"spectrum_id":"CCMSLIB00017320833","spectrum_index":54293},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Aminoethyl)-4-chlorobenzamide (delta mass: 147.212 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.275,"smiles":null,"spectrum_id":"CCMSLIB00017320834","spectrum_index":54294},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dulcitol (delta mass: 296.2048 Da; putative annotation: N/A; putative formula: C21H29O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.291,"smiles":null,"spectrum_id":"CCMSLIB00017320835","spectrum_index":54295},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 244.2194 Da; putative annotation: N/A; putative formula: C18H28)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.332,"smiles":null,"spectrum_id":"CCMSLIB00017320836","spectrum_index":54296},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 99.0323 Da; putative annotation: N/A; putative formula: C4H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.092,"smiles":null,"spectrum_id":"CCMSLIB00017320837","spectrum_index":54297},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Dihydrocyclopenta[b]indol-3(2H)-one (delta mass: 96.0578 Da; putative annotation: N/A; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.134,"smiles":null,"spectrum_id":"CCMSLIB00017320838","spectrum_index":54298},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Azabicyclo[3.2.1]octan-3-ol (delta mass: 38.0454 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":166.152,"smiles":null,"spectrum_id":"CCMSLIB00017320839","spectrum_index":54299},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1134.3679 Da; putative annotation: N/A; putative formula: C81H46N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1477.49,"smiles":null,"spectrum_id":"CCMSLIB00017320840","spectrum_index":54300},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmaline (delta mass: 255.1204 Da; putative annotation: N/A; putative formula: C13H22NPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.238,"smiles":null,"spectrum_id":"CCMSLIB00017320841","spectrum_index":54301},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"MLS001048999-01!1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole\"\" (delta mass: 42.0474 Da; putative annotation: N/A; putative formula: C3H6)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.155,"smiles":null,"spectrum_id":"CCMSLIB00017320842","spectrum_index":54302},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 633.2488 Da; putative annotation: N/A; putative formula: C38H31N7O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":814.32,"smiles":null,"spectrum_id":"CCMSLIB00017320843","spectrum_index":54303},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methoxy-2,2-dimethyl-4-chromanol (delta mass: 220.258 Da; putative annotation: N/A; putative formula: C17H32O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":429.375,"smiles":null,"spectrum_id":"CCMSLIB00017320844","spectrum_index":54304},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 68.0104 Da; putative annotation: N/A; putative formula: CN4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.169,"smiles":null,"spectrum_id":"CCMSLIB00017320845","spectrum_index":54305},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 78.0619 Da; putative annotation: N/A; putative formula: C5H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.185,"smiles":null,"spectrum_id":"CCMSLIB00017320846","spectrum_index":54306},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 61.0083 Da; putative annotation: N/A; putative formula: CH4NP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.084,"smiles":null,"spectrum_id":"CCMSLIB00017320847","spectrum_index":54307},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 68.0472 Da; putative annotation: N/A; putative formula: C2H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":407.17,"smiles":null,"spectrum_id":"CCMSLIB00017320848","spectrum_index":54308},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3Z,5E)-4-hydroxy-6-(4-hydroxyphenyl)hexa-3,5-dien-2-one (delta mass: 62.0174 Da; putative annotation: N/A; putative formula: C5H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.103,"smiles":null,"spectrum_id":"CCMSLIB00017320849","spectrum_index":54309},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of phenylethanolamine - 40.0 eV (delta mass: 265.1027 Da; putative annotation: N/A; putative formula: C7H15N5O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.194,"smiles":null,"spectrum_id":"CCMSLIB00017320850","spectrum_index":54310},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 69.0172 Da; putative annotation: N/A; putative formula: C3H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.171,"smiles":null,"spectrum_id":"CCMSLIB00017320851","spectrum_index":54311},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannitol (delta mass: 111.0696 Da; putative annotation: N/A; putative formula: C6H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":294.156,"smiles":null,"spectrum_id":"CCMSLIB00017320852","spectrum_index":54312},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Val from NIST14 (delta mass: 115.0274 Da; putative annotation: N/A; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.166,"smiles":null,"spectrum_id":"CCMSLIB00017320853","spectrum_index":54313},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R)-quinolin-4-yl(5-vinylquinuclidin-2-yl)methanol (delta mass: 18.0204 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.201,"smiles":null,"spectrum_id":"CCMSLIB00017320854","spectrum_index":54314},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004501 3-hydroxybenzo(a)pyrene|benzo[a]pyren-3-ol (delta mass: 114.0692 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":383.165,"smiles":null,"spectrum_id":"CCMSLIB00017320855","spectrum_index":54315},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 273.1162 Da; putative annotation: N/A; putative formula: C12H15N7O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.166,"smiles":null,"spectrum_id":"CCMSLIB00017320856","spectrum_index":54316},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 326.2096 Da; putative annotation: N/A; putative formula: C18H30O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":671.343,"smiles":null,"spectrum_id":"CCMSLIB00017320857","spectrum_index":54317},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 143.1892 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.348,"smiles":null,"spectrum_id":"CCMSLIB00017320858","spectrum_index":54318},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of TRYPTAMINE (delta mass: 392.2765 Da; putative annotation: N/A; putative formula: C24H42P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":553.384,"smiles":null,"spectrum_id":"CCMSLIB00017320859","spectrum_index":54319},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 40.0885 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.248,"smiles":null,"spectrum_id":"CCMSLIB00017320860","spectrum_index":54320},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-5-methyl-3-[2-oxo-2-(2-pyridinyl)ethyl]-1,3-dihydro-2H-indol-2-one (delta mass: 102.038 Da; putative annotation: N/A; putative formula: C2H6N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.146,"smiles":null,"spectrum_id":"CCMSLIB00017320861","spectrum_index":54321},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asn-Val (delta mass: 113.084 Da; putative annotation: N/A; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.213,"smiles":null,"spectrum_id":"CCMSLIB00017320862","spectrum_index":54322},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lotusine (delta mass: 132.0841 Da; putative annotation: N/A; putative formula: C4H12N4O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.259,"smiles":null,"spectrum_id":"CCMSLIB00017320863","spectrum_index":54323},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 120.0208 Da; putative annotation: N/A; putative formula: C7H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.091,"smiles":null,"spectrum_id":"CCMSLIB00017320864","spectrum_index":54324},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 70.0782 Da; putative annotation: N/A; putative formula: C5H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.315,"smiles":null,"spectrum_id":"CCMSLIB00017320865","spectrum_index":54325},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 240.1269 Da; putative annotation: N/A; putative formula: C15H16N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.255,"smiles":null,"spectrum_id":"CCMSLIB00017320866","spectrum_index":54326},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isopycnarrhine (delta mass: 27.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.119,"smiles":null,"spectrum_id":"CCMSLIB00017320867","spectrum_index":54327},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-cyclopropylacetic acid (delta mass: 99.0643 Da; putative annotation: N/A; putative formula: CH5N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.135,"smiles":null,"spectrum_id":"CCMSLIB00017320868","spectrum_index":54328},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-FORMYL-METHIONINE (delta mass: 101.0488 Da; putative annotation: N/A; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.102,"smiles":null,"spectrum_id":"CCMSLIB00017320869","spectrum_index":54329},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 467.3253 Da; putative annotation: N/A; putative formula: C26H45NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":630.385,"smiles":null,"spectrum_id":"CCMSLIB00017320870","spectrum_index":54330},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 78.0473 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.222,"smiles":null,"spectrum_id":"CCMSLIB00017320871","spectrum_index":54331},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 184.1247 Da; putative annotation: N/A; putative formula: C9H16N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017320872","spectrum_index":54332},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 42.0213 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.108,"smiles":null,"spectrum_id":"CCMSLIB00017320873","spectrum_index":54333},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 93.988 Da; putative annotation: N/A; putative formula: C5H2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":274.075,"smiles":null,"spectrum_id":"CCMSLIB00017320874","spectrum_index":54334},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Cys (delta mass: 117.0581 Da; putative annotation: N/A; putative formula: C8H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":354.112,"smiles":null,"spectrum_id":"CCMSLIB00017320875","spectrum_index":54335},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N,N-Bis(2-hydroxyethyl)glycine (delta mass: 175.0637 Da; putative annotation: N/A; putative formula: C10H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.155,"smiles":null,"spectrum_id":"CCMSLIB00017320876","spectrum_index":54336},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltotetraose (delta mass: 809.2781 Da; putative annotation: N/A; putative formula: C48H47N3O3S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1476.51,"smiles":null,"spectrum_id":"CCMSLIB00017320877","spectrum_index":54337},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 23.016 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.118,"smiles":null,"spectrum_id":"CCMSLIB00017320878","spectrum_index":54338},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C5:0 (delta mass: 84.9448 Da; putative annotation: N/A; putative formula: C2H-1NO-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.11,"smiles":null,"spectrum_id":"CCMSLIB00017320879","spectrum_index":54339},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 97.0557 Da; putative annotation: N/A; putative formula: C5H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.153,"smiles":null,"spectrum_id":"CCMSLIB00017320880","spectrum_index":54340},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 14.0727 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":218.138,"smiles":null,"spectrum_id":"CCMSLIB00017320881","spectrum_index":54341},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-4-(4-thiomorpholinyl)aniline (delta mass: 59.0485 Da; putative annotation: N/A; putative formula: CH5N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.134,"smiles":null,"spectrum_id":"CCMSLIB00017320882","spectrum_index":54342},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-BUTYRIC ACID (delta mass: 446.3512 Da; putative annotation: N/A; putative formula: C27H46N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.453,"smiles":null,"spectrum_id":"CCMSLIB00017320883","spectrum_index":54343},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1H-Benzimidazol-2-ylsulfanyl)ethanol (delta mass: 13.024 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.083,"smiles":null,"spectrum_id":"CCMSLIB00017320884","spectrum_index":54344},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 16.917 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.086,"smiles":null,"spectrum_id":"CCMSLIB00017320885","spectrum_index":54345},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of synephrine (delta mass: 58.0764 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":226.178,"smiles":null,"spectrum_id":"CCMSLIB00017320886","spectrum_index":54346},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 38.0157 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.102,"smiles":null,"spectrum_id":"CCMSLIB00017320887","spectrum_index":54347},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 152.0559 Da; putative annotation: N/A; putative formula: C3H4N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":369.12,"smiles":null,"spectrum_id":"CCMSLIB00017320888","spectrum_index":54348},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 164.0354 Da; putative annotation: N/A; putative formula: C4H9N2O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.096,"smiles":null,"spectrum_id":"CCMSLIB00017320889","spectrum_index":54349},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 260.0719 Da; putative annotation: N/A; putative formula: C12H12N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":603.195,"smiles":null,"spectrum_id":"CCMSLIB00017320890","spectrum_index":54350},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 95.5829 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.685,"smiles":null,"spectrum_id":"CCMSLIB00017320891","spectrum_index":54351},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 108.0246 Da; putative annotation: N/A; putative formula: C5H5N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.105,"smiles":null,"spectrum_id":"CCMSLIB00017320892","spectrum_index":54352},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 259.1708 Da; putative annotation: N/A; putative formula: C13H26NO2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.297,"smiles":null,"spectrum_id":"CCMSLIB00017320893","spectrum_index":54353},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 130.0764 Da; putative annotation: N/A; putative formula: C4H11N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.252,"smiles":null,"spectrum_id":"CCMSLIB00017320894","spectrum_index":54354},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 93.0542 Da; putative annotation: N/A; putative formula: C6H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":436.178,"smiles":null,"spectrum_id":"CCMSLIB00017320895","spectrum_index":54355},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 286.137 Da; putative annotation: N/A; putative formula: C14H18N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":670.287,"smiles":null,"spectrum_id":"CCMSLIB00017320896","spectrum_index":54356},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gln-Leu (delta mass: 224.1154 Da; putative annotation: N/A; putative formula: C11H16N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.276,"smiles":null,"spectrum_id":"CCMSLIB00017320897","spectrum_index":54357},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-oxo-1h-indole-3-propanoic acid (delta mass: 161.0412 Da; putative annotation: N/A; putative formula: C8H7N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":365.107,"smiles":null,"spectrum_id":"CCMSLIB00017320898","spectrum_index":54358},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-[3-(trifluoromethyl)phenyl]ethanol (delta mass: 31.0445 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.123,"smiles":null,"spectrum_id":"CCMSLIB00017320899","spectrum_index":54359},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Metanephrine (delta mass: 248.2526 Da; putative annotation: N/A; putative formula: C18H32)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":446.365,"smiles":null,"spectrum_id":"CCMSLIB00017320900","spectrum_index":54360},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 307.1638 Da; putative annotation: N/A; putative formula: C14H29NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.224,"smiles":null,"spectrum_id":"CCMSLIB00017320901","spectrum_index":54361},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 350.2608 Da; putative annotation: N/A; putative formula: C25H34O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.326,"smiles":null,"spectrum_id":"CCMSLIB00017320902","spectrum_index":54362},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 568.3756 Da; putative annotation: N/A; putative formula: C29H53N4O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":733.451,"smiles":null,"spectrum_id":"CCMSLIB00017320903","spectrum_index":54363},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 58.0625 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":387.201,"smiles":null,"spectrum_id":"CCMSLIB00017320904","spectrum_index":54364},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AC000433 Citrinin|Antimycin|(3R,4S)-6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid (delta mass: 207.0738 Da; putative annotation: N/A; putative formula: C7H13NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.165,"smiles":null,"spectrum_id":"CCMSLIB00017320905","spectrum_index":54365},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Desglymidodrine (delta mass: 745.4675 Da; putative annotation: N/A; putative formula: C45H67N3O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":943.58,"smiles":null,"spectrum_id":"CCMSLIB00017320906","spectrum_index":54366},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,8-Dihydroxy-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-6-carboxylic acid (delta mass: 43.9953 Da; putative annotation: N/A; putative formula: HN2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.05,"smiles":null,"spectrum_id":"CCMSLIB00017320907","spectrum_index":54367},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 46.5555 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.642,"smiles":null,"spectrum_id":"CCMSLIB00017320908","spectrum_index":54368},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLMURAMIC ACID (delta mass: 16.7949 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":310.913,"smiles":null,"spectrum_id":"CCMSLIB00017320909","spectrum_index":54369},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(Carboxymethyl)-1-.beta.-D-glucopyranosyl-1H-indole (delta mass: 162.0532 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":500.177,"smiles":null,"spectrum_id":"CCMSLIB00017320910","spectrum_index":54370},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Visamminol (delta mass: 195.0745 Da; putative annotation: N/A; putative formula: C6H13NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.182,"smiles":null,"spectrum_id":"CCMSLIB00017320911","spectrum_index":54371},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-2-naphthol (delta mass: 328.308 Da; putative annotation: N/A; putative formula: C19H40N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":488.384,"smiles":null,"spectrum_id":"CCMSLIB00017320912","spectrum_index":54372},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 150.0787 Da; putative annotation: 5-Butyl-1H-pyrazole-3-carboxylic acid; putative formula: C8H10N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.144,"smiles":null,"spectrum_id":"CCMSLIB00017320913","spectrum_index":54373},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 118.0413 Da; putative annotation: PHENYLACETIC ACID; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.153,"smiles":null,"spectrum_id":"CCMSLIB00017320914","spectrum_index":54374},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-7-hydroxy-8-(2-hydroxyethyl)-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 148.0516 Da; putative annotation: 3-(2-Hydroxyphenyl)propionic acid; putative formula: C9H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.159,"smiles":null,"spectrum_id":"CCMSLIB00017320915","spectrum_index":54375},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 107.0035 Da; putative annotation: Taurine; putative formula: C2H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":288.074,"smiles":null,"spectrum_id":"CCMSLIB00017320916","spectrum_index":54376},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pro-Ile (delta mass: 244.1224 Da; putative annotation: Ile-Met; putative formula: C11H20N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":473.277,"smiles":null,"spectrum_id":"CCMSLIB00017320917","spectrum_index":54377},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 894.4981 Da; putative annotation: NCGC00381308-01_C47H76O17_(3beta,5xi,9xi,18xi,22beta)-22,25-Dihydroxyolean-12-en-3-yl 6-deoxy-alpha-L-mannopyranosyl-(1->2)-beta-D-xylopyranosyl-(1->2)-beta-D-glucopyranosiduronic acid; putative formula: C47H74O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1047.57,"smiles":null,"spectrum_id":"CCMSLIB00017320918","spectrum_index":54378},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 268.1098 Da; putative annotation: Phenol, 5-[(1Z)-2-(3,5-dimethoxyphenyl)ethenyl]-2-methoxy-; putative formula: C17H16O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.185,"smiles":null,"spectrum_id":"CCMSLIB00017320919","spectrum_index":54379},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylmethylamino)ethanol N-oxide (delta mass: 68.0612 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.179,"smiles":null,"spectrum_id":"CCMSLIB00017320920","spectrum_index":54380},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of hirsutanone (delta mass: 152.0316 Da; putative annotation: N/A; putative formula: C4H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":481.17,"smiles":null,"spectrum_id":"CCMSLIB00017320921","spectrum_index":54381},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of beta-Lactose - 40.0 eV (delta mass: 247.9842 Da; putative annotation: N/A; putative formula: C7H9N2O2PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.108,"smiles":null,"spectrum_id":"CCMSLIB00017320922","spectrum_index":54382},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(4-Phenoxyphenyl)-2-pyrazinecarboxamide (delta mass: 227.0774 Da; putative annotation: N/A; putative formula: C14H13NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.185,"smiles":null,"spectrum_id":"CCMSLIB00017320923","spectrum_index":54383},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Chloroacetyl)pyrrole (delta mass: 59.0321 Da; putative annotation: N/A; putative formula: C2H6NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.053,"smiles":null,"spectrum_id":"CCMSLIB00017320924","spectrum_index":54384},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dimethylquinolin-8-ol (delta mass: 116.0584 Da; putative annotation: N/A; putative formula: C4H8N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.15,"smiles":null,"spectrum_id":"CCMSLIB00017320925","spectrum_index":54385},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxydopamine (delta mass: 254.1158 Da; putative annotation: N/A; putative formula: C6H18N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":424.197,"smiles":null,"spectrum_id":"CCMSLIB00017320926","spectrum_index":54386},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2-naphthol (delta mass: 114.8696 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":273.95,"smiles":null,"spectrum_id":"CCMSLIB00017320927","spectrum_index":54387},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 881.5198 Da; putative annotation: N/A; putative formula: C37H67N15O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1212.67,"smiles":null,"spectrum_id":"CCMSLIB00017320928","spectrum_index":54388},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Betonicine; AIF; CE30; MS2Dec (delta mass: 50.0138 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.111,"smiles":null,"spectrum_id":"CCMSLIB00017320929","spectrum_index":54389},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corynoline (delta mass: 32.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":400.166,"smiles":null,"spectrum_id":"CCMSLIB00017320930","spectrum_index":54390},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 57.0107 Da; putative annotation: N/A; putative formula: C2H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.118,"smiles":null,"spectrum_id":"CCMSLIB00017320931","spectrum_index":54391},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 158.1595 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.219,"smiles":null,"spectrum_id":"CCMSLIB00017320932","spectrum_index":54392},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 158.1349 Da; putative annotation: N/A; putative formula: C8H19N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.195,"smiles":null,"spectrum_id":"CCMSLIB00017320933","spectrum_index":54393},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Ribose (delta mass: 119.9062 Da; putative annotation: N/A; putative formula: CH-1OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.966,"smiles":null,"spectrum_id":"CCMSLIB00017320934","spectrum_index":54394},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pycnarrhine (delta mass: 41.0274 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.129,"smiles":null,"spectrum_id":"CCMSLIB00017320935","spectrum_index":54395},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100279 D-Sorbitol|D-Sorbit|D-Glucitol|D-1,2,3,4,5,6-Hexanehexol|D-Sorbol|Cystosol|Glucarine|Diakarmon|Esasorb|Sorbol (delta mass: 390.0739 Da; putative annotation: N/A; putative formula: C22H14O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":573.16,"smiles":null,"spectrum_id":"CCMSLIB00017320936","spectrum_index":54396},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-(-)-Salsolidine (delta mass: 85.0397 Da; putative annotation: N/A; putative formula: CH3N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.173,"smiles":null,"spectrum_id":"CCMSLIB00017320937","spectrum_index":54397},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Difluoromethoxyphenyl)ethylamine (delta mass: 151.046 Da; putative annotation: N/A; putative formula: C8H9NS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":339.134,"smiles":null,"spectrum_id":"CCMSLIB00017320938","spectrum_index":54398},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dihydroxy-phenylalanine (L-DOPA); AIF; CE0; MS2Dec (delta mass: 63.0684 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.145,"smiles":null,"spectrum_id":"CCMSLIB00017320939","spectrum_index":54399},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinolin-2-ol (delta mass: 90.068 Da; putative annotation: N/A; putative formula: H6N6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.144,"smiles":null,"spectrum_id":"CCMSLIB00017320940","spectrum_index":54400},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Benzyloxy)-1H-indole-2-carboxylic acid (delta mass: 106.9886 Da; putative annotation: N/A; putative formula: H2N3O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":375.085,"smiles":null,"spectrum_id":"CCMSLIB00017320941","spectrum_index":54401},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 290.4854 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.572,"smiles":null,"spectrum_id":"CCMSLIB00017320942","spectrum_index":54402},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 381.1635 Da; putative annotation: N/A; putative formula: C15H27NO10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.333,"smiles":null,"spectrum_id":"CCMSLIB00017320943","spectrum_index":54403},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 363.1687 Da; putative annotation: N/A; putative formula: C12H25N7O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":527.26,"smiles":null,"spectrum_id":"CCMSLIB00017320944","spectrum_index":54404},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 334.163 Da; putative annotation: N/A; putative formula: C15H26O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.244,"smiles":null,"spectrum_id":"CCMSLIB00017320945","spectrum_index":54405},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 151.208 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.273,"smiles":null,"spectrum_id":"CCMSLIB00017320946","spectrum_index":54406},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 10.9824 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.1,"smiles":null,"spectrum_id":"CCMSLIB00017320947","spectrum_index":54407},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alpha-Codeimethine (delta mass: 162.0531 Da; putative annotation: N/A; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":476.228,"smiles":null,"spectrum_id":"CCMSLIB00017320948","spectrum_index":54408},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 176.0768 Da; putative annotation: N/A; putative formula: C2H8N8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.174,"smiles":null,"spectrum_id":"CCMSLIB00017320949","spectrum_index":54409},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2-dihydroxyheptadec-16-en-4-yl acetate (delta mass: 259.2618 Da; putative annotation: N/A; putative formula: C10H29N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.53,"smiles":null,"spectrum_id":"CCMSLIB00017320950","spectrum_index":54410},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 54.0164 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.196,"smiles":null,"spectrum_id":"CCMSLIB00017320951","spectrum_index":54411},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrazolo[1,5-a]pyridine-2-carboxylic acid (delta mass: 1086.3846 Da; putative annotation: N/A; putative formula: C55H62N2O21)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1249.43,"smiles":null,"spectrum_id":"CCMSLIB00017320952","spectrum_index":54412},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 142.1112 Da; putative annotation: N/A; putative formula: C7H14N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":286.157,"smiles":null,"spectrum_id":"CCMSLIB00017320953","spectrum_index":54413},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of alline (delta mass: 55.9892 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.107,"smiles":null,"spectrum_id":"CCMSLIB00017320954","spectrum_index":54414},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 17.0627 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":224.149,"smiles":null,"spectrum_id":"CCMSLIB00017320955","spectrum_index":54415},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"1,5-ANHYDRO-GLUCITOL\"\" (delta mass: 130.0784 Da; putative annotation: N/A; putative formula: C10H10)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.154,"smiles":null,"spectrum_id":"CCMSLIB00017320956","spectrum_index":54416},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(2-Nitrophenyl)-1,2-ethanediamine (delta mass: 102.047 Da; putative annotation: N/A; putative formula: C8H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.139,"smiles":null,"spectrum_id":"CCMSLIB00017320957","spectrum_index":54417},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(leucylprolyl) (delta mass: 186.1005 Da; putative annotation: N/A; putative formula: C8H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.245,"smiles":null,"spectrum_id":"CCMSLIB00017320958","spectrum_index":54418},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 70.0643 Da; putative annotation: N/A; putative formula: C2H6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.187,"smiles":null,"spectrum_id":"CCMSLIB00017320959","spectrum_index":54419},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU288205 Carboline|9H-pyrido[2,3-b]indole (delta mass: 76.0094 Da; putative annotation: N/A; putative formula: CH4N2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.085,"smiles":null,"spectrum_id":"CCMSLIB00017320960","spectrum_index":54420},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 63.0184 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":342.12,"smiles":null,"spectrum_id":"CCMSLIB00017320961","spectrum_index":54421},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 76.0296 Da; putative annotation: N/A; putative formula: H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.105,"smiles":null,"spectrum_id":"CCMSLIB00017320962","spectrum_index":54422},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Nonen-1-ol, (Z)- (delta mass: 70.0421 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.185,"smiles":null,"spectrum_id":"CCMSLIB00017320963","spectrum_index":54423},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Galacturonic acid (delta mass: 128.0626 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.112,"smiles":null,"spectrum_id":"CCMSLIB00017320964","spectrum_index":54424},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CNP0214803 (delta mass: 434.0852 Da; putative annotation: N/A; putative formula: C23H19N2O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":745.14,"smiles":null,"spectrum_id":"CCMSLIB00017320965","spectrum_index":54425},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 276.1355 Da; putative annotation: N/A; putative formula: C10H21N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":441.211,"smiles":null,"spectrum_id":"CCMSLIB00017320966","spectrum_index":54426},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Koninginin D (delta mass: 128.0623 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.248,"smiles":null,"spectrum_id":"CCMSLIB00017320967","spectrum_index":54427},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 77.0649 Da; putative annotation: N/A; putative formula: C6H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.251,"smiles":null,"spectrum_id":"CCMSLIB00017320968","spectrum_index":54428},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepine (delta mass: 46.0157 Da; putative annotation: N/A; putative formula: H2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.123,"smiles":null,"spectrum_id":"CCMSLIB00017320969","spectrum_index":54429},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 70.0413 Da; putative annotation: N/A; putative formula: C4H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":251.112,"smiles":null,"spectrum_id":"CCMSLIB00017320970","spectrum_index":54430},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylic acid (delta mass: 59.037 Da; putative annotation: N/A; putative formula: C2H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.15,"smiles":null,"spectrum_id":"CCMSLIB00017320971","spectrum_index":54431},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 863.3135 Da; putative annotation: N/A; putative formula: C45H49N7O7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1206.44,"smiles":null,"spectrum_id":"CCMSLIB00017320972","spectrum_index":54432},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 24.0899 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.15,"smiles":null,"spectrum_id":"CCMSLIB00017320973","spectrum_index":54433},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-5-methoxyheptan-3-one (delta mass: 376.183 Da; putative annotation: N/A; putative formula: C28H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.358,"smiles":null,"spectrum_id":"CCMSLIB00017320974","spectrum_index":54434},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Dihydroxynaphthalene (delta mass: 12.0178 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.077,"smiles":null,"spectrum_id":"CCMSLIB00017320975","spectrum_index":54435},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 180.0996 Da; putative annotation: N/A; putative formula: C4H8N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.202,"smiles":null,"spectrum_id":"CCMSLIB00017320976","spectrum_index":54436},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 142.0632 Da; putative annotation: N/A; putative formula: C7H10O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":366.176,"smiles":null,"spectrum_id":"CCMSLIB00017320977","spectrum_index":54437},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 88.1246 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.206,"smiles":null,"spectrum_id":"CCMSLIB00017320978","spectrum_index":54438},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-1-phenylethanol CollisionEnergy:205060 (delta mass: 15.9923 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":154.084,"smiles":null,"spectrum_id":"CCMSLIB00017320979","spectrum_index":54439},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2,5-Dimethyl-1,3-thiazol-4-yl)acetic acid (delta mass: 43.0751 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.118,"smiles":null,"spectrum_id":"CCMSLIB00017320980","spectrum_index":54440},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 185.1416 Da; putative annotation: N/A; putative formula: C10H19NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.244,"smiles":null,"spectrum_id":"CCMSLIB00017320981","spectrum_index":54441},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 117.0793 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.182,"smiles":null,"spectrum_id":"CCMSLIB00017320982","spectrum_index":54442},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 206.0577 Da; putative annotation: N/A; putative formula: C11H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.123,"smiles":null,"spectrum_id":"CCMSLIB00017320983","spectrum_index":54443},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 156.0323 Da; putative annotation: N/A; putative formula: C9H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.16,"smiles":null,"spectrum_id":"CCMSLIB00017320984","spectrum_index":54444},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 64.0628 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.217,"smiles":null,"spectrum_id":"CCMSLIB00017320985","spectrum_index":54445},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 74.1084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.262,"smiles":null,"spectrum_id":"CCMSLIB00017320986","spectrum_index":54446},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Pyridinemethanol (delta mass: 57.0214 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":167.081,"smiles":null,"spectrum_id":"CCMSLIB00017320987","spectrum_index":54447},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Acetyloxy)-2-naphthoic acid (delta mass: 82.0782 Da; putative annotation: N/A; putative formula: C6H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":313.143,"smiles":null,"spectrum_id":"CCMSLIB00017320988","spectrum_index":54448},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salicylcurcumin (delta mass: 12.0361 Da; putative annotation: N/A; putative formula: C2H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.148,"smiles":null,"spectrum_id":"CCMSLIB00017320989","spectrum_index":54449},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 38.0236 Da; putative annotation: N/A; putative formula: C2H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.125,"smiles":null,"spectrum_id":"CCMSLIB00017320990","spectrum_index":54450},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 278.1508 Da; putative annotation: N/A; putative formula: C10H23N4O3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":465.274,"smiles":null,"spectrum_id":"CCMSLIB00017320991","spectrum_index":54451},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 78.0321 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.212,"smiles":null,"spectrum_id":"CCMSLIB00017320992","spectrum_index":54452},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 191.0077 Da; putative annotation: N/A; putative formula: C6H9NO2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":492.188,"smiles":null,"spectrum_id":"CCMSLIB00017320993","spectrum_index":54453},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naltrexone (delta mass: 43.0421 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.212,"smiles":null,"spectrum_id":"CCMSLIB00017320994","spectrum_index":54454},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of LACTULOSE (delta mass: 422.3197 Da; putative annotation: N/A; putative formula: C22H42N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":765.443,"smiles":null,"spectrum_id":"CCMSLIB00017320995","spectrum_index":54455},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 167.1254 Da; putative annotation: N/A; putative formula: C10H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.201,"smiles":null,"spectrum_id":"CCMSLIB00017320996","spectrum_index":54456},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosamine (delta mass: 287.1386 Da; putative annotation: N/A; putative formula: C14H17N5O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.236,"smiles":null,"spectrum_id":"CCMSLIB00017320997","spectrum_index":54457},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,10-Dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,8,15,18-heptaen-12-one (delta mass: 469.1377 Da; putative annotation: N/A; putative formula: C19H20N9O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":840.287,"smiles":null,"spectrum_id":"CCMSLIB00017320998","spectrum_index":54458},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 34.032 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.113,"smiles":null,"spectrum_id":"CCMSLIB00017320999","spectrum_index":54459},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ285306 Benserazide|2-amino-3-hydroxy-N`-(2,3,4-trihydroxybenzyl)propionohydrazide (delta mass: 120.031 Da; putative annotation: N/A; putative formula: C6H4N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.139,"smiles":null,"spectrum_id":"CCMSLIB00017321000","spectrum_index":54460},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 921.509 Da; putative annotation: N/A; putative formula: C62H63N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1084.57,"smiles":null,"spectrum_id":"CCMSLIB00017321001","spectrum_index":54461},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Pro-Ile from NIST14 (delta mass: 115.1015 Da; putative annotation: N/A; putative formula: C6H13NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.256,"smiles":null,"spectrum_id":"CCMSLIB00017321002","spectrum_index":54462},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole (delta mass: 76.0386 Da; putative annotation: N/A; putative formula: H4N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.146,"smiles":null,"spectrum_id":"CCMSLIB00017321003","spectrum_index":54463},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydroalstonine (delta mass: 338.1618 Da; putative annotation: N/A; putative formula: C14H23N6O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":691.348,"smiles":null,"spectrum_id":"CCMSLIB00017321004","spectrum_index":54464},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 385.1373 Da; putative annotation: N/A; putative formula: C17H23NO9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":551.224,"smiles":null,"spectrum_id":"CCMSLIB00017321005","spectrum_index":54465},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(3,4-Dimethoxyphenyl)-1,3,4-thiadiazol-2-amine (delta mass: 117.0859 Da; putative annotation: N/A; putative formula: H7N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.15,"smiles":null,"spectrum_id":"CCMSLIB00017321006","spectrum_index":54466},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isoproterenol (delta mass: 187.0479 Da; putative annotation: N/A; putative formula: C7H9NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.176,"smiles":null,"spectrum_id":"CCMSLIB00017321007","spectrum_index":54467},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Gly-Phe (delta mass: 204.0862 Da; putative annotation: N/A; putative formula: C11H12N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.194,"smiles":null,"spectrum_id":"CCMSLIB00017321008","spectrum_index":54468},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6R,7R)-7-Amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 40.1447 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.188,"smiles":null,"spectrum_id":"CCMSLIB00017321009","spectrum_index":54469},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid, 2,3-dehydro-2-deoxy- (delta mass: 1295.3567 Da; putative annotation: N/A; putative formula: C81H58N9O-1P5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1587.46,"smiles":null,"spectrum_id":"CCMSLIB00017321010","spectrum_index":54470},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Fluoro-1H-indole-2-carboxylic acid (delta mass: 42.0167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.062,"smiles":null,"spectrum_id":"CCMSLIB00017321011","spectrum_index":54471},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 283.1941 Da; putative annotation: N/A; putative formula: C19H25NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.353,"smiles":null,"spectrum_id":"CCMSLIB00017321012","spectrum_index":54472},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Heptanone, 7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)- (delta mass: 108.046 Da; putative annotation: N/A; putative formula: C4H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":439.2,"smiles":null,"spectrum_id":"CCMSLIB00017321013","spectrum_index":54473},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6,6a-dihydrodemethoxyguadiscine (delta mass: 73.0311 Da; putative annotation: N/A; putative formula: C6H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.18,"smiles":null,"spectrum_id":"CCMSLIB00017321014","spectrum_index":54474},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 626.5385 Da; putative annotation: N/A; putative formula: C40H70N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":812.61,"smiles":null,"spectrum_id":"CCMSLIB00017321015","spectrum_index":54475},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 163.0844 Da; putative annotation: N/A; putative formula: C6H13NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":344.182,"smiles":null,"spectrum_id":"CCMSLIB00017321016","spectrum_index":54476},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of HarmalolHCl2H2O///harmalol///Harmalol CollisionEnergy:205060 (delta mass: 45.0679 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":246.17,"smiles":null,"spectrum_id":"CCMSLIB00017321017","spectrum_index":54477},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 98.0843 Da; putative annotation: N/A; putative formula: C5H10N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.119,"smiles":null,"spectrum_id":"CCMSLIB00017321018","spectrum_index":54478},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N1-(3-Aminopropyl)-N1-methylpropane-1,3-diamine (delta mass: 23.9886 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":170.154,"smiles":null,"spectrum_id":"CCMSLIB00017321019","spectrum_index":54479},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 57.0219 Da; putative annotation: N/A; putative formula: C2H3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":204.087,"smiles":null,"spectrum_id":"CCMSLIB00017321020","spectrum_index":54480},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 108.092 Da; putative annotation: N/A; putative formula: C8H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.183,"smiles":null,"spectrum_id":"CCMSLIB00017321021","spectrum_index":54481},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-(1H-Indol-4-yl)-N-(3-methoxypropyl)-1,2,4-oxadiazole-5-carboxamide (delta mass: 78.0218 Da; putative annotation: N/A; putative formula: C4H2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.151,"smiles":null,"spectrum_id":"CCMSLIB00017321022","spectrum_index":54482},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-HYDROXYDOPAMINE (delta mass: 64.0402 Da; putative annotation: N/A; putative formula: C4H4N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.121,"smiles":null,"spectrum_id":"CCMSLIB00017321023","spectrum_index":54483},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethyl-1,3-thiazole-4-carboxylic acid (delta mass: 236.9602 Da; putative annotation: N/A; putative formula: C7H3N5O-1S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":394.987,"smiles":null,"spectrum_id":"CCMSLIB00017321024","spectrum_index":54484},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 84.0948 Da; putative annotation: N/A; putative formula: C6H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.181,"smiles":null,"spectrum_id":"CCMSLIB00017321025","spectrum_index":54485},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxy-4-propylphenethylamine (delta mass: 32.0254 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.19,"smiles":null,"spectrum_id":"CCMSLIB00017321026","spectrum_index":54486},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[4-(Dimethylamino)phenyl]ethan-1-ol (delta mass: 118.0412 Da; putative annotation: N/A; putative formula: C2H7N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.164,"smiles":null,"spectrum_id":"CCMSLIB00017321027","spectrum_index":54487},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 920.9159 Da; putative annotation: N/A; putative formula: C60H120O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1143.01,"smiles":null,"spectrum_id":"CCMSLIB00017321028","spectrum_index":54488},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 726.4342 Da; putative annotation: N/A; putative formula: C42H62O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":907.505,"smiles":null,"spectrum_id":"CCMSLIB00017321029","spectrum_index":54489},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 283.0418 Da; putative annotation: N/A; putative formula: C8H12N7O-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.201,"smiles":null,"spectrum_id":"CCMSLIB00017321030","spectrum_index":54490},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Acetamido-2-deoxy-3-O-(.alpha.-L-fucopyranosyl)-D-glucopyranose (delta mass: 213.0796 Da; putative annotation: N/A; putative formula: C6H11N7S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":581.235,"smiles":null,"spectrum_id":"CCMSLIB00017321031","spectrum_index":54491},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Arabinitol (delta mass: 227.0944 Da; putative annotation: N/A; putative formula: C14H13NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.17,"smiles":null,"spectrum_id":"CCMSLIB00017321032","spectrum_index":54492},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (delta mass: 124.0595 Da; putative annotation: N/A; putative formula: C2H4N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.193,"smiles":null,"spectrum_id":"CCMSLIB00017321033","spectrum_index":54493},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-indol-4-ol (delta mass: 147.1135 Da; putative annotation: N/A; putative formula: C4H13N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.173,"smiles":null,"spectrum_id":"CCMSLIB00017321034","spectrum_index":54494},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 104.0265 Da; putative annotation: N/A; putative formula: C7H4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.128,"smiles":null,"spectrum_id":"CCMSLIB00017321035","spectrum_index":54495},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR311024 Diferuloyl putrescine (delta mass: 273.1577 Da; putative annotation: N/A; putative formula: C13H23NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":714.36,"smiles":null,"spectrum_id":"CCMSLIB00017321036","spectrum_index":54496},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 95.0372 Da; putative annotation: N/A; putative formula: C5H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.108,"smiles":null,"spectrum_id":"CCMSLIB00017321037","spectrum_index":54497},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(2-Quinolyl)ethanol (delta mass: 167.0899 Da; putative annotation: N/A; putative formula: C8H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":341.181,"smiles":null,"spectrum_id":"CCMSLIB00017321038","spectrum_index":54498},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Hydroxypyrene (delta mass: 105.0189 Da; putative annotation: N/A; putative formula: C2H-1N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.099,"smiles":null,"spectrum_id":"CCMSLIB00017321039","spectrum_index":54499},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU250803 2-Oxindole|Oxindole|1,3-dihydroindol-2-one (delta mass: 297.2509 Da; putative annotation: N/A; putative formula: C11H27N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":431.311,"smiles":null,"spectrum_id":"CCMSLIB00017321040","spectrum_index":54500},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 25.0287 Da; putative annotation: N/A; putative formula: C2H3NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":206.099,"smiles":null,"spectrum_id":"CCMSLIB00017321041","spectrum_index":54501},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenyl-1,3-thiazole-4-carboxylic acid (delta mass: 272.1986 Da; putative annotation: N/A; putative formula: C15H28O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":478.226,"smiles":null,"spectrum_id":"CCMSLIB00017321042","spectrum_index":54502},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nephrosteranic acid (delta mass: 162.1412 Da; putative annotation: N/A; putative formula: C12H18)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.363,"smiles":null,"spectrum_id":"CCMSLIB00017321043","spectrum_index":54503},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-(2-Hydroxyethyl)-4-methylthiazole (delta mass: 73.0609 Da; putative annotation: N/A; putative formula: C2H7N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.109,"smiles":null,"spectrum_id":"CCMSLIB00017321044","spectrum_index":54504},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methoxytyramine (delta mass: 17.9466 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":186.048,"smiles":null,"spectrum_id":"CCMSLIB00017321045","spectrum_index":54505},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of ReSpect:PM018176 Spermidine-di-p-coumaroyl (delta mass: 225.9984 Da; putative annotation: N/A; putative formula: C7H6N4OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.237,"smiles":null,"spectrum_id":"CCMSLIB00017321046","spectrum_index":54506},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dextrorphan (delta mass: 158.0979 Da; putative annotation: N/A; putative formula: C7H15N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.283,"smiles":null,"spectrum_id":"CCMSLIB00017321047","spectrum_index":54507},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 128.0626 Da; putative annotation: N/A; putative formula: C10H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":312.159,"smiles":null,"spectrum_id":"CCMSLIB00017321048","spectrum_index":54508},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyltyramine (delta mass: 25.0048 Da; putative annotation: N/A; putative formula: H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.107,"smiles":null,"spectrum_id":"CCMSLIB00017321049","spectrum_index":54509},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 471.0921 Da; putative annotation: N/A; putative formula: C22H21N3O5S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":634.152,"smiles":null,"spectrum_id":"CCMSLIB00017321050","spectrum_index":54510},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 97.9628 Da; putative annotation: N/A; putative formula: C3H-2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.06,"smiles":null,"spectrum_id":"CCMSLIB00017321051","spectrum_index":54511},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to (-)-Epinephrine from NIST14 (delta mass: 370.2497 Da; putative annotation: N/A; putative formula: C18H35N4O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.346,"smiles":null,"spectrum_id":"CCMSLIB00017321052","spectrum_index":54512},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 115.027 Da; putative annotation: D-Aspartatic acid - 30.0 eV; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.113,"smiles":null,"spectrum_id":"CCMSLIB00017321053","spectrum_index":54513},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR310692 Disaccharide(Hex-Hex) (delta mass: 324.1056 Da; putative annotation: Palatinose; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.229,"smiles":null,"spectrum_id":"CCMSLIB00017321054","spectrum_index":54514},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 174.1039 Da; putative annotation: (4-Isobutylphenyl)acetic acid; putative formula: C12H14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.175,"smiles":null,"spectrum_id":"CCMSLIB00017321055","spectrum_index":54515},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 101.047 Da; putative annotation: Massbank:PR100315 L-allo-Threonine|allo-Thr|L-Allothreonine|(2S,3S)-2-Amino-3-hydroxybutyric Acid; putative formula: C4H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":282.118,"smiles":null,"spectrum_id":"CCMSLIB00017321056","spectrum_index":54516},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 254.0219 Da; putative annotation: 2-[(3-Nitro-2-pyridinyl)sulfanyl]-1H-benzimidazole; putative formula: C12H6N4OS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.082,"smiles":null,"spectrum_id":"CCMSLIB00017321057","spectrum_index":54517},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 126.031 Da; putative annotation: 3-(Methoxycarbonyl)but-3-enoic acid; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.102,"smiles":null,"spectrum_id":"CCMSLIB00017321058","spectrum_index":54518},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 295.106 Da; putative annotation: NCGC00385280-01_C14H19NO7_(2R)-2-(beta-D-Glucopyranosyloxy)-2-phenylacetamide; putative formula: C14H17NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":479.203,"smiles":null,"spectrum_id":"CCMSLIB00017321059","spectrum_index":54519},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (3-exo)-3-[3-Methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octane (delta mass: 63.054 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.246,"smiles":null,"spectrum_id":"CCMSLIB00017321060","spectrum_index":54520},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Val-Leu from NIST14 (delta mass: 147.0685 Da; putative annotation: N/A; putative formula: C9H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.239,"smiles":null,"spectrum_id":"CCMSLIB00017321061","spectrum_index":54521},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 132.0803 Da; putative annotation: N/A; putative formula: C7H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.14,"smiles":null,"spectrum_id":"CCMSLIB00017321062","spectrum_index":54522},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 132.0379 Da; putative annotation: N/A; putative formula: C4H10N2O-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.119,"smiles":null,"spectrum_id":"CCMSLIB00017321063","spectrum_index":54523},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-3-pyridazinol (delta mass: 47.9724 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":159.028,"smiles":null,"spectrum_id":"CCMSLIB00017321064","spectrum_index":54524},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 137.084 Da; putative annotation: N/A; putative formula: C8H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":318.155,"smiles":null,"spectrum_id":"CCMSLIB00017321065","spectrum_index":54525},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-3-Benzazepine-7,8-diol, 6-chloro-2,3,4,5-tetrahydro-1-phenyl- (delta mass: 62.0058 Da; putative annotation: N/A; putative formula: H3N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":352.1,"smiles":null,"spectrum_id":"CCMSLIB00017321066","spectrum_index":54526},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ethylmorphine (delta mass: 63.9949 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.17,"smiles":null,"spectrum_id":"CCMSLIB00017321067","spectrum_index":54527},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 502.1321 Da; putative annotation: N/A; putative formula: C19H14N14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":668.218,"smiles":null,"spectrum_id":"CCMSLIB00017321068","spectrum_index":54528},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 38.0161 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.113,"smiles":null,"spectrum_id":"CCMSLIB00017321069","spectrum_index":54529},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 50.0149 Da; putative annotation: N/A; putative formula: C4H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.081,"smiles":null,"spectrum_id":"CCMSLIB00017321070","spectrum_index":54530},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 260.0925 Da; putative annotation: N/A; putative formula: C10H17N2O4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.19,"smiles":null,"spectrum_id":"CCMSLIB00017321071","spectrum_index":54531},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 77.0264 Da; putative annotation: N/A; putative formula: C5H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.081,"smiles":null,"spectrum_id":"CCMSLIB00017321072","spectrum_index":54532},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one (delta mass: 112.0313 Da; putative annotation: N/A; putative formula: C9H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.19,"smiles":null,"spectrum_id":"CCMSLIB00017321073","spectrum_index":54533},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 23.9965 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":353.135,"smiles":null,"spectrum_id":"CCMSLIB00017321074","spectrum_index":54534},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Leu-Lys-Arg (delta mass: 69.0608 Da; putative annotation: N/A; putative formula: C4H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.359,"smiles":null,"spectrum_id":"CCMSLIB00017321075","spectrum_index":54535},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 139.0637 Da; putative annotation: N/A; putative formula: C7H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":530.239,"smiles":null,"spectrum_id":"CCMSLIB00017321076","spectrum_index":54536},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 210.1985 Da; putative annotation: N/A; putative formula: C14H26O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":376.252,"smiles":null,"spectrum_id":"CCMSLIB00017321077","spectrum_index":54537},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Platyphyllonol (delta mass: 94.0782 Da; putative annotation: N/A; putative formula: C7H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.237,"smiles":null,"spectrum_id":"CCMSLIB00017321078","spectrum_index":54538},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 6.0108 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":165.091,"smiles":null,"spectrum_id":"CCMSLIB00017321079","spectrum_index":54539},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methionine sulfoxide (delta mass: 208.1826 Da; putative annotation: N/A; putative formula: C14H24O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.236,"smiles":null,"spectrum_id":"CCMSLIB00017321080","spectrum_index":54540},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 14-Hydroxycodeinone (delta mass: 23.9613 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":338.1,"smiles":null,"spectrum_id":"CCMSLIB00017321081","spectrum_index":54541},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of gamma-Glutamylmethionine (delta mass: 112.0894 Da; putative annotation: N/A; putative formula: C7H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":391.19,"smiles":null,"spectrum_id":"CCMSLIB00017321082","spectrum_index":54542},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 342.2044 Da; putative annotation: N/A; putative formula: C18H30O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":585.306,"smiles":null,"spectrum_id":"CCMSLIB00017321083","spectrum_index":54543},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of catharanthine (delta mass: 121.0807 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.272,"smiles":null,"spectrum_id":"CCMSLIB00017321084","spectrum_index":54544},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Phe-Leu from NIST14 (delta mass: 242.1156 Da; putative annotation: N/A; putative formula: C12H18O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":521.286,"smiles":null,"spectrum_id":"CCMSLIB00017321085","spectrum_index":54545},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4,5-Trimethoxyphenyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol (delta mass: 280.0926 Da; putative annotation: N/A; putative formula: C10H22N2OP2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":612.242,"smiles":null,"spectrum_id":"CCMSLIB00017321086","spectrum_index":54546},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Synephrine (delta mass: 388.1897 Da; putative annotation: N/A; putative formula: C23H24N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.292,"smiles":null,"spectrum_id":"CCMSLIB00017321087","spectrum_index":54547},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl .alpha.-D-mannopyranoside (delta mass: 193.0953 Da; putative annotation: N/A; putative formula: C7H15NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.182,"smiles":null,"spectrum_id":"CCMSLIB00017321088","spectrum_index":54548},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Pyrrolidinone; AIF; CE30; CorrDec (delta mass: 52.0313 Da; putative annotation: N/A; putative formula: C4H4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":138.091,"smiles":null,"spectrum_id":"CCMSLIB00017321089","spectrum_index":54549},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 18.9952 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.113,"smiles":null,"spectrum_id":"CCMSLIB00017321090","spectrum_index":54550},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-6-carboxamide, N-hydroxy-1-[(4-methoxyphenyl)methyl]- (delta mass: 46.0053 Da; putative annotation: N/A; putative formula: CH2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.129,"smiles":null,"spectrum_id":"CCMSLIB00017321091","spectrum_index":54551},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-4-tert-amylphenol (delta mass: 144.0786 Da; putative annotation: N/A; putative formula: C7H12O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.217,"smiles":null,"spectrum_id":"CCMSLIB00017321092","spectrum_index":54552},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (Phenoxymethyl)penicilloic acid (delta mass: 179.055 Da; putative annotation: N/A; putative formula: C6H16NO-1P3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":548.167,"smiles":null,"spectrum_id":"CCMSLIB00017321093","spectrum_index":54553},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-[2-(4-Aminophenyl)ethylamino]ethanol (delta mass: 104.0867 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.22,"smiles":null,"spectrum_id":"CCMSLIB00017321094","spectrum_index":54554},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 630.7052 Da; putative annotation: N/A; putative formula: C45H90)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":973.829,"smiles":null,"spectrum_id":"CCMSLIB00017321095","spectrum_index":54555},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 306.293 Da; putative annotation: N/A; putative formula: C21H38O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":915.564,"smiles":null,"spectrum_id":"CCMSLIB00017321096","spectrum_index":54556},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 358.2708 Da; putative annotation: N/A; putative formula: C17H30N10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.308,"smiles":null,"spectrum_id":"CCMSLIB00017321097","spectrum_index":54557},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 91.0421 Da; putative annotation: N/A; putative formula: C6H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.128,"smiles":null,"spectrum_id":"CCMSLIB00017321098","spectrum_index":54558},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 129.0392 Da; putative annotation: N/A; putative formula: CH3N7O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":410.193,"smiles":null,"spectrum_id":"CCMSLIB00017321099","spectrum_index":54559},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 171.1257 Da; putative annotation: N/A; putative formula: C9H17NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.223,"smiles":null,"spectrum_id":"CCMSLIB00017321100","spectrum_index":54560},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 112.0526 Da; putative annotation: N/A; putative formula: C6H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":325.15,"smiles":null,"spectrum_id":"CCMSLIB00017321101","spectrum_index":54561},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one (delta mass: 411.1894 Da; putative annotation: N/A; putative formula: C20H29NO8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":742.343,"smiles":null,"spectrum_id":"CCMSLIB00017321102","spectrum_index":54562},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 253.0588 Da; putative annotation: N/A; putative formula: C11H11NO6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":423.14,"smiles":null,"spectrum_id":"CCMSLIB00017321103","spectrum_index":54563},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Methylenedioxymethcathinone (delta mass: 182.0576 Da; putative annotation: N/A; putative formula: C9H10O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":390.154,"smiles":null,"spectrum_id":"CCMSLIB00017321104","spectrum_index":54564},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:NA002980 4-Hydroxycoumarin|CID 14101|2-hydroxychromen-4-one (delta mass: 479.142 Da; putative annotation: N/A; putative formula: C35H17N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":642.181,"smiles":null,"spectrum_id":"CCMSLIB00017321105","spectrum_index":54565},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Methylquinoline-2,7-diol (delta mass: 84.1149 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":260.185,"smiles":null,"spectrum_id":"CCMSLIB00017321106","spectrum_index":54566},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 167.0257 Da; putative annotation: N/A; putative formula: C4H9NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.117,"smiles":null,"spectrum_id":"CCMSLIB00017321107","spectrum_index":54567},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-2-(Naphthalen-2-yloxy)propanoic acid (delta mass: 102.0425 Da; putative annotation: N/A; putative formula: C3H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.128,"smiles":null,"spectrum_id":"CCMSLIB00017321108","spectrum_index":54568},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Methyl-N-phenyl-1H-indole-2-carboxamide (delta mass: 168.0749 Da; putative annotation: N/A; putative formula: C5H8N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.193,"smiles":null,"spectrum_id":"CCMSLIB00017321109","spectrum_index":54569},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxytryptophol (delta mass: 89.0861 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":281.188,"smiles":null,"spectrum_id":"CCMSLIB00017321110","spectrum_index":54570},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 222.0319 Da; putative annotation: N/A; putative formula: C14H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.103,"smiles":null,"spectrum_id":"CCMSLIB00017321111","spectrum_index":54571},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,8-Dimethylquinolin-2-ol (delta mass: 69.0668 Da; putative annotation: N/A; putative formula: C3H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.158,"smiles":null,"spectrum_id":"CCMSLIB00017321112","spectrum_index":54572},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 99.0397 Da; putative annotation: N/A; putative formula: C3H5N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.126,"smiles":null,"spectrum_id":"CCMSLIB00017321113","spectrum_index":54573},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-.alpha.-Kainic acid (delta mass: 24.0 Da; putative annotation: N/A; putative formula: C2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":238.107,"smiles":null,"spectrum_id":"CCMSLIB00017321114","spectrum_index":54574},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 101.0493 Da; putative annotation: N/A; putative formula: C3H8N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":323.147,"smiles":null,"spectrum_id":"CCMSLIB00017321115","spectrum_index":54575},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100335 D-Mannose-6-phosphate|Man-6P|6-phosphono-D-mannopyranose (delta mass: 403.3293 Da; putative annotation: N/A; putative formula: C22H45NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":664.366,"smiles":null,"spectrum_id":"CCMSLIB00017321116","spectrum_index":54576},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 71.082 Da; putative annotation: N/A; putative formula: C3H9N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.252,"smiles":null,"spectrum_id":"CCMSLIB00017321117","spectrum_index":54577},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Ribonic acid .gamma.-lactone (delta mass: 60.0447 Da; putative annotation: N/A; putative formula: H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":209.089,"smiles":null,"spectrum_id":"CCMSLIB00017321118","spectrum_index":54578},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 48.0211 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":214.144,"smiles":null,"spectrum_id":"CCMSLIB00017321119","spectrum_index":54579},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXYTYRAMINE (delta mass: 25.0205 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.122,"smiles":null,"spectrum_id":"CCMSLIB00017321120","spectrum_index":54580},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Ethyl-4-piperidinecarboxamide (delta mass: 72.0436 Da; putative annotation: N/A; putative formula: CH4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":229.177,"smiles":null,"spectrum_id":"CCMSLIB00017321121","spectrum_index":54581},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 626.2024 Da; putative annotation: N/A; putative formula: C44H27N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":806.289,"smiles":null,"spectrum_id":"CCMSLIB00017321122","spectrum_index":54582},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 116.0825 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":277.142,"smiles":null,"spectrum_id":"CCMSLIB00017321123","spectrum_index":54583},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PB005923 Tetrahydropapaveroline|1-[(3,4-dihydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol (delta mass: 63.0197 Da; putative annotation: N/A; putative formula: C3HN3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.143,"smiles":null,"spectrum_id":"CCMSLIB00017321124","spectrum_index":54584},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Fluoro-9H-carbazole (delta mass: 336.263 Da; putative annotation: N/A; putative formula: C17H32N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.334,"smiles":null,"spectrum_id":"CCMSLIB00017321125","spectrum_index":54585},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Avocadyne (delta mass: 62.0457 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.288,"smiles":null,"spectrum_id":"CCMSLIB00017321126","spectrum_index":54586},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Benzyl-1,3-thiazole-4-carboxylic acid (delta mass: 64.1075 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.15,"smiles":null,"spectrum_id":"CCMSLIB00017321127","spectrum_index":54587},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 324.1066 Da; putative annotation: N/A; putative formula: C12H20O10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":829.283,"smiles":null,"spectrum_id":"CCMSLIB00017321128","spectrum_index":54588},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-(1H-Indol-3-yl)-1,3-thiazol-2-ylamine (delta mass: 18.0177 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.077,"smiles":null,"spectrum_id":"CCMSLIB00017321129","spectrum_index":54589},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenylephrine (delta mass: 143.15 Da; putative annotation: N/A; putative formula: C6H17N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.252,"smiles":null,"spectrum_id":"CCMSLIB00017321130","spectrum_index":54590},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 269.1269 Da; putative annotation: N/A; putative formula: C14H23NS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":616.276,"smiles":null,"spectrum_id":"CCMSLIB00017321131","spectrum_index":54591},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-[2-(5-methoxy-2-methylindol-3-yl)ethyl](3,4,5-trimethoxyphenyl)carboxamide CollisionEnergy:102040\"\" (delta mass: 212.069 Da; putative annotation: N/A; putative formula: C9H12N2O4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":611.26,"smiles":null,"spectrum_id":"CCMSLIB00017321132","spectrum_index":54592},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isomaltose (delta mass: 366.2085 Da; putative annotation: N/A; putative formula: C17H36O4P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":709.332,"smiles":null,"spectrum_id":"CCMSLIB00017321133","spectrum_index":54593},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinoline-4-carboxylic acid CollisionEnergy:205060 (delta mass: 17.0298 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.085,"smiles":null,"spectrum_id":"CCMSLIB00017321134","spectrum_index":54594},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 151.1066 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.286,"smiles":null,"spectrum_id":"CCMSLIB00017321135","spectrum_index":54595},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 8.949 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.051,"smiles":null,"spectrum_id":"CCMSLIB00017321136","spectrum_index":54596},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 779.4452 Da; putative annotation: N/A; putative formula: C54H57N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":944.521,"smiles":null,"spectrum_id":"CCMSLIB00017321137","spectrum_index":54597},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Hydroxyhexenal (delta mass: 57.0578 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.133,"smiles":null,"spectrum_id":"CCMSLIB00017321138","spectrum_index":54598},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 330.9249 Da; putative annotation: N/A; putative formula: C14H5NOS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.985,"smiles":null,"spectrum_id":"CCMSLIB00017321139","spectrum_index":54599},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 381.2518 Da; putative annotation: N/A; putative formula: C21H35NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":532.312,"smiles":null,"spectrum_id":"CCMSLIB00017321140","spectrum_index":54600},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Terbutaline (delta mass: 218.163 Da; putative annotation: N/A; putative formula: C10H22N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":444.307,"smiles":null,"spectrum_id":"CCMSLIB00017321141","spectrum_index":54601},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Nafcillin (delta mass: 102.0179 Da; putative annotation: N/A; putative formula: CH2N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.15,"smiles":null,"spectrum_id":"CCMSLIB00017321142","spectrum_index":54602},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 783.3318 Da; putative annotation: N/A; putative formula: C40H54N3O9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":934.392,"smiles":null,"spectrum_id":"CCMSLIB00017321143","spectrum_index":54603},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 410.1422 Da; putative annotation: N/A; putative formula: C16H26O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":705.245,"smiles":null,"spectrum_id":"CCMSLIB00017321144","spectrum_index":54604},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 194.2098 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":495.39,"smiles":null,"spectrum_id":"CCMSLIB00017321145","spectrum_index":54605},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluorotryptamine (delta mass: 55.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":234.134,"smiles":null,"spectrum_id":"CCMSLIB00017321146","spectrum_index":54606},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MALTOSE (delta mass: 306.0465 Da; putative annotation: N/A; putative formula: C10H18N4O-1S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.17,"smiles":null,"spectrum_id":"CCMSLIB00017321147","spectrum_index":54607},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 86.0495 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":477.225,"smiles":null,"spectrum_id":"CCMSLIB00017321148","spectrum_index":54608},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Amino-4-methylquinolin-2-ol (delta mass: 95.9843 Da; putative annotation: N/A; putative formula: C4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":271.071,"smiles":null,"spectrum_id":"CCMSLIB00017321149","spectrum_index":54609},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5S,6R)-2-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 144.0474 Da; putative annotation: N/A; putative formula: C4H8N4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.28,"smiles":null,"spectrum_id":"CCMSLIB00017321150","spectrum_index":54610},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Stachydrine (delta mass: 98.0095 Da; putative annotation: N/A; putative formula: C3H2N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.111,"smiles":null,"spectrum_id":"CCMSLIB00017321151","spectrum_index":54611},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lactitol (delta mass: 36.0434 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":381.182,"smiles":null,"spectrum_id":"CCMSLIB00017321152","spectrum_index":54612},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EA285108 Albuterol|Salbutamol|4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol (delta mass: 434.1708 Da; putative annotation: N/A; putative formula: C19H31O9P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":674.33,"smiles":null,"spectrum_id":"CCMSLIB00017321153","spectrum_index":54613},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(2-nitrobenzyl)ethanamine (delta mass: 86.0442 Da; putative annotation: N/A; putative formula: C3H6N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":361.163,"smiles":null,"spectrum_id":"CCMSLIB00017321154","spectrum_index":54614},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 296.243 Da; putative annotation: N/A; putative formula: C13H28N8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":433.278,"smiles":null,"spectrum_id":"CCMSLIB00017321155","spectrum_index":54615},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 396.5451 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":550.631,"smiles":null,"spectrum_id":"CCMSLIB00017321156","spectrum_index":54616},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 127.0509 Da; putative annotation: N/A; putative formula: C3H5N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":293.173,"smiles":null,"spectrum_id":"CCMSLIB00017321157","spectrum_index":54617},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 154.0584 Da; putative annotation: N/A; putative formula: H2N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.16,"smiles":null,"spectrum_id":"CCMSLIB00017321158","spectrum_index":54618},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,5-Dimethoxyphenethylamine (delta mass: 57.0465 Da; putative annotation: N/A; putative formula: H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017321159","spectrum_index":54619},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of cephalotaxine (delta mass: 127.1253 Da; putative annotation: N/A; putative formula: C5H13N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":443.28,"smiles":null,"spectrum_id":"CCMSLIB00017321160","spectrum_index":54620},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 128.0831 Da; putative annotation: N/A; putative formula: C7H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.133,"smiles":null,"spectrum_id":"CCMSLIB00017321161","spectrum_index":54621},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Kanamycin A (delta mass: 442.2157 Da; putative annotation: N/A; putative formula: C30H26N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":927.461,"smiles":null,"spectrum_id":"CCMSLIB00017321162","spectrum_index":54622},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 148.089 Da; putative annotation: N/A; putative formula: C10H12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.175,"smiles":null,"spectrum_id":"CCMSLIB00017321163","spectrum_index":54623},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Arg-Tyr (delta mass: 163.0626 Da; putative annotation: N/A; putative formula: C9H9NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":501.245,"smiles":null,"spectrum_id":"CCMSLIB00017321164","spectrum_index":54624},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine-6-phosphate (delta mass: 341.2935 Da; putative annotation: N/A; putative formula: C20H39NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":643.357,"smiles":null,"spectrum_id":"CCMSLIB00017321165","spectrum_index":54625},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE (delta mass: 240.0422 Da; putative annotation: N/A; putative formula: C14H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.113,"smiles":null,"spectrum_id":"CCMSLIB00017321166","spectrum_index":54626},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (E)-1,7-Bis(4-hydroxyphenyl)hept-1-en-3-one (delta mass: 30.0319 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.18,"smiles":null,"spectrum_id":"CCMSLIB00017321167","spectrum_index":54627},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Melezitose (delta mass: 845.3045 Da; putative annotation: N/A; putative formula: C43H52N5O7PS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1350.48,"smiles":null,"spectrum_id":"CCMSLIB00017321168","spectrum_index":54628},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-((Dimethylamino)methyl)phenol (delta mass: 236.1567 Da; putative annotation: N/A; putative formula: C18H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.264,"smiles":null,"spectrum_id":"CCMSLIB00017321169","spectrum_index":54629},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 596.3892 Da; putative annotation: N/A; putative formula: C39H53N2OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":987.564,"smiles":null,"spectrum_id":"CCMSLIB00017321170","spectrum_index":54630},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 66.0596 Da; putative annotation: N/A; putative formula: C4H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":290.172,"smiles":null,"spectrum_id":"CCMSLIB00017321171","spectrum_index":54631},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adonitol (delta mass: 282.1256 Da; putative annotation: N/A; putative formula: C18H18O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":435.201,"smiles":null,"spectrum_id":"CCMSLIB00017321172","spectrum_index":54632},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 478.1726 Da; putative annotation: N/A; putative formula: C23H18N12O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":787.285,"smiles":null,"spectrum_id":"CCMSLIB00017321173","spectrum_index":54633},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 548.3714 Da; putative annotation: N/A; putative formula: C32H52O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":755.458,"smiles":null,"spectrum_id":"CCMSLIB00017321174","spectrum_index":54634},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-O-Methylvisamminol (delta mass: 68.0628 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.185,"smiles":null,"spectrum_id":"CCMSLIB00017321175","spectrum_index":54635},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Normorphine (delta mass: 63.9985 Da; putative annotation: N/A; putative formula: C4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":336.127,"smiles":null,"spectrum_id":"CCMSLIB00017321176","spectrum_index":54636},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 338.0849 Da; putative annotation: N/A; putative formula: C10H6N14O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":517.14,"smiles":null,"spectrum_id":"CCMSLIB00017321177","spectrum_index":54637},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Ureidoisobutyric acid [M+H-H2O]+; AIF; CE10; MS2Dec (delta mass: 150.0351 Da; putative annotation: N/A; putative formula: C5H10O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":297.112,"smiles":null,"spectrum_id":"CCMSLIB00017321178","spectrum_index":54638},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one (delta mass: 64.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":213.123,"smiles":null,"spectrum_id":"CCMSLIB00017321179","spectrum_index":54639},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 91.0994 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.285,"smiles":null,"spectrum_id":"CCMSLIB00017321180","spectrum_index":54640},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 189.1991 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":426.275,"smiles":null,"spectrum_id":"CCMSLIB00017321181","spectrum_index":54641},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 88.053 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":311.15,"smiles":null,"spectrum_id":"CCMSLIB00017321182","spectrum_index":54642},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-QUINOLINECARBOXYLIC ACID - 70.00 eV (delta mass: 3.445 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.5,"smiles":null,"spectrum_id":"CCMSLIB00017321183","spectrum_index":54643},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-PSICOSE (delta mass: 348.2342 Da; putative annotation: N/A; putative formula: C18H38O2P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.305,"smiles":null,"spectrum_id":"CCMSLIB00017321184","spectrum_index":54644},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 296.2363 Da; putative annotation: N/A; putative formula: C19H28N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":640.422,"smiles":null,"spectrum_id":"CCMSLIB00017321185","spectrum_index":54645},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of quinine anhydre (delta mass: 76.1472 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":401.338,"smiles":null,"spectrum_id":"CCMSLIB00017321186","spectrum_index":54646},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-{[3-(Dimethylamino)propyl]amino}propanenitrile (delta mass: 59.073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":215.223,"smiles":null,"spectrum_id":"CCMSLIB00017321187","spectrum_index":54647},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid (delta mass: 181.0734 Da; putative annotation: N/A; putative formula: C9H11NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.128,"smiles":null,"spectrum_id":"CCMSLIB00017321188","spectrum_index":54648},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Murrayafoline A (delta mass: 91.0263 Da; putative annotation: N/A; putative formula: C2H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.133,"smiles":null,"spectrum_id":"CCMSLIB00017321189","spectrum_index":54649},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 354.0736 Da; putative annotation: N/A; putative formula: C14H27PS4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":535.144,"smiles":null,"spectrum_id":"CCMSLIB00017321190","spectrum_index":54650},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100279 D-Sorbitol|D-Sorbit|D-Glucitol|D-1,2,3,4,5,6-Hexanehexol|D-Sorbol|Cystosol|Glucarine|Diakarmon|Esasorb|Sorbol (delta mass: 302.2979 Da; putative annotation: N/A; putative formula: C22H38)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.384,"smiles":null,"spectrum_id":"CCMSLIB00017321191","spectrum_index":54651},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Fluorophenyl)-N-(2-methoxybenzyl)ethanamine (delta mass: 16.0261 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.171,"smiles":null,"spectrum_id":"CCMSLIB00017321192","spectrum_index":54652},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxy-2-methylindole (delta mass: 122.0732 Da; putative annotation: N/A; putative formula: C8H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.149,"smiles":null,"spectrum_id":"CCMSLIB00017321193","spectrum_index":54653},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 334.1733 Da; putative annotation: N/A; putative formula: C16H31O3PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":556.271,"smiles":null,"spectrum_id":"CCMSLIB00017321194","spectrum_index":54654},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ366301 Cefazolin|3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-7-[[2-(tetrazol-1-yl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (delta mass: 256.146 Da; putative annotation: N/A; putative formula: C17H20O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":711.183,"smiles":null,"spectrum_id":"CCMSLIB00017321195","spectrum_index":54655},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.-Mannobiose (delta mass: 115.027 Da; putative annotation: L-Aspartic acid; putative formula: C4H5NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.151,"smiles":null,"spectrum_id":"CCMSLIB00017321196","spectrum_index":54656},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ile-Glu (delta mass: 113.0842 Da; putative annotation: Norleucine; putative formula: C6H11NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":374.229,"smiles":null,"spectrum_id":"CCMSLIB00017321197","spectrum_index":54657},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 96.0575 Da; putative annotation: 4-Hydroxyhexenal; putative formula: C6H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":267.123,"smiles":null,"spectrum_id":"CCMSLIB00017321198","spectrum_index":54658},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-glucosamine (delta mass: 267.2541 Da; putative annotation: Heptadecasphing-4-enine; putative formula: C17H33NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":489.351,"smiles":null,"spectrum_id":"CCMSLIB00017321199","spectrum_index":54659},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 264.2454 Da; putative annotation: oleic acid CollisionEnergy:205060; putative formula: C18H32O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.306,"smiles":null,"spectrum_id":"CCMSLIB00017321200","spectrum_index":54660},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 100.0159 Da; putative annotation: METHYLMALONIC ACID; putative formula: C4H4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.102,"smiles":null,"spectrum_id":"CCMSLIB00017321201","spectrum_index":54661},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 248.021 Da; putative annotation: 3-Chloro-N-(4-phenyl-1,3-thiazol-2-yl)propanamide; putative formula: C12H9ClN2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.086,"smiles":null,"spectrum_id":"CCMSLIB00017321202","spectrum_index":54662},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 50.0519 Da; putative annotation: N/A; putative formula: C5H6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.164,"smiles":null,"spectrum_id":"CCMSLIB00017321203","spectrum_index":54663},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Piperidinecarboxamide (delta mass: 118.7477 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.85,"smiles":null,"spectrum_id":"CCMSLIB00017321204","spectrum_index":54664},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 108.0579 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.123,"smiles":null,"spectrum_id":"CCMSLIB00017321205","spectrum_index":54665},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2EFO1BP34R - 40.0 eV (delta mass: 100.0787 Da; putative annotation: N/A; putative formula: C6H13O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":409.191,"smiles":null,"spectrum_id":"CCMSLIB00017321206","spectrum_index":54666},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Alnusone (delta mass: 155.0887 Da; putative annotation: N/A; putative formula: C7H13N3O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":450.222,"smiles":null,"spectrum_id":"CCMSLIB00017321207","spectrum_index":54667},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE - 70.0 eV (delta mass: 53.9168 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.003,"smiles":null,"spectrum_id":"CCMSLIB00017321208","spectrum_index":54668},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ser-Leu (delta mass: 101.0461 Da; putative annotation: N/A; putative formula: H3N7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.18,"smiles":null,"spectrum_id":"CCMSLIB00017321209","spectrum_index":54669},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Hydroxy-2,9,10-trimethoxy-5,6-dihydroisoquinolino[3,2-a]isoquinolinium cation (delta mass: 180.085 Da; putative annotation: N/A; putative formula: C4H12N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":518.224,"smiles":null,"spectrum_id":"CCMSLIB00017321210","spectrum_index":54670},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lycobetaine (delta mass: 58.0416 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":324.123,"smiles":null,"spectrum_id":"CCMSLIB00017321211","spectrum_index":54671},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Alanine, N-[2-(2-pyridinyl)-6-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)-4-pyrimidinyl]- (delta mass: 44.0175 Da; putative annotation: N/A; putative formula: C2H5O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.21,"smiles":null,"spectrum_id":"CCMSLIB00017321212","spectrum_index":54672},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 292.1157 Da; putative annotation: N/A; putative formula: C12H20O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":458.202,"smiles":null,"spectrum_id":"CCMSLIB00017321213","spectrum_index":54673},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxydopamine (delta mass: 91.0173 Da; putative annotation: N/A; putative formula: C4HN3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.099,"smiles":null,"spectrum_id":"CCMSLIB00017321214","spectrum_index":54674},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Methylenedioxymethamphetamine (delta mass: 15.9949 Da; putative annotation: N/A; putative formula: O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":210.113,"smiles":null,"spectrum_id":"CCMSLIB00017321215","spectrum_index":54675},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Acetyl-L-threonine (delta mass: 54.0098 Da; putative annotation: N/A; putative formula: C3H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.086,"smiles":null,"spectrum_id":"CCMSLIB00017321216","spectrum_index":54676},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N8-Acetylspermidine (delta mass: 183.167 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":371.343,"smiles":null,"spectrum_id":"CCMSLIB00017321217","spectrum_index":54677},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Fructose (delta mass: 257.125 Da; putative annotation: N/A; putative formula: C9H11N11O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":438.196,"smiles":null,"spectrum_id":"CCMSLIB00017321218","spectrum_index":54678},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-8H-isochromen-6-one (delta mass: 80.0635 Da; putative annotation: N/A; putative formula: C6H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.16,"smiles":null,"spectrum_id":"CCMSLIB00017321219","spectrum_index":54679},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Methyl-1H-indazole-3-carboxylic acid (delta mass: 63.0624 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":240.128,"smiles":null,"spectrum_id":"CCMSLIB00017321220","spectrum_index":54680},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 189.1014 Da; putative annotation: N/A; putative formula: C9H11N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.167,"smiles":null,"spectrum_id":"CCMSLIB00017321221","spectrum_index":54681},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 58.0321 Da; putative annotation: N/A; putative formula: C3H7O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.135,"smiles":null,"spectrum_id":"CCMSLIB00017321222","spectrum_index":54682},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSAMINE 6-PHOSPHATE (delta mass: 180.1529 Da; putative annotation: N/A; putative formula: C12H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.206,"smiles":null,"spectrum_id":"CCMSLIB00017321223","spectrum_index":54683},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Cinchonidine (delta mass: 45.0667 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.247,"smiles":null,"spectrum_id":"CCMSLIB00017321224","spectrum_index":54684},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU084604 3-Hydroxy-2-naphthoic acid|3-hydroxynaphthalene-2-carboxylic acid (delta mass: 119.0672 Da; putative annotation: N/A; putative formula: C3H9N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.122,"smiles":null,"spectrum_id":"CCMSLIB00017321225","spectrum_index":54685},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 248.0486 Da; putative annotation: N/A; putative formula: C17H4N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":579.203,"smiles":null,"spectrum_id":"CCMSLIB00017321226","spectrum_index":54686},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 182.1314 Da; putative annotation: N/A; putative formula: C11H18O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.218,"smiles":null,"spectrum_id":"CCMSLIB00017321227","spectrum_index":54687},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Dihydroxychromone (delta mass: 266.0795 Da; putative annotation: N/A; putative formula: C8H11N8OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":445.113,"smiles":null,"spectrum_id":"CCMSLIB00017321228","spectrum_index":54688},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 79.0693 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.109,"smiles":null,"spectrum_id":"CCMSLIB00017321229","spectrum_index":54689},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Austdiol (delta mass: 68.0628 Da; putative annotation: N/A; putative formula: C5H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.138,"smiles":null,"spectrum_id":"CCMSLIB00017321230","spectrum_index":54690},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salvinorin B (delta mass: 81.0694 Da; putative annotation: N/A; putative formula: C4H7N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.245,"smiles":null,"spectrum_id":"CCMSLIB00017321231","spectrum_index":54691},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"4-amino-3-indol-3-ylazoline-2,5-dione CollisionEnergy:102040\"\" (delta mass: 17.0275 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.104,"smiles":null,"spectrum_id":"CCMSLIB00017321232","spectrum_index":54692},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4_methoxy_23_dihydro_1H_indole (delta mass: 42.0087 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":192.1,"smiles":null,"spectrum_id":"CCMSLIB00017321233","spectrum_index":54693},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of CLE_291.1026_12.2 (delta mass: 44.0826 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017321234","spectrum_index":54694},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (.+/-.)-Anatoxin A (delta mass: 388.3354 Da; putative annotation: N/A; putative formula: C26H44O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":554.458,"smiles":null,"spectrum_id":"CCMSLIB00017321235","spectrum_index":54695},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2-(4-oxo-1,2,3,5-tetrahydrocyclopenta[1,2-c]quinolin-5-yl)acetic acid CollisionEnergy:102040\"\" (delta mass: 17.0144 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":261.111,"smiles":null,"spectrum_id":"CCMSLIB00017321236","spectrum_index":54696},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Centrolobol (delta mass: 241.2289 Da; putative annotation: N/A; putative formula: C12H27N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":542.409,"smiles":null,"spectrum_id":"CCMSLIB00017321237","spectrum_index":54697},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R,3R,4S,5S,6R)-2-[(3R)-1,7-bis(3,4-dihydroxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol (delta mass: 114.0675 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":609.29,"smiles":null,"spectrum_id":"CCMSLIB00017321238","spectrum_index":54698},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Hirsutenone (delta mass: 17.084 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.222,"smiles":null,"spectrum_id":"CCMSLIB00017321239","spectrum_index":54699},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 19.0184 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":262.12,"smiles":null,"spectrum_id":"CCMSLIB00017321240","spectrum_index":54700},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 5-acetyloxy-6,10-dihydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,8-trioxo-4a,5,6,6a,9,10,10b,11-octahydronaphtho[1,2-h]isochromene-2-carboxylate (delta mass: 114.0747 Da; putative annotation: N/A; putative formula: CH6N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.328,"smiles":null,"spectrum_id":"CCMSLIB00017321241","spectrum_index":54701},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-2-naphthol (delta mass: 256.1143 Da; putative annotation: N/A; putative formula: C6H12N10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":416.19,"smiles":null,"spectrum_id":"CCMSLIB00017321242","spectrum_index":54702},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmaline (delta mass: 167.1252 Da; putative annotation: N/A; putative formula: C10H18NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":382.243,"smiles":null,"spectrum_id":"CCMSLIB00017321243","spectrum_index":54703},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopamine (delta mass: 123.0681 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.17,"smiles":null,"spectrum_id":"CCMSLIB00017321244","spectrum_index":54704},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 62.9863 Da; putative annotation: N/A; putative formula: H2NOP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":207.032,"smiles":null,"spectrum_id":"CCMSLIB00017321245","spectrum_index":54705},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-3,4-Dihydroxyphenyl glycol (delta mass: 311.1946 Da; putative annotation: N/A; putative formula: C14H25N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":482.26,"smiles":null,"spectrum_id":"CCMSLIB00017321246","spectrum_index":54706},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenelzine (delta mass: 59.8461 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":196.953,"smiles":null,"spectrum_id":"CCMSLIB00017321247","spectrum_index":54707},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 56.0718 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.158,"smiles":null,"spectrum_id":"CCMSLIB00017321248","spectrum_index":54708},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 227.0705 Da; putative annotation: N/A; putative formula: C10H14NO3P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.119,"smiles":null,"spectrum_id":"CCMSLIB00017321249","spectrum_index":54709},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 289.1893 Da; putative annotation: N/A; putative formula: C14H27NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.265,"smiles":null,"spectrum_id":"CCMSLIB00017321250","spectrum_index":54710},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Amino-1-(2-amino-3-hydroxyphenyl)propan-1-one (delta mass: 78.037 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":259.134,"smiles":null,"spectrum_id":"CCMSLIB00017321251","spectrum_index":54711},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 84.0372 Da; putative annotation: N/A; putative formula: C8H4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":247.16,"smiles":null,"spectrum_id":"CCMSLIB00017321252","spectrum_index":54712},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 91.0544 Da; putative annotation: N/A; putative formula: C5H5N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.141,"smiles":null,"spectrum_id":"CCMSLIB00017321253","spectrum_index":54713},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 132.0941 Da; putative annotation: N/A; putative formula: C10H12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":457.331,"smiles":null,"spectrum_id":"CCMSLIB00017321254","spectrum_index":54714},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 105.0576 Da; putative annotation: N/A; putative formula: C7H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.128,"smiles":null,"spectrum_id":"CCMSLIB00017321255","spectrum_index":54715},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Hydroxytropinone (delta mass: 94.1146 Da; putative annotation: N/A; putative formula: C8H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":250.217,"smiles":null,"spectrum_id":"CCMSLIB00017321256","spectrum_index":54716},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 98.1047 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":327.202,"smiles":null,"spectrum_id":"CCMSLIB00017321257","spectrum_index":54717},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylglucosaminylasparagine (delta mass: 242.1018 Da; putative annotation: N/A; putative formula: C9H14N4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":578.242,"smiles":null,"spectrum_id":"CCMSLIB00017321258","spectrum_index":54718},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1S)-2-Amino-1-(4-fluorophenyl)ethanol (delta mass: 45.0204 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":201.102,"smiles":null,"spectrum_id":"CCMSLIB00017321259","spectrum_index":54719},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 56.0777 Da; putative annotation: N/A; putative formula: C3H8N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017321260","spectrum_index":54720},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 17.9366 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.08,"smiles":null,"spectrum_id":"CCMSLIB00017321261","spectrum_index":54721},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Santacruzamate A (delta mass: 78.0348 Da; putative annotation: N/A; putative formula: C3H2N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.205,"smiles":null,"spectrum_id":"CCMSLIB00017321262","spectrum_index":54722},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-N'-(2-phenylethyl)thiourea (delta mass: 126.023 Da; putative annotation: N/A; putative formula: C6H7OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.149,"smiles":null,"spectrum_id":"CCMSLIB00017321263","spectrum_index":54723},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 386.2885 Da; putative annotation: N/A; putative formula: C21H43N2PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":608.386,"smiles":null,"spectrum_id":"CCMSLIB00017321264","spectrum_index":54724},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Fluorophenethylamine (delta mass: 49.0031 Da; putative annotation: N/A; putative formula: C2H-1N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":189.09,"smiles":null,"spectrum_id":"CCMSLIB00017321265","spectrum_index":54725},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmaline (delta mass: 69.0106 Da; putative annotation: N/A; putative formula: C3H4NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":284.129,"smiles":null,"spectrum_id":"CCMSLIB00017321266","spectrum_index":54726},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 357.2468 Da; putative annotation: N/A; putative formula: C18H37N3P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":490.323,"smiles":null,"spectrum_id":"CCMSLIB00017321267","spectrum_index":54727},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 204.0429 Da; putative annotation: N/A; putative formula: C4H8N6O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.145,"smiles":null,"spectrum_id":"CCMSLIB00017321268","spectrum_index":54728},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP023103 D(+)-Melezitose|Melezitose|(2R,3R,4S,5S,6R)-2-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl]oxy-6-(hydroxymethyl)oxane- (delta mass: 192.0432 Da; putative annotation: N/A; putative formula: C11H12O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":697.219,"smiles":null,"spectrum_id":"CCMSLIB00017321269","spectrum_index":54729},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 72.0577 Da; putative annotation: N/A; putative formula: C4H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.155,"smiles":null,"spectrum_id":"CCMSLIB00017321270","spectrum_index":54730},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 43.0412 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":176.117,"smiles":null,"spectrum_id":"CCMSLIB00017321271","spectrum_index":54731},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Uridine 5'-monophosphate (delta mass: 97.1858 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.229,"smiles":null,"spectrum_id":"CCMSLIB00017321272","spectrum_index":54732},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 61.0518 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":222.111,"smiles":null,"spectrum_id":"CCMSLIB00017321273","spectrum_index":54733},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-[(2-Naphthyloxy)methyl]benzoic acid (delta mass: 55.0062 Da; putative annotation: N/A; putative formula: C2HNO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":334.108,"smiles":null,"spectrum_id":"CCMSLIB00017321274","spectrum_index":54734},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Phenethylamine (delta mass: 235.1917 Da; putative annotation: N/A; putative formula: C11H21N7O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":357.288,"smiles":null,"spectrum_id":"CCMSLIB00017321275","spectrum_index":54735},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Turanose (delta mass: 482.3036 Da; putative annotation: N/A; putative formula: C23H42N6O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":825.427,"smiles":null,"spectrum_id":"CCMSLIB00017321276","spectrum_index":54736},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cyclo(isoleucylprolyl) (delta mass: 117.079 Da; putative annotation: N/A; putative formula: C5H11NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.223,"smiles":null,"spectrum_id":"CCMSLIB00017321277","spectrum_index":54737},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Labetalol (delta mass: 131.1016 Da; putative annotation: N/A; putative formula: CH9N9O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.288,"smiles":null,"spectrum_id":"CCMSLIB00017321278","spectrum_index":54738},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pyrrole-2-carboxylic acid (delta mass: 57.0582 Da; putative annotation: N/A; putative formula: C3H7N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":169.098,"smiles":null,"spectrum_id":"CCMSLIB00017321279","spectrum_index":54739},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Mannosamine (delta mass: 231.0887 Da; putative annotation: N/A; putative formula: C8H13N3O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.175,"smiles":null,"spectrum_id":"CCMSLIB00017321280","spectrum_index":54740},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carbidopa (delta mass: 242.1277 Da; putative annotation: N/A; putative formula: C11H18N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":469.23,"smiles":null,"spectrum_id":"CCMSLIB00017321281","spectrum_index":54741},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 234.1623 Da; putative annotation: N/A; putative formula: C15H22O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":529.265,"smiles":null,"spectrum_id":"CCMSLIB00017321282","spectrum_index":54742},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 409.1972 Da; putative annotation: N/A; putative formula: C19H31N5OS2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":560.257,"smiles":null,"spectrum_id":"CCMSLIB00017321283","spectrum_index":54743},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 31.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":197.117,"smiles":null,"spectrum_id":"CCMSLIB00017321284","spectrum_index":54744},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Aminodesacetoxycephalosporanic acid (delta mass: 204.1247 Da; putative annotation: N/A; putative formula: C8H12N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.173,"smiles":null,"spectrum_id":"CCMSLIB00017321285","spectrum_index":54745},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 72.0397 Da; putative annotation: N/A; putative formula: C4H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":385.183,"smiles":null,"spectrum_id":"CCMSLIB00017321286","spectrum_index":54746},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl)propane-1,2-diol (delta mass: 80.0442 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":356.167,"smiles":null,"spectrum_id":"CCMSLIB00017321287","spectrum_index":54747},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 58.0775 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.179,"smiles":null,"spectrum_id":"CCMSLIB00017321288","spectrum_index":54748},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Fluoro-1H-indazole-3-carboxylic acid (delta mass: 286.0776 Da; putative annotation: N/A; putative formula: C15H14N2O2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.118,"smiles":null,"spectrum_id":"CCMSLIB00017321289","spectrum_index":54749},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 50.0368 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.206,"smiles":null,"spectrum_id":"CCMSLIB00017321290","spectrum_index":54750},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 588.1488 Da; putative annotation: N/A; putative formula: C29H32O9S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":751.209,"smiles":null,"spectrum_id":"CCMSLIB00017321291","spectrum_index":54751},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid (delta mass: 198.1048 Da; putative annotation: N/A; putative formula: C7H14N6O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":395.17,"smiles":null,"spectrum_id":"CCMSLIB00017321292","spectrum_index":54752},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(1,3-Benzodioxol-5-yl)ethylamine (delta mass: 17.0306 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":183.117,"smiles":null,"spectrum_id":"CCMSLIB00017321293","spectrum_index":54753},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-amine (delta mass: 259.239 Da; putative annotation: N/A; putative formula: C12H29N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.362,"smiles":null,"spectrum_id":"CCMSLIB00017321294","spectrum_index":54754},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Nitro-1H-indole-2-carboxylic acid (delta mass: 10.046 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":217.086,"smiles":null,"spectrum_id":"CCMSLIB00017321295","spectrum_index":54755},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 408.2667 Da; putative annotation: N/A; putative formula: C27H36O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":615.353,"smiles":null,"spectrum_id":"CCMSLIB00017321296","spectrum_index":54756},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 121.0527 Da; putative annotation: N/A; putative formula: C7H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":404.222,"smiles":null,"spectrum_id":"CCMSLIB00017321297","spectrum_index":54757},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 12.9145 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.063,"smiles":null,"spectrum_id":"CCMSLIB00017321298","spectrum_index":54758},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Phenylpiperazine (delta mass: 74.0253 Da; putative annotation: N/A; putative formula: C5H2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":237.148,"smiles":null,"spectrum_id":"CCMSLIB00017321299","spectrum_index":54759},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of OCTOPAMINE (delta mass: 389.5561 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":543.642,"smiles":null,"spectrum_id":"CCMSLIB00017321300","spectrum_index":54760},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methyl-1H,2H-[1,2,4]triazolo[4,3-a]quinolin-1-one (delta mass: 76.0197 Da; putative annotation: N/A; putative formula: CH5N2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.102,"smiles":null,"spectrum_id":"CCMSLIB00017321301","spectrum_index":54761},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(4-Chlorophenoxy)-N-[2-(dimethylamino)ethyl]-2-methylpropanamide (delta mass: 112.1219 Da; putative annotation: N/A; putative formula: C8H16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":397.258,"smiles":null,"spectrum_id":"CCMSLIB00017321302","spectrum_index":54762},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 118.0418 Da; putative annotation: N/A; putative formula: C8H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.112,"smiles":null,"spectrum_id":"CCMSLIB00017321303","spectrum_index":54763},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of putrescine-C6:0 (delta mass: 98.0725 Da; putative annotation: N/A; putative formula: C6H10O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.253,"smiles":null,"spectrum_id":"CCMSLIB00017321304","spectrum_index":54764},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 222.0197 Da; putative annotation: N/A; putative formula: C7H10O6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":480.132,"smiles":null,"spectrum_id":"CCMSLIB00017321305","spectrum_index":54765},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-GLUCOSAMINE 6-PHOSPHATE SODIUM SALT - 30.0 eV (delta mass: 108.0413 Da; putative annotation: N/A; putative formula: C7H8O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.094,"smiles":null,"spectrum_id":"CCMSLIB00017321306","spectrum_index":54766},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydro-6,7-isoquinolinediol (delta mass: 73.0778 Da; putative annotation: N/A; putative formula: CH7N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.164,"smiles":null,"spectrum_id":"CCMSLIB00017321307","spectrum_index":54767},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Endothal (delta mass: 55.9896 Da; putative annotation: N/A; putative formula: C2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":243.05,"smiles":null,"spectrum_id":"CCMSLIB00017321308","spectrum_index":54768},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 205.1678 Da; putative annotation: N/A; putative formula: C11H19N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.233,"smiles":null,"spectrum_id":"CCMSLIB00017321309","spectrum_index":54769},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Isosorbide (delta mass: 293.2348 Da; putative annotation: N/A; putative formula: C18H31NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":440.3,"smiles":null,"spectrum_id":"CCMSLIB00017321310","spectrum_index":54770},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 126.0316 Da; putative annotation: N/A; putative formula: C6H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.144,"smiles":null,"spectrum_id":"CCMSLIB00017321311","spectrum_index":54771},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(4-Hydroxyphenyl)-2-methylaminoethanone (delta mass: 92.0626 Da; putative annotation: N/A; putative formula: C7H8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.149,"smiles":null,"spectrum_id":"CCMSLIB00017321312","spectrum_index":54772},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYLNEURAMINATE - 20.0 eV (delta mass: 737.6355 Da; putative annotation: N/A; putative formula: C45H87NO4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1047.75,"smiles":null,"spectrum_id":"CCMSLIB00017321313","spectrum_index":54773},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-(2,3-Dihydroxy-3-methylbutoxy)-4-methoxy-1-methylquinolin-2(1H)-one (delta mass: 60.073 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.222,"smiles":null,"spectrum_id":"CCMSLIB00017321314","spectrum_index":54774},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of AMP-Deoxynojirimycin (delta mass: 54.0553 Da; putative annotation: N/A; putative formula: C3H6N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":452.345,"smiles":null,"spectrum_id":"CCMSLIB00017321315","spectrum_index":54775},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-4,6-dimethylpyrimidine (delta mass: 18.0105 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":143.081,"smiles":null,"spectrum_id":"CCMSLIB00017321316","spectrum_index":54776},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 45.0179 Da; putative annotation: N/A; putative formula: CH3NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":270.13,"smiles":null,"spectrum_id":"CCMSLIB00017321317","spectrum_index":54777},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 536.3218 Da; putative annotation: N/A; putative formula: C28H48N4O2S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":717.393,"smiles":null,"spectrum_id":"CCMSLIB00017321318","spectrum_index":54778},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 108.0771 Da; putative annotation: N/A; putative formula: C5H8N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":320.169,"smiles":null,"spectrum_id":"CCMSLIB00017321319","spectrum_index":54779},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NCGC00180442-02!2-[(1S)-1-hydroxyethyl]-1H-quinazolin-4-one (delta mass: 541.3193 Da; putative annotation: N/A; putative formula: C35H43NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":732.401,"smiles":null,"spectrum_id":"CCMSLIB00017321320","spectrum_index":54780},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of EPINEPHRINE (delta mass: 81.008 Da; putative annotation: N/A; putative formula: CH-1N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.105,"smiles":null,"spectrum_id":"CCMSLIB00017321321","spectrum_index":54781},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:102040\"\" (delta mass: 88.0736 Da; putative annotation: N/A; putative formula: C2H8N4)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.16,"smiles":null,"spectrum_id":"CCMSLIB00017321322","spectrum_index":54782},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muricarpone B (delta mass: 41.0261 Da; putative annotation: N/A; putative formula: C2H3N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":372.18,"smiles":null,"spectrum_id":"CCMSLIB00017321323","spectrum_index":54783},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 650.3491 Da; putative annotation: N/A; putative formula: C27H50N6O12)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":911.386,"smiles":null,"spectrum_id":"CCMSLIB00017321324","spectrum_index":54784},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galacto-N-biose (delta mass: 188.0801 Da; putative annotation: N/A; putative formula: C7H12N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":572.23,"smiles":null,"spectrum_id":"CCMSLIB00017321325","spectrum_index":54785},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-lactosamine (delta mass: 43.0459 Da; putative annotation: N/A; putative formula: C2H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":427.196,"smiles":null,"spectrum_id":"CCMSLIB00017321326","spectrum_index":54786},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(2,8-Dihydroxyquinolin-5-yl)ethan-1-one (delta mass: 252.0568 Da; putative annotation: N/A; putative formula: C11H12N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":456.122,"smiles":null,"spectrum_id":"CCMSLIB00017321327","spectrum_index":54787},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3,4-Dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one (delta mass: 161.0686 Da; putative annotation: N/A; putative formula: C6H11NO4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":522.233,"smiles":null,"spectrum_id":"CCMSLIB00017321328","spectrum_index":54788},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,7-Dihydroxynaphthalene (delta mass: 44.4403 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":205.5,"smiles":null,"spectrum_id":"CCMSLIB00017321329","spectrum_index":54789},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Haplamine (delta mass: 176.0323 Da; putative annotation: N/A; putative formula: C6H8O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":434.145,"smiles":null,"spectrum_id":"CCMSLIB00017321330","spectrum_index":54790},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydromuronic acid (delta mass: 106.0761 Da; putative annotation: N/A; putative formula: C8H10)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":475.34,"smiles":null,"spectrum_id":"CCMSLIB00017321331","spectrum_index":54791},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Desmethyltapentadol (delta mass: 58.0163 Da; putative annotation: N/A; putative formula: CH2N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.186,"smiles":null,"spectrum_id":"CCMSLIB00017321332","spectrum_index":54792},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aeruginoic acid (delta mass: 44.0626 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":266.085,"smiles":null,"spectrum_id":"CCMSLIB00017321333","spectrum_index":54793},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Monoacetylmorphine (delta mass: 1.9655 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":330.12,"smiles":null,"spectrum_id":"CCMSLIB00017321334","spectrum_index":54794},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyldopa (delta mass: 327.2272 Da; putative annotation: N/A; putative formula: C15H29N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":539.319,"smiles":null,"spectrum_id":"CCMSLIB00017321335","spectrum_index":54795},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 27.0468 Da; putative annotation: N/A; putative formula: C2H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.138,"smiles":null,"spectrum_id":"CCMSLIB00017321336","spectrum_index":54796},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Mannose (delta mass: 318.0011 Da; putative annotation: N/A; putative formula: C14H6O9)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":499.072,"smiles":null,"spectrum_id":"CCMSLIB00017321337","spectrum_index":54797},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid (delta mass: 154.002 Da; putative annotation: N/A; putative formula: C6H6N2O-1S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":406.125,"smiles":null,"spectrum_id":"CCMSLIB00017321338","spectrum_index":54798},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Albuterol (delta mass: 9.0006 Da; putative annotation: N/A; putative formula: C13H18N6O4S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":249.16,"smiles":null,"spectrum_id":"CCMSLIB00017321339","spectrum_index":54799},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol (delta mass: 240.2555 Da; putative annotation: N/A; putative formula: C15H32N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":599.441,"smiles":null,"spectrum_id":"CCMSLIB00017321340","spectrum_index":54800},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 354.1793 Da; putative annotation: N/A; putative formula: C22H26O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":503.26,"smiles":null,"spectrum_id":"CCMSLIB00017321341","spectrum_index":54801},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mirabegron (YM178) (delta mass: 213.0119 Da; putative annotation: N/A; putative formula: C7H8N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":610.181,"smiles":null,"spectrum_id":"CCMSLIB00017321342","spectrum_index":54802},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to D-(+)-Mannose from NIST14 (delta mass: 141.1149 Da; putative annotation: Pregabalin; putative formula: C8H15NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.186,"smiles":null,"spectrum_id":"CCMSLIB00017321343","spectrum_index":54803},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Anhydro-.beta.-D-glucose (delta mass: 94.0417 Da; putative annotation: Hex-3-ynoic acid; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":257.102,"smiles":null,"spectrum_id":"CCMSLIB00017321344","spectrum_index":54804},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 136.0528 Da; putative annotation: 2-Hydroxy-3-methoxybenzenemethanol; putative formula: C8H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":509.217,"smiles":null,"spectrum_id":"CCMSLIB00017321345","spectrum_index":54805},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:RP014502 N-Acetyl-D-Mannosamine|aldehydo-N-acetyl-D-mannosamine|N-[(2R,3S,4R,5S)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide (delta mass: 198.1003 Da; putative annotation: Thr-Pro; putative formula: C9H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":420.198,"smiles":null,"spectrum_id":"CCMSLIB00017321346","spectrum_index":54806},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Mercaptomethylbenzimidazole (delta mass: 80.0691 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.117,"smiles":null,"spectrum_id":"CCMSLIB00017321347","spectrum_index":54807},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-Gentiobiose (delta mass: 124.0673 Da; putative annotation: N/A; putative formula: C11H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.191,"smiles":null,"spectrum_id":"CCMSLIB00017321348","spectrum_index":54808},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100326 gamma-Glu-Cys|L-gamma-Glutamyl-L-cysteine|Des-Gly-glutathione Reduced Form|5-L-Glutamyl-L-cysteine|L-gamma-Glutamylcysteine (delta mass: 119.0043 Da; putative annotation: N/A; putative formula: C3H5NO2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.074,"smiles":null,"spectrum_id":"CCMSLIB00017321349","spectrum_index":54809},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 369.1629 Da; putative annotation: N/A; putative formula: C27H19N3O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":591.26,"smiles":null,"spectrum_id":"CCMSLIB00017321350","spectrum_index":54810},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET020002 CLE_291.1026_12.2|Clensiopenterol|1-(4-amino-3,5-dichlorophenyl)-2-(3-methylbutylamino)ethanol (delta mass: 137.053 Da; putative annotation: N/A; putative formula: CH7N5O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":428.155,"smiles":null,"spectrum_id":"CCMSLIB00017321351","spectrum_index":54811},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asp-Ile-Lys (delta mass: 85.0885 Da; putative annotation: N/A; putative formula: C5H11N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":460.312,"smiles":null,"spectrum_id":"CCMSLIB00017321352","spectrum_index":54812},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Salbutamol (delta mass: 66.048 Da; putative annotation: N/A; putative formula: C5H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":306.207,"smiles":null,"spectrum_id":"CCMSLIB00017321353","spectrum_index":54813},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aaptamine (delta mass: 78.0655 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.163,"smiles":null,"spectrum_id":"CCMSLIB00017321354","spectrum_index":54814},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"2,3,4-trihydrobeta-carbolin-1-one CollisionEnergy:205060\"\" (delta mass: 58.0781 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":245.165,"smiles":null,"spectrum_id":"CCMSLIB00017321355","spectrum_index":54815},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-ACETYL-D-GLUCOSAMINE (delta mass: 79.042 Da; putative annotation: N/A; putative formula: C5H5N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.139,"smiles":null,"spectrum_id":"CCMSLIB00017321356","spectrum_index":54816},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DL-Norepinephrine (delta mass: 130.0588 Da; putative annotation: N/A; putative formula: C2H6N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":300.14,"smiles":null,"spectrum_id":"CCMSLIB00017321357","spectrum_index":54817},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 179.1157 Da; putative annotation: N/A; putative formula: C8H13N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.175,"smiles":null,"spectrum_id":"CCMSLIB00017321358","spectrum_index":54818},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Benzeneethanamine, 2,5-dimethoxy-3,4-dimethyl- (delta mass: 81.0457 Da; putative annotation: N/A; putative formula: C2H3N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.195,"smiles":null,"spectrum_id":"CCMSLIB00017321359","spectrum_index":54819},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:CE000236 Mannitol (delta mass: 176.1565 Da; putative annotation: N/A; putative formula: C13H20)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":359.243,"smiles":null,"spectrum_id":"CCMSLIB00017321360","spectrum_index":54820},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Asparagine propyl ester (delta mass: 96.9672 Da; putative annotation: N/A; putative formula: C3HNO-1P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":272.075,"smiles":null,"spectrum_id":"CCMSLIB00017321361","spectrum_index":54821},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1234.6325 Da; putative annotation: N/A; putative formula: C70H90N8O8S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1577.76,"smiles":null,"spectrum_id":"CCMSLIB00017321362","spectrum_index":54822},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 149.1248 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":422.251,"smiles":null,"spectrum_id":"CCMSLIB00017321363","spectrum_index":54823},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 67.0786 Da; putative annotation: N/A; putative formula: C5H9NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.154,"smiles":null,"spectrum_id":"CCMSLIB00017321364","spectrum_index":54824},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylquinolin-4-ol (delta mass: 42.0109 Da; putative annotation: N/A; putative formula: C2H2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":202.087,"smiles":null,"spectrum_id":"CCMSLIB00017321365","spectrum_index":54825},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of SYNEPHRINE (delta mass: 10.1661 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.268,"smiles":null,"spectrum_id":"CCMSLIB00017321366","spectrum_index":54826},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2(1H)-Quinolinone, 7-[3-[4-(2,3-dimethylphenyl)-1-piperazinyl]propoxy]- (delta mass: 78.0507 Da; putative annotation: N/A; putative formula: C6H6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":470.284,"smiles":null,"spectrum_id":"CCMSLIB00017321367","spectrum_index":54827},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Galactosamine (delta mass: 96.0212 Da; putative annotation: N/A; putative formula: C5H4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":276.108,"smiles":null,"spectrum_id":"CCMSLIB00017321368","spectrum_index":54828},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosaminitol (delta mass: 126.0081 Da; putative annotation: N/A; putative formula: C5H-2N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":350.121,"smiles":null,"spectrum_id":"CCMSLIB00017321369","spectrum_index":54829},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Melibiose (delta mass: 202.0415 Da; putative annotation: N/A; putative formula: C7H10N2O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":545.165,"smiles":null,"spectrum_id":"CCMSLIB00017321370","spectrum_index":54830},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:ET020002 CLE_291.1026_12.2|Clensiopenterol|1-(4-amino-3,5-dichlorophenyl)-2-(3-methylbutylamino)ethanol (delta mass: 176.0422 Da; putative annotation: N/A; putative formula: C2N12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":467.145,"smiles":null,"spectrum_id":"CCMSLIB00017321371","spectrum_index":54831},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,7-Difluoro-1H-indole-2-carboxylic acid (delta mass: 538.1553 Da; putative annotation: N/A; putative formula: C25H27N6O4PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":736.191,"smiles":null,"spectrum_id":"CCMSLIB00017321372","spectrum_index":54832},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Coelonin (delta mass: 35.0372 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.139,"smiles":null,"spectrum_id":"CCMSLIB00017321373","spectrum_index":54833},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 174.0525 Da; putative annotation: N/A; putative formula: C7H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.112,"smiles":null,"spectrum_id":"CCMSLIB00017321374","spectrum_index":54834},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-(2-Phenylethyl)thiourea (delta mass: 13.9206 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":195.0,"smiles":null,"spectrum_id":"CCMSLIB00017321375","spectrum_index":54835},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sotalol (delta mass: 42.1257 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.252,"smiles":null,"spectrum_id":"CCMSLIB00017321376","spectrum_index":54836},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 298.069 Da; putative annotation: N/A; putative formula: C13H14O8)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":459.129,"smiles":null,"spectrum_id":"CCMSLIB00017321377","spectrum_index":54837},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-3-acetic acid (delta mass: 192.1205 Da; putative annotation: N/A; putative formula: C6H16N4O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":368.191,"smiles":null,"spectrum_id":"CCMSLIB00017321378","spectrum_index":54838},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Maltitol (delta mass: 140.0083 Da; putative annotation: N/A; putative formula: C2N6O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":485.147,"smiles":null,"spectrum_id":"CCMSLIB00017321379","spectrum_index":54839},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one (delta mass: 334.2047 Da; putative annotation: N/A; putative formula: C22H26N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.353,"smiles":null,"spectrum_id":"CCMSLIB00017321380","spectrum_index":54840},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Carpinontriol B (delta mass: 174.1744 Da; putative annotation: N/A; putative formula: C14H22O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":519.308,"smiles":null,"spectrum_id":"CCMSLIB00017321381","spectrum_index":54841},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Deoxygalactonojirimycin (delta mass: 145.0417 Da; putative annotation: N/A; putative formula: C3H7N5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":309.133,"smiles":null,"spectrum_id":"CCMSLIB00017321382","spectrum_index":54842},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 341.2216 Da; putative annotation: N/A; putative formula: C19H27N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":506.297,"smiles":null,"spectrum_id":"CCMSLIB00017321383","spectrum_index":54843},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bicyclo[3.1.1]hept-2-ene-2-methanol, 4-[4-(1,1-dimethylheptyl)-2,6-dimethoxyphenyl]-6,6-dimethyl-, (1R,4R,5R)-rel-(+)- (delta mass: 27.0316 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.352,"smiles":null,"spectrum_id":"CCMSLIB00017321384","spectrum_index":54844},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Ethyl-N-(3-methylphenyl)ethane-1,2-diamine (delta mass: 126.0824 Da; putative annotation: N/A; putative formula: C11H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":305.237,"smiles":null,"spectrum_id":"CCMSLIB00017321385","spectrum_index":54845},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 114.0434 Da; putative annotation: N/A; putative formula: C4H6N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":789.289,"smiles":null,"spectrum_id":"CCMSLIB00017321386","spectrum_index":54846},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 611.2066 Da; putative annotation: N/A; putative formula: C27H38N3O9PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":954.33,"smiles":null,"spectrum_id":"CCMSLIB00017321387","spectrum_index":54847},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 266.1115 Da; putative annotation: N/A; putative formula: C9H18N2O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.281,"smiles":null,"spectrum_id":"CCMSLIB00017321388","spectrum_index":54848},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:AU217808 Dihydrocodeine|(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-ol (delta mass: 502.1842 Da; putative annotation: N/A; putative formula: C21H27N8O5P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.359,"smiles":null,"spectrum_id":"CCMSLIB00017321389","spectrum_index":54849},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 156.1513 Da; putative annotation: N/A; putative formula: C10H20O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.227,"smiles":null,"spectrum_id":"CCMSLIB00017321390","spectrum_index":54850},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetylneuraminic acid (delta mass: 326.704 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":636.817,"smiles":null,"spectrum_id":"CCMSLIB00017321391","spectrum_index":54851},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-4-((7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-(3-(methylthio)phenyl)butanamide (delta mass: 88.0586 Da; putative annotation: N/A; putative formula: C3H9N2O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":680.306,"smiles":null,"spectrum_id":"CCMSLIB00017321392","spectrum_index":54852},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 664.3658 Da; putative annotation: N/A; putative formula: C36H58O7P2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":925.403,"smiles":null,"spectrum_id":"CCMSLIB00017321393","spectrum_index":54853},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE CollisionEnergy:102040 (delta mass: 107.0735 Da; putative annotation: N/A; putative formula: C7H9N)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.165,"smiles":null,"spectrum_id":"CCMSLIB00017321394","spectrum_index":54854},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Diprotin B (delta mass: 218.1053 Da; putative annotation: N/A; putative formula: C12H14N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":546.328,"smiles":null,"spectrum_id":"CCMSLIB00017321395","spectrum_index":54855},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 46.0581 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":211.134,"smiles":null,"spectrum_id":"CCMSLIB00017321396","spectrum_index":54856},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 342.118 Da; putative annotation: N/A; putative formula: C15H25N2OP3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":685.242,"smiles":null,"spectrum_id":"CCMSLIB00017321397","spectrum_index":54857},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHYL-2-OXINDOLE - 70.0 eV (delta mass: 30.0633 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":178.139,"smiles":null,"spectrum_id":"CCMSLIB00017321398","spectrum_index":54858},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Methyl 4-fluoro-1H-pyrrole-2-carboxylate (delta mass: 29.0725 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":173.118,"smiles":null,"spectrum_id":"CCMSLIB00017321399","spectrum_index":54859},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .beta.-D-Allose (delta mass: 332.014 Da; putative annotation: N/A; putative formula: C11H4N6O7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":513.085,"smiles":null,"spectrum_id":"CCMSLIB00017321400","spectrum_index":54860},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:EQ371607 2-Naphthoxyacetic acid|beta-Naphthoxyacetic acid|(2-Naphthyloxy)acetic acid (delta mass: 24.0177 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.088,"smiles":null,"spectrum_id":"CCMSLIB00017321401","spectrum_index":54861},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:LU087706 2-Naphthalenol|2-Naphthol|naphthalen-2-ol (delta mass: 215.1522 Da; putative annotation: N/A; putative formula: C11H21NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.217,"smiles":null,"spectrum_id":"CCMSLIB00017321402","spectrum_index":54862},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Methyltetrahydro-2H-pyran-2,4,5-triol (delta mass: 76.0304 Da; putative annotation: N/A; putative formula: H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.111,"smiles":null,"spectrum_id":"CCMSLIB00017321403","spectrum_index":54863},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Naphthol (delta mass: 40.4607 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":185.525,"smiles":null,"spectrum_id":"CCMSLIB00017321404","spectrum_index":54864},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Ractopamine (delta mass: 17.0514 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":319.227,"smiles":null,"spectrum_id":"CCMSLIB00017321405","spectrum_index":54865},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of DOPAMINE (delta mass: 174.05 Da; putative annotation: N/A; putative formula: C3H6N6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.136,"smiles":null,"spectrum_id":"CCMSLIB00017321406","spectrum_index":54866},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5,11-Dihydro-16H-benzo[a]carbazole (delta mass: 13.0215 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":233.134,"smiles":null,"spectrum_id":"CCMSLIB00017321407","spectrum_index":54867},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"3,4-DIHYDROXYPHENYLGLYCOL\"\" (delta mass: 22.9084 Da; putative annotation: N/A; putative formula: N/A)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":193.974,"smiles":null,"spectrum_id":"CCMSLIB00017321408","spectrum_index":54868},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,6-Dihydroxynaphthalene (delta mass: 42.0824 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":203.142,"smiles":null,"spectrum_id":"CCMSLIB00017321409","spectrum_index":54869},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Deoxy-D-ribose (delta mass: 64.0678 Da; putative annotation: N/A; putative formula: C6H8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":199.133,"smiles":null,"spectrum_id":"CCMSLIB00017321410","spectrum_index":54870},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Tetrahydrocurcumin (delta mass: 132.0197 Da; putative annotation: N/A; putative formula: C2H5N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":505.184,"smiles":null,"spectrum_id":"CCMSLIB00017321411","spectrum_index":54871},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3S_2349_Tetrahydro_1h_pyrido_34b_indole_carboxylic_acid (delta mass: 58.0419 Da; putative annotation: N/A; putative formula: C3H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":275.139,"smiles":null,"spectrum_id":"CCMSLIB00017321412","spectrum_index":54872},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 8-Methoxy-4-methyl-2(1H)-quinolinone (delta mass: 45.0677 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":235.154,"smiles":null,"spectrum_id":"CCMSLIB00017321413","spectrum_index":54873},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 231.0888 Da; putative annotation: N/A; putative formula: C7H14N5O2P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.175,"smiles":null,"spectrum_id":"CCMSLIB00017321414","spectrum_index":54874},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Cellobiose (delta mass: 78.0833 Da; putative annotation: N/A; putative formula: C7H10O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":421.207,"smiles":null,"spectrum_id":"CCMSLIB00017321415","spectrum_index":54875},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H,2H,3H,4H,5H-[1,4]Diazepino[1,2-a]indole (delta mass: 306.2307 Da; putative annotation: N/A; putative formula: C18H30N2O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":493.354,"smiles":null,"spectrum_id":"CCMSLIB00017321416","spectrum_index":54876},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Serotonin (delta mass: 424.3696 Da; putative annotation: N/A; putative formula: C24H49N4P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":601.472,"smiles":null,"spectrum_id":"CCMSLIB00017321417","spectrum_index":54877},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Naphthoic acid (delta mass: 226.108 Da; putative annotation: N/A; putative formula: C10H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":399.168,"smiles":null,"spectrum_id":"CCMSLIB00017321418","spectrum_index":54878},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,5S)-9-Methyl-9-azabicyclo[3.3.1]nonan-3-amine (delta mass: 16.9425 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":172.097,"smiles":null,"spectrum_id":"CCMSLIB00017321419","spectrum_index":54879},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Dihydroxynaphthalene (delta mass: 58.0622 Da; putative annotation: N/A; putative formula: CH6N4O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":219.122,"smiles":null,"spectrum_id":"CCMSLIB00017321420","spectrum_index":54880},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Massbank:PR100091 3,4-Dihydroxy-L-phenylalanine|L-DOPA|L-3-Hydroxytyrosine|Levodopa|3-(3,4-Dihydroxyphenyl)-L-alanine|DOPA (delta mass: 181.0402 Da; putative annotation: N/A; putative formula: C7H8N3OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.116,"smiles":null,"spectrum_id":"CCMSLIB00017321421","spectrum_index":54881},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Pancracine (delta mass: 28.1612 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":316.284,"smiles":null,"spectrum_id":"CCMSLIB00017321422","spectrum_index":54882},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Escaline (delta mass: 120.0578 Da; putative annotation: N/A; putative formula: C8H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":346.202,"smiles":null,"spectrum_id":"CCMSLIB00017321423","spectrum_index":54883},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-(+)-Threose (delta mass: 144.0419 Da; putative annotation: N/A; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":265.091,"smiles":null,"spectrum_id":"CCMSLIB00017321424","spectrum_index":54884},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3'-.alpha.-Sialyl-N-acetyllactosamine (delta mass: 791.6684 Da; putative annotation: N/A; putative formula: C48H89NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1466.91,"smiles":null,"spectrum_id":"CCMSLIB00017321425","spectrum_index":54885},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-Rhamnose (delta mass: 433.1379 Da; putative annotation: N/A; putative formula: C24H24N3OPS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":598.214,"smiles":null,"spectrum_id":"CCMSLIB00017321426","spectrum_index":54886},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4,6-O-Ethylidene-.alpha.-D-glucopyranoside (delta mass: 412.2976 Da; putative annotation: N/A; putative formula: C27H40O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":619.384,"smiles":null,"spectrum_id":"CCMSLIB00017321427","spectrum_index":54887},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 123.0684 Da; putative annotation: N/A; putative formula: C7H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":307.165,"smiles":null,"spectrum_id":"CCMSLIB00017321428","spectrum_index":54888},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Etilefrine (delta mass: 8.9891 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":191.107,"smiles":null,"spectrum_id":"CCMSLIB00017321429","spectrum_index":54889},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-(+)-Arabitol (delta mass: 164.0993 Da; putative annotation: N/A; putative formula: C14H12O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":317.175,"smiles":null,"spectrum_id":"CCMSLIB00017321430","spectrum_index":54890},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-Aminopenicillanic acid (delta mass: 62.0451 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":279.109,"smiles":null,"spectrum_id":"CCMSLIB00017321431","spectrum_index":54891},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9-Phenanthrol (delta mass: 12.9976 Da; putative annotation: N/A; putative formula: C22H32N8O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":208.078,"smiles":null,"spectrum_id":"CCMSLIB00017321432","spectrum_index":54892},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Yashabushiketol (delta mass: 98.0215 Da; putative annotation: N/A; putative formula: C2H2N4O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":379.175,"smiles":null,"spectrum_id":"CCMSLIB00017321433","spectrum_index":54893},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-MANNOSAMINE (delta mass: 109.0567 Da; putative annotation: N/A; putative formula: C6H7NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":289.143,"smiles":null,"spectrum_id":"CCMSLIB00017321434","spectrum_index":54894},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Anolobine (delta mass: 97.9975 Da; putative annotation: N/A; putative formula: H-2N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":380.11,"smiles":null,"spectrum_id":"CCMSLIB00017321435","spectrum_index":54895},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Gluconic acid, .delta.-lactone (delta mass: 164.0111 Da; putative annotation: N/A; putative formula: C8H4O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":343.066,"smiles":null,"spectrum_id":"CCMSLIB00017321436","spectrum_index":54896},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of trans,cis-3,6-Nonadien-1-ol (delta mass: 167.0238 Da; putative annotation: N/A; putative formula: C8HN5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.151,"smiles":null,"spectrum_id":"CCMSLIB00017321437","spectrum_index":54897},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-galactosamine (delta mass: 9.9843 Da; putative annotation: N/A; putative formula: C15H24N4O3S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":232.081,"smiles":null,"spectrum_id":"CCMSLIB00017321438","spectrum_index":54898},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-METHOXY-L-TYROSINE - 20.0 eV (delta mass: 83.0088 Da; putative annotation: N/A; putative formula: C2HN3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":295.1,"smiles":null,"spectrum_id":"CCMSLIB00017321439","spectrum_index":54899},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 221.1265 Da; putative annotation: N/A; putative formula: C9H19NO5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":504.296,"smiles":null,"spectrum_id":"CCMSLIB00017321440","spectrum_index":54900},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Lincomycin (delta mass: 65.059 Da; putative annotation: N/A; putative formula: C5H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":472.28,"smiles":null,"spectrum_id":"CCMSLIB00017321441","spectrum_index":54901},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adenosine 3'-monophosphate (delta mass: 11.9996 Da; putative annotation: N/A; putative formula: C)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":360.07,"smiles":null,"spectrum_id":"CCMSLIB00017321442","spectrum_index":54902},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to N-Acetyl-D-glucosamine from NIST14 (delta mass: 861.0671 Da; putative annotation: N/A; putative formula: C38H23NO23)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1083.16,"smiles":null,"spectrum_id":"CCMSLIB00017321443","spectrum_index":54903},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (2R)-8-Ethyl-7-hydroxy-5-methoxy-2-methyl-2,3-dihydrochromen-4-one (delta mass: 176.0828 Da; putative annotation: N/A; putative formula: C5H13N4OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":413.195,"smiles":null,"spectrum_id":"CCMSLIB00017321444","spectrum_index":54904},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydrolycorine (delta mass: 257.2233 Da; putative annotation: N/A; putative formula: C12H27N5O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":547.362,"smiles":null,"spectrum_id":"CCMSLIB00017321445","spectrum_index":54905},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Imipenem (delta mass: 77.058 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":377.159,"smiles":null,"spectrum_id":"CCMSLIB00017321446","spectrum_index":54906},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Oxycodone (delta mass: 16.9085 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":333.063,"smiles":null,"spectrum_id":"CCMSLIB00017321447","spectrum_index":54907},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of INDOLE-3-ETHANOL (delta mass: 173.0942 Da; putative annotation: N/A; putative formula: C10H11N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":335.185,"smiles":null,"spectrum_id":"CCMSLIB00017321448","spectrum_index":54908},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 94.0418 Da; putative annotation: N/A; putative formula: C6H6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":258.134,"smiles":null,"spectrum_id":"CCMSLIB00017321449","spectrum_index":54909},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,2,3,4-Tetrahydroisoquinoline-6-carboxylic acid (delta mass: 89.9699 Da; putative annotation: N/A; putative formula: H-2N2O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":268.056,"smiles":null,"spectrum_id":"CCMSLIB00017321450","spectrum_index":54910},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Paprotrain (delta mass: 45.0302 Da; putative annotation: N/A; putative formula: H3N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":291.133,"smiles":null,"spectrum_id":"CCMSLIB00017321451","spectrum_index":54911},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Perseitol (delta mass: 26.0307 Da; putative annotation: N/A; putative formula: CH2N2O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":239.128,"smiles":null,"spectrum_id":"CCMSLIB00017321452","spectrum_index":54912},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4-Methyl-2-oxo-1(2H)-quinolinyl)acetic acid (delta mass: 137.0486 Da; putative annotation: N/A; putative formula: C7H7NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":355.13,"smiles":null,"spectrum_id":"CCMSLIB00017321453","spectrum_index":54913},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3-Methoxy-5-pentyl-2-prenylphenol (delta mass: 88.0522 Da; putative annotation: N/A; putative formula: C4H8O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":351.253,"smiles":null,"spectrum_id":"CCMSLIB00017321454","spectrum_index":54914},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"\"Conjugate of \"\"N-(2,5-dimethoxyphenyl)-2-[2-oxo-4-(2-1,2,3,4-tetrahydroisoquinolylcarbonyl)hy droquinolyl]acetamide CollisionEnergy:102040\"\" (delta mass: 152.0688 Da; putative annotation: N/A; putative formula: C6H8N4O)\"","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":650.271,"smiles":null,"spectrum_id":"CCMSLIB00017321455","spectrum_index":54915},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Antibiotic WB (delta mass: 74.0597 Da; putative annotation: N/A; putative formula: CH6N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":461.217,"smiles":null,"spectrum_id":"CCMSLIB00017321456","spectrum_index":54916},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 268.1314 Da; putative annotation: N/A; putative formula: C14H20O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":419.191,"smiles":null,"spectrum_id":"CCMSLIB00017321457","spectrum_index":54917},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6.beta.-Naltrexol (delta mass: 346.2484 Da; putative annotation: N/A; putative formula: C18H30N6O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":690.434,"smiles":null,"spectrum_id":"CCMSLIB00017321458","spectrum_index":54918},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Corypalline (delta mass: 30.9955 Da; putative annotation: N/A; putative formula: H2NO-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":225.113,"smiles":null,"spectrum_id":"CCMSLIB00017321459","spectrum_index":54919},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Chloro-1H-pyrrole-2-carboxylic acid (delta mass: 31.9794 Da; putative annotation: N/A; putative formula: HP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":177.98,"smiles":null,"spectrum_id":"CCMSLIB00017321460","spectrum_index":54920},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Pentadien-3-one, 1,5-bis(2-hydroxyphenyl)-, (1E,4E)- (delta mass: 335.2277 Da; putative annotation: N/A; putative formula: C20H33NOS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":602.329,"smiles":null,"spectrum_id":"CCMSLIB00017321461","spectrum_index":54921},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Dihydroyashabushiketol (delta mass: 159.1307 Da; putative annotation: N/A; putative formula: C7H18N3O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":442.3,"smiles":null,"spectrum_id":"CCMSLIB00017321462","spectrum_index":54922},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D(+)-Glucuronic acid .gamma.-lactone (delta mass: 152.0474 Da; putative annotation: N/A; putative formula: C8H8O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.087,"smiles":null,"spectrum_id":"CCMSLIB00017321463","spectrum_index":54923},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 116.0838 Da; putative annotation: N/A; putative formula: C6H12O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":340.212,"smiles":null,"spectrum_id":"CCMSLIB00017321464","spectrum_index":54924},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 89.0566 Da; putative annotation: N/A; putative formula: C2H7N3O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":244.154,"smiles":null,"spectrum_id":"CCMSLIB00017321465","spectrum_index":54925},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Amino-2-deoxy-D-glucopyranose (delta mass: 198.1008 Da; putative annotation: N/A; putative formula: C9H14N2O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":378.187,"smiles":null,"spectrum_id":"CCMSLIB00017321466","spectrum_index":54926},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-[2-(2-Fluorophenyl)ethyl]hydrazine (delta mass: 86.0573 Da; putative annotation: N/A; putative formula: C5H10O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.155,"smiles":null,"spectrum_id":"CCMSLIB00017321467","spectrum_index":54927},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,7-Dihydroxy-2-naphthoic acid (delta mass: 139.9745 Da; putative annotation: N/A; putative formula: C5O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.024,"smiles":null,"spectrum_id":"CCMSLIB00017321468","spectrum_index":54928},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.alpha.,6.alpha.-Mannotriose (delta mass: 299.2785 Da; putative annotation: D-ribo-Phytosphingosine; putative formula: C18H37NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":804.455,"smiles":null,"spectrum_id":"CCMSLIB00017321469","spectrum_index":54929},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Hydroxy-6-methylquinoline-3-carbaldehyde (delta mass: 141.0438 Da; putative annotation: (.alpha.S,1S,2R)-.alpha.-Amino-2-carboxycyclopropaneacetic acid; putative formula: C6H7NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":329.114,"smiles":null,"spectrum_id":"CCMSLIB00017321470","spectrum_index":54930},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Quinolin-2-ol (delta mass: 155.0591 Da; putative annotation: (1S,3R)-1-Aminocyclopentane-1,3-dicarboxylic acid; putative formula: C7H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":301.119,"smiles":null,"spectrum_id":"CCMSLIB00017321471","spectrum_index":54931},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Norepinephrine (delta mass: 53.063 Da; putative annotation: Pyrrolidine; putative formula: C4H7NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":223.144,"smiles":null,"spectrum_id":"CCMSLIB00017321472","spectrum_index":54932},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-Deoxynojirimycin (delta mass: 162.053 Da; putative annotation: D-Psicose; putative formula: C6H10O5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":326.145,"smiles":null,"spectrum_id":"CCMSLIB00017321473","spectrum_index":54933},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 144.0423 Da; putative annotation: Spectral Match to .beta.-D-Glucopyranose, 1,6-anhydro- from NIST14; putative formula: C6H8O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":328.139,"smiles":null,"spectrum_id":"CCMSLIB00017321474","spectrum_index":54934},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Spectral Match to Sucrose from NIST14 (delta mass: 306.0899 Da; putative annotation: 4'-Hydroxywarfarin; putative formula: C19H14O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":649.213,"smiles":null,"spectrum_id":"CCMSLIB00017321475","spectrum_index":54935},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sedoheptulosan (delta mass: 850.4343 Da; putative annotation: NCGC00347384-02_C44H68O17_(1beta,3alpha,9xi,14xi)-1-Hydroxyspirosta-5,25(27)-dien-3-yl beta-D-glucopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->2)-(3xi)-alpha-D-threo-pentopyranoside; putative formula: C44H66O16)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1043.51,"smiles":null,"spectrum_id":"CCMSLIB00017321476","spectrum_index":54936},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of allo-Protolichesterinic acid (delta mass: 439.2927 Da; putative annotation: Agelasine (Stereochemistry Of Diterpene Unknown); putative formula: C26H38ClN5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":764.53,"smiles":null,"spectrum_id":"CCMSLIB00017321477","spectrum_index":54937},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Aminoindan (delta mass: 169.1348 Da; putative annotation: N/A; putative formula: C7H15N5)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":303.231,"smiles":null,"spectrum_id":"CCMSLIB00017321478","spectrum_index":54938},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone (delta mass: 322.1418 Da; putative annotation: N/A; putative formula: C12H19N8OP)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":667.312,"smiles":null,"spectrum_id":"CCMSLIB00017321479","spectrum_index":54939},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,7-Bis(3,4-dihydroxyphenyl)-6-hydroxyheptan-3-one (delta mass: 64.052 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":411.201,"smiles":null,"spectrum_id":"CCMSLIB00017321480","spectrum_index":54940},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Fumaricin (delta mass: 218.1714 Da; putative annotation: N/A; putative formula: C9H22N4O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":588.336,"smiles":null,"spectrum_id":"CCMSLIB00017321481","spectrum_index":54941},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MassbankEU:UA004403 1-hydroxypyrene|pyren-1-ol (delta mass: 23.018 Da; putative annotation: N/A; putative formula: C2HNO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":242.098,"smiles":null,"spectrum_id":"CCMSLIB00017321482","spectrum_index":54942},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Psicose (delta mass: 166.1145 Da; putative annotation: N/A; putative formula: C14H14O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":347.185,"smiles":null,"spectrum_id":"CCMSLIB00017321483","spectrum_index":54943},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GALACTOSAMINE (delta mass: 353.0603 Da; putative annotation: N/A; putative formula: C12H19NO7S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":533.147,"smiles":null,"spectrum_id":"CCMSLIB00017321484","spectrum_index":54944},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Mescaline (delta mass: 133.0819 Da; putative annotation: N/A; putative formula: C4H11N3O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":345.21,"smiles":null,"spectrum_id":"CCMSLIB00017321485","spectrum_index":54945},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 142.1073 Da; putative annotation: N/A; putative formula: C3H10N8O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":483.263,"smiles":null,"spectrum_id":"CCMSLIB00017321486","spectrum_index":54946},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of GLUCOSE 1-PHOSPHATE (delta mass: 102.0458 Da; putative annotation: N/A; putative formula: C2H7N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":363.083,"smiles":null,"spectrum_id":"CCMSLIB00017321487","spectrum_index":54947},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Naphthoresorcinol (delta mass: 20.0613 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":181.121,"smiles":null,"spectrum_id":"CCMSLIB00017321488","spectrum_index":54948},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Citrinin (delta mass: 48.0186 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.11,"smiles":null,"spectrum_id":"CCMSLIB00017321489","spectrum_index":54949},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-[3-(Dimethylamino)propyl]piperidine-4-carboxamide (delta mass: 27.0363 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":241.228,"smiles":null,"spectrum_id":"CCMSLIB00017321490","spectrum_index":54950},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of .alpha.-D-(+)-Talose (delta mass: 39.048 Da; putative annotation: N/A; putative formula: C3H5NO-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":220.119,"smiles":null,"spectrum_id":"CCMSLIB00017321491","spectrum_index":54951},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,4-Anhydroerythritol (delta mass: 303.1835 Da; putative annotation: N/A; putative formula: C18H25NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":408.238,"smiles":null,"spectrum_id":"CCMSLIB00017321492","spectrum_index":54952},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-QUINOLINECARBOXYLIC ACID (delta mass: 228.1857 Da; putative annotation: N/A; putative formula: C11H25N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":402.241,"smiles":null,"spectrum_id":"CCMSLIB00017321493","spectrum_index":54953},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 312.0657 Da; putative annotation: N/A; putative formula: C8H17N4O5PS)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":607.168,"smiles":null,"spectrum_id":"CCMSLIB00017321494","spectrum_index":54954},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Girinimbine (delta mass: 43.9978 Da; putative annotation: N/A; putative formula: N2O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":308.136,"smiles":null,"spectrum_id":"CCMSLIB00017321495","spectrum_index":54955},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-Methylindoline (delta mass: 114.0683 Da; putative annotation: N/A; putative formula: C6H10O2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":248.165,"smiles":null,"spectrum_id":"CCMSLIB00017321496","spectrum_index":54956},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 6-(Acetyloxy)-2-naphthoic acid (delta mass: 90.0316 Da; putative annotation: N/A; putative formula: C3H6O3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":321.097,"smiles":null,"spectrum_id":"CCMSLIB00017321497","spectrum_index":54957},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Cephradine (delta mass: 17.0314 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":367.148,"smiles":null,"spectrum_id":"CCMSLIB00017321498","spectrum_index":54958},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,6-Dihydroxynaphthalene (delta mass: 256.0589 Da; putative annotation: N/A; putative formula: C4H12N6O5S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":417.119,"smiles":null,"spectrum_id":"CCMSLIB00017321499","spectrum_index":54959},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1-(3-Phenyl-6,7-dihydro-2H-pyrazolo[4,3-c]pyridin-5(4H)-yl)propan-1-one (delta mass: 66.0529 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":322.197,"smiles":null,"spectrum_id":"CCMSLIB00017321500","spectrum_index":54960},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-4-carbonitrile (delta mass: 140.1151 Da; putative annotation: N/A; putative formula: C5H12N6O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":283.176,"smiles":null,"spectrum_id":"CCMSLIB00017321501","spectrum_index":54961},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisdemethoxycurcumin CollisionEnergy:102040 (delta mass: 291.0947 Da; putative annotation: N/A; putative formula: C16H13N5O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":600.207,"smiles":null,"spectrum_id":"CCMSLIB00017321502","spectrum_index":54962},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 301.1162 Da; putative annotation: N/A; putative formula: C13H19NO7)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":596.219,"smiles":null,"spectrum_id":"CCMSLIB00017321503","spectrum_index":54963},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 4-Cyano-1H-pyrrole-2-carboxylic acid (delta mass: 268.2326 Da; putative annotation: N/A; putative formula: C17H33P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":405.267,"smiles":null,"spectrum_id":"CCMSLIB00017321504","spectrum_index":54964},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Bisindolylmaleimide IV (delta mass: 42.0201 Da; putative annotation: N/A; putative formula: CH2N2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":370.128,"smiles":null,"spectrum_id":"CCMSLIB00017321505","spectrum_index":54965},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (1R,2S)-(-)-3,4-Dihydroxynorephedrine (delta mass: 131.0371 Da; putative annotation: N/A; putative formula: C8H5NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":315.134,"smiles":null,"spectrum_id":"CCMSLIB00017321506","spectrum_index":54966},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of NORMETANEPHRINE (delta mass: 204.1371 Da; putative annotation: N/A; putative formula: C11H16N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":388.234,"smiles":null,"spectrum_id":"CCMSLIB00017321507","spectrum_index":54967},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Aceroside VII (delta mass: 21.2674 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":484.5,"smiles":null,"spectrum_id":"CCMSLIB00017321508","spectrum_index":54968},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 477.1848 Da; putative annotation: N/A; putative formula: C26H23N9O-1S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":699.282,"smiles":null,"spectrum_id":"CCMSLIB00017321509","spectrum_index":54969},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indole-3-carboxylic acid, 1-pentyl- (delta mass: 99.0759 Da; putative annotation: N/A; putative formula: C4H9N3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":331.209,"smiles":null,"spectrum_id":"CCMSLIB00017321510","spectrum_index":54970},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7,8-Dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one (delta mass: 168.0975 Da; putative annotation: N/A; putative formula: C10H16S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":393.21,"smiles":null,"spectrum_id":"CCMSLIB00017321511","spectrum_index":54971},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of L-DOPA methyl ester (delta mass: 18.9938 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":231.085,"smiles":null,"spectrum_id":"CCMSLIB00017321512","spectrum_index":54972},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 7-Methylnaphthalen-2-ol (delta mass: 256.0176 Da; putative annotation: N/A; putative formula: C8H17OPS3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":415.098,"smiles":null,"spectrum_id":"CCMSLIB00017321513","spectrum_index":54973},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (S)-Salsoline (delta mass: 91.0632 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":285.181,"smiles":null,"spectrum_id":"CCMSLIB00017321514","spectrum_index":54974},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Adrenochrome (delta mass: 76.0301 Da; putative annotation: N/A; putative formula: H5N4O-1P)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":256.096,"smiles":null,"spectrum_id":"CCMSLIB00017321515","spectrum_index":54975},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Chitobiose (delta mass: 167.0574 Da; putative annotation: N/A; putative formula: C8H9NO3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":508.213,"smiles":null,"spectrum_id":"CCMSLIB00017321516","spectrum_index":54976},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 9H-Xanthene-4-acetic acid, 5,6-dimethyl-9-oxo- (delta mass: 266.1476 Da; putative annotation: N/A; putative formula: C10H22N2O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":549.244,"smiles":null,"spectrum_id":"CCMSLIB00017321517","spectrum_index":54977},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3.10S-Hydroxypheophorbide a (delta mass: 864.7192 Da; putative annotation: N/A; putative formula: C56H96O6)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1473.99,"smiles":null,"spectrum_id":"CCMSLIB00017321518","spectrum_index":54978},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 370.3076 Da; putative annotation: N/A; putative formula: C22H42O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":631.345,"smiles":null,"spectrum_id":"CCMSLIB00017321519","spectrum_index":54979},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of MANNOSE 6-PHOSPHATE (delta mass: 394.3072 Da; putative annotation: N/A; putative formula: C24H42O4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":655.344,"smiles":null,"spectrum_id":"CCMSLIB00017321520","spectrum_index":54980},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 711.2786 Da; putative annotation: N/A; putative formula: C52H33N5O-1)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1054.4,"smiles":null,"spectrum_id":"CCMSLIB00017321521","spectrum_index":54981},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,4,5-Trimethoxyamphetamine (delta mass: 29.0043 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":255.148,"smiles":null,"spectrum_id":"CCMSLIB00017321522","spectrum_index":54982},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Demethoxycurcumin (delta mass: 64.0523 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":403.175,"smiles":null,"spectrum_id":"CCMSLIB00017321523","spectrum_index":54983},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of D-Lyxose (delta mass: 359.1226 Da; putative annotation: N/A; putative formula: C16H25NO4S2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":510.183,"smiles":null,"spectrum_id":"CCMSLIB00017321524","spectrum_index":54984},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Benzyl-2,2,2-trifluoroethanamine (delta mass: 108.0596 Da; putative annotation: N/A; putative formula: C7H8O)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":298.143,"smiles":null,"spectrum_id":"CCMSLIB00017321525","spectrum_index":54985},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1_prop_2_en_1_yl__1H_indole_3_carboxylic_acid (delta mass: 14.0155 Da; putative annotation: N/A; putative formula: CH2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":216.102,"smiles":null,"spectrum_id":"CCMSLIB00017321526","spectrum_index":54986},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (4R,5S or 4S,5R)-4-hydroxy-5-((?-D-glucopyranosyloxy)methyl)dihydrofuran-2(3H)-one (delta mass: 159.0696 Da; putative annotation: N/A; putative formula: C10H9NO)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":454.172,"smiles":null,"spectrum_id":"CCMSLIB00017321527","spectrum_index":54987},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2-(Benzylamino)-1-phenylethanol (delta mass: 120.0444 Da; putative annotation: N/A; putative formula: C5H4N4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":348.183,"smiles":null,"spectrum_id":"CCMSLIB00017321528","spectrum_index":54988},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of (-)-Epinephrine (delta mass: 442.1496 Da; putative annotation: N/A; putative formula: C21H32O4P2S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":626.246,"smiles":null,"spectrum_id":"CCMSLIB00017321529","spectrum_index":54989},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1,1'-(Ethane-1,2-diyl)bis(5-oxopyrrolidine-3-carboxylic acid) (delta mass: 17.0157 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":302.124,"smiles":null,"spectrum_id":"CCMSLIB00017321530","spectrum_index":54990},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 5-Methoxy-1H-indazole-3-carboxylic acid (delta mass: 28.0563 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":221.117,"smiles":null,"spectrum_id":"CCMSLIB00017321531","spectrum_index":54991},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Sucrose (delta mass: 1026.3504 Da; putative annotation: N/A; putative formula: C72H46N6S)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1369.47,"smiles":null,"spectrum_id":"CCMSLIB00017321532","spectrum_index":54992},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 3,4-Dimethoxymethcathinone (delta mass: 75.0315 Da; putative annotation: N/A; putative formula: C2H5NO2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":299.16,"smiles":null,"spectrum_id":"CCMSLIB00017321533","spectrum_index":54993},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Muramic acid (delta mass: 26.0335 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":278.141,"smiles":null,"spectrum_id":"CCMSLIB00017321534","spectrum_index":54994},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 1H-Indol-2-amine (delta mass: 547.9834 Da; putative annotation: N/A; putative formula: C22H16N2O7S4)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":681.059,"smiles":null,"spectrum_id":"CCMSLIB00017321535","spectrum_index":54995},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Harmol (delta mass: 27.9999 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":227.087,"smiles":null,"spectrum_id":"CCMSLIB00017321536","spectrum_index":54996},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of Indole-6-carboxaldehyde (delta mass: 38.0187 Da; putative annotation: N/A; putative formula: C3H2)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":184.079,"smiles":null,"spectrum_id":"CCMSLIB00017321537","spectrum_index":54997},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of 2,3-Quinoxalinedione, 6-chloro-1,4-dihydro- (delta mass: 15.0258 Da; putative annotation: N/A; putative formula: N/A)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":212.037,"smiles":null,"spectrum_id":"CCMSLIB00017321538","spectrum_index":54998},{"adduct":"[M+H]+","analyzer":null,"charge":1,"chromatography":null,"compound_name":"Conjugate of N-Acetyl-D-Mannosamine (delta mass: 847.2275 Da; putative annotation: N/A; putative formula: C43H41N7O6S3)","exact_mass":0.0,"inchikey":null,"instrument":"Orbitrap","instrument_model":null,"instrument_vendor":null,"ion_mode":"Positive","ion_source":"LC-ESI","ionization":null,"precursor_mz":1069.32,"smiles":null,"spectrum_id":"CCMSLIB00017321539","spectrum_index":54999}]
